data_1pqx_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 1pqx _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 ' 2' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.695 0.283 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 52.6 mt 55.1 101.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.326 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 mm -105.44 -30.06 2.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.486 -179.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 89.0 p . . . . . 0 N--CA 1.463 0.205 0 CA-C-O 121.035 0.445 . . . . 0.0 111.608 -179.874 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.658 0.266 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.413 ' HG1' ' C ' ' A' ' 63' ' ' VAL . 12.5 t -150.14 129.64 13.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.967 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -116.55 154.48 30.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.265 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.05 134.61 37.55 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.937 0.399 . . . . 0.0 110.721 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.4 mt -98.34 123.24 50.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.318 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 86.1 m -85.53 131.47 34.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.002 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.4 mt -101.16 162.17 13.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.363 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 62.2 p -67.5 -5.55 15.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.293 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.714 -179.737 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 21.7 mtp . . . . . 0 CA--C 1.53 0.188 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.4 p -75.47 164.1 26.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.735 0.302 . . . . 0.0 110.537 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.1 p -158.2 101.26 1.73 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.505 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -162.82 160.24 24.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.752 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 m -102.58 135.23 44.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.286 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -119.16 106.57 12.5 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.168 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.88 -3.05 8.19 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.725 -179.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.0 pttt -154.09 34.76 0.43 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.545 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.533 ' CG1' ' H ' ' A' ' 35' ' ' ASP . 17.8 t 51.57 177.93 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.555 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.533 ' H ' ' CG1' ' A' ' 34' ' ' VAL . 12.7 t70 62.52 109.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.846 0.355 . . . . 0.0 110.859 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 175.24 21.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.74 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 p 74.69 18.23 2.79 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.055 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.21 172.07 9.87 Favored Pre-proline 0 C--N 1.332 -0.166 0 N-CA-C 109.929 -0.396 . . . . 0.0 109.929 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -73.11 130.13 14.99 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.519 2.146 . . . . 0.0 111.388 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.85 -37.2 8.39 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.024 0.44 . . . . 0.0 110.28 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -54.21 -33.28 57.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.721 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.0 mm -77.47 -23.62 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.163 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.411 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.559 ' N ' HD21 ' A' ' 43' ' ' ASN . 0.9 OUTLIER -60.81 -35.76 77.3 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.715 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.445 ' O ' ' N ' ' A' ' 48' ' ' VAL . 3.9 t70 -58.33 -51.66 68.87 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.526 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 61.4 mt -50.31 -50.14 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.805 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -62.92 -37.33 86.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.525 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -83.6 -10.07 58.49 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.06 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.445 ' N ' ' O ' ' A' ' 44' ' ' ASP . 27.5 t -76.3 116.86 20.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -51.73 134.39 30.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.681 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 113.49 -30.21 7.4 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 43.0 t -79.47 145.0 10.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.738 0.304 . . . . 0.0 110.202 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -103.11 -52.34 3.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.224 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 p -169.98 178.45 3.95 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.637 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 82.7 mt -138.59 151.4 24.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.184 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.405 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 17.9 t80 -138.23 107.59 6.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.005 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -94.57 131.64 40.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.248 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.448 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 1.5 p -165.59 156.9 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.444 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 7.7 ttm 44.0 -138.99 0.31 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.45 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -103.68 38.99 1.69 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.695 0.283 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.448 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 37.2 p90 -158.26 170.82 21.4 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.987 0.422 . . . . 0.0 111.009 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 58.0 mt -138.06 133.21 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.656 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 m -101.04 111.41 23.61 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.155 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.413 ' C ' ' HG1' ' A' ' 14' ' ' THR . 60.3 t -103.53 117.38 48.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.06 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 64' ' ' ASP . 0.2 OUTLIER -106.19 141.88 36.8 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.46 -179.632 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -121.78 -171.57 2.26 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.957 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -97.19 131.73 43.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -50.57 -26.68 5.57 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.84 0.353 . . . . 0.0 110.608 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -71.46 -33.22 69.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.66 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.87 -172.93 4.22 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.835 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -134.17 -175.36 3.83 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.277 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -99.06 -46.81 5.46 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.185 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.511 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 2.1 mp0 -53.26 -21.89 6.1 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.233 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.2 t -86.29 -43.78 12.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.163 0.506 . . . . 0.0 110.222 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -78.68 -37.77 21.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.838 -178.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.524 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.8 mp -47.65 -57.47 9.83 Favored Pre-proline 0 N--CA 1.467 0.396 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.0 Cg_exo -44.32 -32.25 5.08 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 122.497 2.131 . . . . 0.0 112.217 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -81.84 -41.21 21.37 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.249 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 85.9 t -60.67 -45.1 98.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.842 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -53.76 -40.98 66.67 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.575 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.27 -32.89 62.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.367 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.7 t -56.74 -66.63 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.887 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -83.26 27.23 0.59 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.754 0.311 . . . . 0.0 110.999 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.073 179.649 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.756 0.312 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 mt -80.81 122.96 36.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.159 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.5 mm -107.24 -19.11 6.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.609 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.4 t . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.98 0.419 . . . . 0.0 111.183 -179.808 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.5 m120 . . . . . 0 N--CA 1.467 0.395 0 N-CA-C 111.458 0.17 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.9 t -148.05 128.01 13.58 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.76 0.314 . . . . 0.0 110.449 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.432 ' HG3' ' CZ2' ' A' ' 71' ' ' TRP . 52.2 mtm -107.91 143.73 36.13 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.674 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 131.66 44.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.836 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.6 mt -95.92 115.36 34.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.641 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.1 m -84.48 127.78 34.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.388 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.44 ' C ' ' H ' ' A' ' 21' ' ' GLU . 36.7 mt -99.57 -173.48 2.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.273 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 96.8 p -63.35 -1.79 1.24 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.706 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.44 ' H ' ' C ' ' A' ' 19' ' ' LEU . 62.7 mt-10 . . . . . 0 N--CA 1.464 0.23 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.72 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 6.2 mmt . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.665 0.269 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 75.3 p -76.73 -124.18 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.291 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 81.1 p -156.19 143.11 18.87 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.248 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -154.01 164.7 38.02 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.816 0.341 . . . . 0.0 110.822 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 57.5 m -144.84 115.19 7.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.886 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -104.28 132.39 50.58 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.341 0.591 . . . . 0.0 111.45 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.419 ' O ' ' CB ' ' A' ' 33' ' ' LYS . 11.9 p -120.6 57.42 0.96 Allowed 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER 89.52 106.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.792 -177.818 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.444 ' C ' ' O ' ' A' ' 33' ' ' LYS . 0.3 OUTLIER 15.57 108.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 114.47 -1.241 . . . . 0.0 113.378 -178.592 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.617 ' H ' ' NE2' ' A' ' 38' ' ' GLN . 8.7 p30 -158.4 -175.02 5.09 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.126 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 50.69 -100.2 0.08 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.436 0.16 . . . . 0.0 110.994 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.3 t -174.43 61.02 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.097 0.475 . . . . 0.0 110.867 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.617 ' NE2' ' H ' ' A' ' 35' ' ' ASP . 1.8 pm0 -82.53 153.68 68.25 Favored Pre-proline 0 N--CA 1.463 0.203 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.441 ' O ' ' N ' ' A' ' 42' ' ' ILE . 3.2 Cg_exo -55.0 137.6 76.64 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 121.716 1.611 . . . . 0.0 110.902 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.23 -38.98 9.14 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.424 0.63 . . . . 0.0 109.41 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -55.2 -34.82 64.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.429 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.441 ' N ' ' O ' ' A' ' 39' ' ' PRO . 2.4 mm -76.55 -22.7 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.3 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.41 ' N ' HD21 ' A' ' 43' ' ' ASN . 2.4 m120 -62.15 -36.34 81.54 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.551 ' O ' ' N ' ' A' ' 48' ' ' VAL . 6.2 m-20 -55.93 -53.6 54.84 Favored 'General case' 0 CA--C 1.523 -0.095 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.593 178.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 53.0 mt -47.71 -52.46 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.485 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -65.32 -37.42 87.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.901 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.8 mttm -82.22 -10.9 58.98 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.741 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.551 ' N ' ' O ' ' A' ' 44' ' ' ASP . 4.4 t -77.06 121.09 28.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.255 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -52.62 145.48 11.8 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.795 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.92 -29.95 10.24 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 86.7 t -78.29 150.66 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 120.813 0.339 . . . . 0.0 110.724 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.459 ' CB ' ' HZ3' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -109.07 -58.8 1.98 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.317 -179.454 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 91.6 p -166.38 -176.94 3.83 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.521 -178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 63.9 mt -137.74 152.21 26.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.985 0.421 . . . . 0.0 111.212 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -139.09 109.71 6.63 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.283 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -97.81 136.63 37.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.366 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.413 ' CG2' ' H ' ' A' ' 58' ' ' MET . 11.6 p -166.55 169.51 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.049 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.413 ' H ' ' CG2' ' A' ' 57' ' ' VAL . 3.1 ttm 41.03 -107.53 0.08 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.937 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -139.69 44.77 1.94 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.149 0.5 . . . . 0.0 109.949 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -161.96 168.76 22.31 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.604 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 75.2 mt -129.31 126.15 63.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.422 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.0 t -97.08 116.22 28.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.288 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 39.7 t -105.81 118.54 53.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.348 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -105.26 142.04 35.72 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.99 0.424 . . . . 0.0 110.54 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.426 ' NZ ' ' CD1' ' A' ' 71' ' ' TRP . 45.1 pttt -128.92 -171.1 2.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.666 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -98.39 137.86 36.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.507 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.485 ' N ' ' OD1' ' A' ' 67' ' ' ASN . 6.1 p-10 -54.18 -27.9 36.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.676 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.64 -33.02 74.92 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.98 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.95 177.51 6.94 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.899 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -131.68 163.19 28.69 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.75 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.432 ' CZ2' ' HG3' ' A' ' 15' ' ' MET . 54.7 m95 -77.88 -55.28 5.44 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.275 -179.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -46.87 -21.07 0.17 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.768 0.318 . . . . 0.0 111.06 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.3 m -88.23 -45.74 9.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.283 0.563 . . . . 0.0 110.467 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -84.22 -38.36 13.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.062 -178.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.567 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 0.9 OUTLIER -47.59 -55.1 18.11 Favored Pre-proline 0 N--CA 1.464 0.239 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 -178.851 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.4 Cg_exo -41.99 -33.06 2.03 Favored 'Trans proline' 0 N--CA 1.49 1.319 0 C-N-CA 122.545 2.163 . . . . 0.0 112.246 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.72 -51.46 7.68 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.329 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 45.1 t -43.87 -53.9 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.593 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -54.25 -40.83 68.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.638 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.18 -32.48 10.37 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.327 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.0 t -61.38 -59.64 3.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.56 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -85.7 44.55 1.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.016 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.533 179.638 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.4 mtmm . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.723 0.296 . . . . 0.0 110.337 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 55.3 mt -81.94 127.09 39.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.337 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 mp -109.19 -55.93 4.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.473 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.8 p . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.664 -179.898 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.5 m120 . . . . . 0 N--CA 1.465 0.3 0 CA-C-O 120.281 0.086 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.492 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 8.8 t -145.72 129.24 16.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 0.0 111.164 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.9 mtm -109.77 158.71 17.85 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.369 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -97.6 124.23 41.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.376 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 54.5 mt -98.1 122.31 49.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.751 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 96.7 m -86.39 132.11 34.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.441 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.8 mt -102.02 174.13 6.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.334 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 88.8 p -65.18 -5.24 6.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.098 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 . . . . . 0 N--CA 1.465 0.313 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.566 -179.775 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.866 0.365 . . . . 0.0 110.172 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.0 t 38.79 -151.87 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.629 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.2 p -157.01 141.85 16.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.444 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -156.77 136.06 12.08 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.762 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.1 m -99.36 128.92 45.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.032 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.526 ' CZ ' ' HB3' ' A' ' 38' ' ' GLN . 54.0 m-85 -113.49 118.55 34.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.726 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.3 p -125.22 -12.01 6.91 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.356 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.474 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 19.7 pttm -155.38 31.87 0.38 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.612 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 33' ' ' LYS . 59.6 t 73.71 166.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.468 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.451 ' N ' ' CG1' ' A' ' 34' ' ' VAL . 33.3 t70 -155.6 -110.32 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.425 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -167.94 -39.45 0.02 OUTLIER 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.733 0.301 . . . . 0.0 110.435 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.0 t -57.92 -31.49 66.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.282 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.526 ' HB3' ' CZ ' ' A' ' 31' ' ' TYR . 2.5 pt20 -80.16 153.79 74.6 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.472 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -59.25 138.85 87.21 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.057 1.838 . . . . 0.0 111.386 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.61 -39.96 12.12 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.109 0.48 . . . . 0.0 109.885 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -54.28 -47.52 72.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.772 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.6 mm -55.91 -27.65 22.99 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.386 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.21 -43.92 97.75 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.75 -37.62 68.73 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.157 179.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.423 ' CG1' HG22 ' A' ' 81' ' ' VAL . 22.1 mt -62.5 -48.81 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.158 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.486 ' O ' HG22 ' A' ' 51' ' ' VAL . 51.1 mt -55.49 -32.9 63.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.838 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -78.81 -4.51 49.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.28 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.0 t -77.91 103.57 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -46.92 110.87 0.33 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.661 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 125.26 6.25 6.34 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.757 ' O ' ' N ' ' A' ' 53' ' ' SER . 0.0 OUTLIER -78.8 -21.65 12.9 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.204 0 CA-C-O 118.759 -0.639 . . . . 0.0 112.51 -179.51 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.9 ttmm 51.83 -64.19 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.231 0.469 . . . . 0.0 111.074 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.757 ' N ' ' O ' ' A' ' 51' ' ' VAL . 1.3 p -172.62 165.76 5.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.163 0.506 . . . . 0.0 111.654 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 83.4 mt -140.78 149.64 21.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.24 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -136.8 115.83 12.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.771 0.32 . . . . 0.0 111.006 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -100.2 132.94 45.28 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.977 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 6.2 p -164.37 153.27 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.825 0.345 . . . . 0.0 110.902 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 13.0 ttt 46.04 -106.83 0.13 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.185 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -133.15 16.5 4.14 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.647 0.261 . . . . 0.0 110.931 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -131.1 164.3 25.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.116 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.8 mt -133.9 130.08 55.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.146 -179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.09 109.56 21.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.7 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 14' ' ' THR . 59.6 t -101.17 119.74 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.682 ' O ' ' O ' ' A' ' 51' ' ' VAL . 0.9 OUTLIER -97.86 154.33 17.71 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.251 179.799 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.0 pttt -132.42 165.35 24.49 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.237 179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -52.4 168.84 0.09 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.204 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -34.97 -42.92 0.17 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.066 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -133.55 -54.2 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.139 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 48.84 -159.21 0.05 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.0 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -145.26 114.51 7.06 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.744 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -71.6 -38.4 70.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.169 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.11 -26.18 48.81 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.951 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.6 m -89.39 -45.84 9.17 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.108 0.48 . . . . 0.0 110.54 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.2 t -66.97 -39.43 83.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.715 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.446 ' CB ' ' CD ' ' A' ' 76' ' ' PRO . 1.4 mm? -49.26 -62.1 2.76 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.83 -0.168 . . . . 0.0 111.385 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' A' ' 75' ' ' LEU . 2.9 Cg_endo -50.29 -31.75 30.68 Favored 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.495 2.13 . . . . 0.0 112.556 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -78.32 -47.12 18.43 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.329 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.72 -39.38 70.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.475 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -55.78 -43.45 76.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.368 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.58 -34.02 48.75 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.378 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.423 HG22 ' CG1' ' A' ' 45' ' ' ILE . 12.9 t -60.4 -61.68 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.756 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -84.39 10.81 9.74 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.918 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 . . . . . 0 C--N 1.331 -0.219 0 CA-C-O 121.138 0.494 . . . . 0.0 110.179 179.815 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 32.1 pttt . . . . . 0 N--CA 1.461 0.082 0 CA-C-O 120.928 0.394 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 96.7 mt -84.62 122.63 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.759 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.526 ' N ' ' CD1' ' A' ' 4' ' ' ILE . 1.8 mp -109.68 -31.73 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-O 121.203 0.525 . . . . 0.0 109.752 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--N 1.326 -0.417 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.159 -179.591 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.8 m120 . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.8 t -136.73 126.66 25.86 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.87 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.414 ' HG2' ' CH2' ' A' ' 71' ' ' TRP . 13.1 ptp -107.78 154.79 21.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.12 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.4 tttt -102.03 128.12 48.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.464 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.7 mt -99.14 114.12 36.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.91 0.386 . . . . 0.0 111.086 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 84.4 m -88.5 128.04 35.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.497 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.1 mt -102.06 161.48 13.65 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.531 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.42 -1.49 6.6 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.47 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 . . . . . 0 N--CA 1.457 -0.107 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.255 -179.27 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 11.8 mtt . . . . . 0 C--O 1.233 0.189 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.495 ' CG2' ' H ' ' A' ' 28' ' ' SER . 1.8 m -162.98 -143.67 0.08 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.885 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.495 ' H ' ' CG2' ' A' ' 27' ' ' THR . 11.7 p -156.08 130.3 8.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.245 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -162.28 138.54 7.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.283 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 52.0 m -98.76 148.12 24.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.27 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.401 ' CD1' ' OE1' ' A' ' 38' ' ' GLN . 22.7 m-85 -135.58 120.07 18.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.479 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.3 p -125.06 -7.49 7.16 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.531 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 34' ' ' VAL . 33.4 pttt -158.45 58.38 0.45 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.234 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.423 ' C ' ' O ' ' A' ' 33' ' ' LYS . 19.2 t 26.56 101.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 O-C-N 123.649 0.593 . . . . 0.0 112.521 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -159.49 -156.74 0.53 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.285 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 56.55 -100.24 0.11 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.841 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.5 t -168.2 63.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.401 ' OE1' ' CD1' ' A' ' 31' ' ' TYR . 9.6 mt-30 -92.9 144.9 29.21 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.16 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.462 ' O ' ' N ' ' A' ' 42' ' ' ILE . 3.1 Cg_exo -55.59 134.22 62.66 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 121.596 1.531 . . . . 0.0 110.201 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.408 ' C ' ' O ' ' A' ' 39' ' ' PRO . . . -41.29 -41.44 1.9 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.401 0.619 . . . . 0.0 109.852 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -52.69 -37.98 59.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.202 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.462 ' N ' ' O ' ' A' ' 39' ' ' PRO . 2.0 mm -70.01 -26.3 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.816 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.527 ' N ' HD21 ' A' ' 43' ' ' ASN . 1.0 OUTLIER -61.17 -38.47 86.6 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.673 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 48' ' ' VAL . 33.6 t70 -55.53 -53.79 52.07 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.829 179.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 84.4 mt -45.76 -53.76 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.241 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.5 mt -67.18 -36.88 82.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.871 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -81.18 -8.46 59.76 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.078 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.56 ' N ' ' O ' ' A' ' 44' ' ' ASP . 3.9 t -79.52 115.05 21.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -51.19 113.23 0.88 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.637 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 139.68 -39.94 1.47 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.5 t -78.62 147.75 6.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -108.95 -35.58 6.31 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.375 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.469 ' OG ' ' N ' ' A' ' 54' ' ' ILE . 3.1 t -172.96 176.54 3.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.123 0.487 . . . . 0.0 111.189 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.469 ' N ' ' OG ' ' A' ' 53' ' ' SER . 83.2 mt -137.11 154.5 31.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.655 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.438 ' HB3' ' HG ' ' A' ' 62' ' ' SER . 37.7 t80 -138.3 109.14 6.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.262 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -95.48 129.39 42.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.988 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.422 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 5.0 p -163.33 162.91 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.214 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.429 ' CG ' ' H ' ' A' ' 59' ' ' ASP . 3.1 ttt 37.29 -137.02 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.023 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.429 ' H ' ' CG ' ' A' ' 58' ' ' MET . 1.2 p30 -102.87 39.87 1.47 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.737 0.303 . . . . 0.0 110.663 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.422 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 38.6 p90 -161.88 169.58 21.0 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.965 0.412 . . . . 0.0 111.373 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.0 mp -138.19 135.4 44.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.431 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.438 ' HG ' ' HB3' ' A' ' 55' ' ' PHE . 0.3 OUTLIER -99.07 154.83 17.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.167 179.581 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.2 t -142.74 112.49 2.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.581 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.7 p-10 -99.04 143.46 29.3 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.011 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.485 ' NZ ' ' NE1' ' A' ' 71' ' ' TRP . 16.6 pttm -124.41 -176.23 3.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.524 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -90.59 129.83 36.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.082 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.34 -34.69 7.15 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -34.42 76.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.562 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.32 166.08 14.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.691 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -108.11 177.48 4.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.584 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.485 ' NE1' ' NZ ' ' A' ' 65' ' ' LYS . 12.2 m95 -98.05 -44.78 6.5 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.591 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.415 ' O ' ' CD ' ' A' ' 76' ' ' PRO . 2.7 pp20? -56.05 -21.27 20.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.673 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.423 ' CG2' ' N ' ' A' ' 74' ' ' VAL . 15.4 t -86.22 -44.65 11.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.313 0.577 . . . . 0.0 109.71 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.423 ' N ' ' CG2' ' A' ' 73' ' ' THR . 0.9 OUTLIER -75.39 -37.51 38.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.961 -179.813 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.451 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 2.5 mt -48.56 -61.34 3.31 Favored Pre-proline 0 N--CA 1.466 0.365 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.3 Cg_exo -42.51 -31.65 1.99 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 C-N-CA 122.415 2.076 . . . . 0.0 112.126 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.44 -41.97 23.52 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.07 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.4 t -52.36 -56.15 7.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.216 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -53.09 -33.95 54.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.022 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -54.4 -32.85 58.07 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.219 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.0 t -56.95 -64.37 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.018 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.452 ' CD1' ' N ' ' A' ' 82' ' ' PHE . 0.7 OUTLIER -85.22 29.88 0.63 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.101 -179.541 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 . . . . . 0 C--N 1.332 -0.178 0 CA-C-O 120.756 0.312 . . . . 0.0 110.821 179.752 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.902 0.382 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.417 HG22 HD12 ' A' ' 3' ' ' ILE . 66.8 mt -81.7 126.34 39.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.799 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.3 mm -110.06 -17.71 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.205 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.463 0.197 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.796 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.4 m120 . . . . . 0 N--CA 1.461 0.117 0 CA-C-O 120.62 0.248 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.6 t -149.25 126.48 11.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.425 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.652 ' SD ' ' CE2' ' A' ' 71' ' ' TRP . 6.7 mtp -108.21 132.21 53.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.39 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.7 ttmm -94.27 121.65 36.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.57 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 58.2 mt -93.6 126.3 46.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.844 0.354 . . . . 0.0 110.684 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.3 m -88.13 137.03 32.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.656 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.423 ' C ' ' H ' ' A' ' 21' ' ' GLU . 49.3 mt -114.98 155.02 27.71 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.398 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.7 p -68.64 2.99 2.07 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.916 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.423 ' H ' ' C ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER . . . . . 0 CA--C 1.529 0.151 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.292 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 8.0 mmm . . . . . 0 C--O 1.234 0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.344 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.0 m -73.59 -131.53 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.243 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.3 p -156.98 133.77 10.17 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.615 0.245 . . . . 0.0 110.419 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -156.43 130.12 8.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.499 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.69 150.5 21.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.403 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -130.76 117.53 19.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.975 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.7 p -118.69 -10.22 10.05 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.187 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.526 ' CB ' ' HZ2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -159.11 48.89 0.33 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.816 179.733 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.442 ' CG1' ' N ' ' A' ' 35' ' ' ASP . 53.8 t 53.68 167.69 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.488 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.442 ' N ' ' CG1' ' A' ' 34' ' ' VAL . 13.2 m-20 -160.07 -101.93 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.496 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.42 ' C ' ' N ' ' A' ' 38' ' ' GLN . 24.2 t0 -172.48 -50.23 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.455 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.8 m -49.49 -15.35 0.15 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.852 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.42 ' N ' ' C ' ' A' ' 36' ' ' ASP . 1.4 pt20 -93.48 147.52 33.82 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.14 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -55.77 137.59 78.93 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 C-N-CA 121.805 1.67 . . . . 0.0 110.584 179.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.97 -39.09 8.44 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.321 0.582 . . . . 0.0 109.463 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -55.75 -31.03 62.2 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.264 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.7 mm -77.02 -24.53 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 N-CA-C 110.156 -0.312 . . . . 0.0 110.156 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.419 ' ND2' ' CG ' ' A' ' 38' ' ' GLN . 9.2 m120 -62.53 -39.65 94.26 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.585 ' O ' ' N ' ' A' ' 48' ' ' VAL . 25.4 t70 -57.7 -52.14 66.66 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.789 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.408 HD11 HG21 ' A' ' 45' ' ' ILE . 56.4 mt -45.41 -52.95 2.06 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.472 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 26.5 mt -61.62 -38.07 86.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.053 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.6 mtpt -84.61 -6.88 59.39 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.172 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.585 ' N ' ' O ' ' A' ' 44' ' ' ASP . 3.7 t -79.86 119.4 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.038 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -52.99 126.24 19.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.82 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 127.22 -39.34 1.96 Allowed Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.5 t -79.75 147.96 6.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.76 0.314 . . . . 0.0 110.735 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -108.97 -34.55 6.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.709 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.1 t -174.09 179.12 1.97 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.067 0.461 . . . . 0.0 110.968 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.0 mt -145.9 138.98 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.075 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -126.6 112.79 15.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.086 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.2 t-160 -93.53 131.24 38.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.418 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.505 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 2.0 p -164.02 156.58 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.837 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.6 ttt 41.27 -141.43 0.08 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.494 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -100.31 27.67 5.53 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 121.173 -0.211 . . . . 0.0 111.069 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.505 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 14.1 p90 -144.62 169.69 17.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.995 0.426 . . . . 0.0 111.056 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.2 mt -136.45 136.86 48.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.307 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.11 110.14 22.12 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.481 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.6 t -98.7 112.5 30.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.683 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 -104.29 134.01 48.23 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.469 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.3 pttt -122.09 -172.91 2.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.404 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -96.32 127.13 42.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.462 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -45.86 -24.75 0.43 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.969 0.414 . . . . 0.0 110.461 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -68.61 -35.22 77.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.004 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.09 163.05 17.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.755 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -111.59 174.03 6.06 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.487 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.652 ' CE2' ' SD ' ' A' ' 15' ' ' MET . 41.0 m95 -92.52 -48.07 6.81 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.019 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -50.59 -22.31 1.95 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.782 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.473 ' CG2' ' N ' ' A' ' 74' ' ' VAL . 4.7 t -88.88 -44.26 10.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.284 0.564 . . . . 0.0 110.166 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.473 ' N ' ' CG2' ' A' ' 73' ' ' THR . 0.9 OUTLIER -77.47 -37.65 25.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.321 -179.16 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.489 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.0 OUTLIER -48.42 -60.25 4.77 Favored Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.479 -179.109 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.7 Cg_exo -42.91 -31.31 2.16 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.507 2.138 . . . . 0.0 111.893 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -81.4 -41.1 22.42 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.08 -53.76 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.035 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -51.39 -40.97 60.32 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.635 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.41 -33.09 42.14 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.97 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.1 t -58.85 -63.12 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.753 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -83.65 23.36 0.97 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.887 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 . . . . . 0 C--O 1.233 0.211 0 CA-C-O 121.053 0.454 . . . . 0.0 110.16 179.72 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 36.7 pttt . . . . . 0 CA--C 1.529 0.155 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.41 HG22 HD13 ' A' ' 3' ' ' ILE . 82.0 mt -80.21 131.7 33.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.766 0.317 . . . . 0.0 110.842 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.42 ' N ' ' CD1' ' A' ' 4' ' ' ILE . 1.7 mp -108.56 -47.61 7.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.007 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.5 p . . . . . 0 CA--C 1.53 0.175 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.896 -179.89 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.4 m120 . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 120.642 0.258 . . . . 0.0 111.492 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.2 t -147.84 157.13 43.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.886 0.374 . . . . 0.0 110.971 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.75 161.3 35.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.44 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.438 ' HG2' ' H ' ' A' ' 17' ' ' ILE . 6.7 ttmm -92.03 162.44 14.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.805 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.438 ' H ' ' HG2' ' A' ' 16' ' ' LYS . 71.3 mt -138.68 113.96 8.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.14 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.8 m -84.9 119.2 25.08 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.255 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.589 ' C ' ' H ' ' A' ' 21' ' ' GLU . 64.4 mt -104.5 166.96 10.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.379 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.8 m -69.6 34.3 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.321 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.589 ' H ' ' C ' ' A' ' 19' ' ' LEU . 10.0 mm-40 . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.299 -179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 14.8 mtt . . . . . 0 N--CA 1.463 0.205 0 CA-C-O 120.786 0.327 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.8 t -75.91 -135.88 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.214 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.2 p -155.73 135.25 12.47 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.673 0.273 . . . . 0.0 110.553 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -158.7 142.13 14.99 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.24 148.56 26.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.324 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -129.73 111.99 13.19 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.201 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.2 p -123.62 -0.83 8.57 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.088 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 35.6 mtmt -151.77 25.44 0.66 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.738 0.304 . . . . 0.0 110.84 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.484 ' CG1' ' N ' ' A' ' 35' ' ' ASP . 60.0 t 54.85 170.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.052 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.484 ' N ' ' CG1' ' A' ' 34' ' ' VAL . 12.6 t0 70.54 99.1 0.06 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.546 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -172.73 21.08 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.091 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.1 p 76.93 13.49 2.16 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.169 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.46 174.2 6.5 Favored Pre-proline 0 N--CA 1.465 0.279 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -71.68 129.04 15.02 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.32 2.013 . . . . 0.0 111.192 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.68 -36.88 7.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.958 0.409 . . . . 0.0 110.342 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 -54.49 -32.94 58.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.841 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.0 mm -76.52 -20.81 14.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.285 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.498 ' N ' HD21 ' A' ' 43' ' ' ASN . 1.8 m120 -62.65 -40.18 96.2 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.411 ' O ' ' N ' ' A' ' 48' ' ' VAL . 21.5 m-20 -57.11 -52.5 65.06 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.726 178.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.8 mt -49.04 -49.76 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.599 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.9 mt -63.34 -36.8 84.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.687 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -83.16 -10.9 58.38 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.22 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.411 ' N ' ' O ' ' A' ' 44' ' ' ASP . 19.7 t -76.3 124.9 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.911 0.386 . . . . 0.0 110.165 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 49' ' ' GLU . 1.8 pm0 -51.14 138.54 19.95 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.142 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 106.35 -35.59 4.95 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.762 -0.935 . . . . 0.0 110.762 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 31.3 t -78.71 138.61 19.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.867 0.365 . . . . 0.0 110.63 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -103.04 -55.13 2.48 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.129 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 64.7 m -161.19 -179.49 7.5 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.465 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 93.7 mt -138.02 153.02 26.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.12 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.4 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 20.2 t80 -139.1 110.58 7.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.462 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -98.42 133.09 43.29 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.437 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.4 ' HB ' ' CZ ' ' A' ' 55' ' ' PHE . 9.3 p -164.5 158.74 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.715 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.409 ' CG ' ' H ' ' A' ' 59' ' ' ASP . 0.2 OUTLIER 46.22 -137.98 0.61 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.383 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.409 ' H ' ' CG ' ' A' ' 58' ' ' MET . 20.3 p-10 -105.06 44.04 1.06 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.001 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -165.75 172.27 11.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.777 0.322 . . . . 0.0 110.653 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 68.7 mt -135.13 143.55 36.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.385 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.3 t -114.46 114.32 25.65 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.713 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.2 t -99.53 111.93 30.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.886 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.28 146.85 27.43 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.955 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.407 ' HZ2' ' C ' ' A' ' 70' ' ' ASN . 11.5 ptpt -124.52 -164.01 1.22 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.138 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -66.11 -153.6 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.684 0.278 . . . . 0.0 110.506 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.04 -48.2 73.74 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.746 0.308 . . . . 0.0 110.367 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -154.06 -42.98 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.453 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 46.79 -137.45 0.72 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.738 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.425 ' N ' ' OD1' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -141.88 135.42 29.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.036 179.724 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -91.53 -45.17 8.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.942 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -54.63 -21.93 12.02 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.85 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.452 ' CG2' ' N ' ' A' ' 74' ' ' VAL . 6.0 t -86.02 -44.11 12.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.115 0.483 . . . . 0.0 110.16 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.452 ' N ' ' CG2' ' A' ' 73' ' ' THR . 1.1 t -74.26 -38.75 48.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.485 -179.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.1 mp -48.58 -58.97 6.94 Favored Pre-proline 0 N--CA 1.465 0.299 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 2.9 Cg_endo -46.39 -32.45 11.0 Favored 'Trans proline' 0 N--CA 1.491 1.334 0 C-N-CA 122.471 2.114 . . . . 0.0 111.931 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.68 -42.07 22.65 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.962 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 74.3 t -58.62 -43.84 88.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.095 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -53.7 -44.86 70.13 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.031 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.38 -32.71 40.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.396 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.2 t -57.84 -62.75 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.469 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -87.9 -33.84 18.36 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 120.828 0.347 . . . . 0.0 111.351 -179.25 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.9 pttt . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.798 0.332 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 39.6 mt 57.43 101.83 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.605 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.6 mm -102.72 -17.72 6.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.798 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.0 t . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.481 -179.926 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.0 m120 . . . . . 0 N--CA 1.461 0.081 0 CA-C-O 120.822 0.344 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.492 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 4.3 t -150.63 131.91 14.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.579 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 63.0 mtm -100.04 156.87 16.93 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.401 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.81 120.7 37.63 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.29 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.8 mt -97.56 110.32 25.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.485 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.2 m -85.2 139.91 31.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.473 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.7 mt -113.69 151.28 32.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.496 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.9 t -67.27 -2.25 5.7 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.194 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.279 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.636 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 10.8 tpp . . . . . 0 C--O 1.233 0.206 0 CA-C-O 120.819 0.342 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.2 p 48.9 -162.86 0.03 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.693 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.2 p -156.76 135.23 11.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.332 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -157.38 143.86 17.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 27.6 m -102.05 121.55 42.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.79 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.423 ' CD1' ' NE2' ' A' ' 38' ' ' GLN . 25.7 m-85 -107.14 114.51 28.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.845 0.355 . . . . 0.0 110.595 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.1 p -132.96 1.72 3.59 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.889 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -157.74 25.84 0.28 Allowed 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.935 -0.306 . . . . 0.0 111.437 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.531 ' CG1' ' H ' ' A' ' 35' ' ' ASP . 13.9 t 50.2 177.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.264 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.531 ' H ' ' CG1' ' A' ' 34' ' ' VAL . 9.8 m-20 58.08 94.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -168.14 -43.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.919 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.5 t 164.65 -22.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.68 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.423 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 0.9 OUTLIER -49.39 147.8 5.26 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.985 -179.662 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -56.8 141.23 92.6 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.229 1.953 . . . . 0.0 111.33 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -47.82 -42.69 26.82 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -54.13 -37.08 63.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.676 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.0 mm -71.67 -24.96 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.383 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.531 ' N ' HD21 ' A' ' 43' ' ' ASN . 1.5 m120 -60.41 -40.84 92.39 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -55.48 -44.46 76.52 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.922 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.49 ' O ' HG23 ' A' ' 51' ' ' VAL . 19.3 mt -58.08 -62.7 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.192 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.368 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 49.0 mt -43.15 -35.52 1.39 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.799 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -81.74 -13.83 57.28 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.8 t -77.29 119.46 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.827 0.346 . . . . 0.0 110.616 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -54.49 143.75 23.25 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.827 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 90.31 -0.55 78.27 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.666 ' O ' ' N ' ' A' ' 53' ' ' SER . 4.1 t -80.41 -19.28 12.0 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt 52.34 -68.1 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 123.412 0.685 . . . . 0.0 111.233 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.666 ' N ' ' O ' ' A' ' 51' ' ' VAL . 18.5 p -174.62 174.45 2.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.107 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 86.1 mt -135.55 147.07 28.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.642 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -135.04 108.75 8.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.253 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -93.8 129.39 40.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.281 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 8.4 p -162.92 148.18 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.126 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.415 ' CG ' ' H ' ' A' ' 59' ' ' ASP . 7.2 tpp 50.28 -146.3 0.42 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.394 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.415 ' H ' ' CG ' ' A' ' 58' ' ' MET . 40.4 p-10 -95.83 43.33 1.08 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.619 0.247 . . . . 0.0 111.482 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -163.62 173.7 12.65 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.8 0.333 . . . . 0.0 110.84 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 14.3 mt -137.95 132.9 44.11 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.608 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 t -100.58 109.09 21.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.13 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.3 t -99.95 110.18 26.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.538 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.633 ' O ' ' O ' ' A' ' 51' ' ' VAL . 1.4 m-20 -89.43 146.46 24.63 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.291 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.0 pttp -120.15 171.6 8.36 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.313 0.383 . . . . 0.0 110.392 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.434 ' O ' ' C ' ' A' ' 67' ' ' ASN . 0.3 OUTLIER -58.49 -176.64 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.97 -179.583 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.434 ' C ' ' O ' ' A' ' 66' ' ' GLU . 2.6 m120 -32.06 -60.25 0.27 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.058 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -138.25 -52.19 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.899 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 47.92 -150.25 0.14 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.06 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -142.44 125.08 15.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.467 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 39.6 m95 -73.5 -45.53 53.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.209 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -56.35 -21.34 23.97 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.077 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 m -86.29 -45.08 11.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.197 0.523 . . . . 0.0 110.128 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.97 -38.96 44.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.435 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.489 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.5 mt -49.26 -58.05 9.97 Favored Pre-proline 0 N--CA 1.464 0.232 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -46.17 -32.33 10.14 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 122.171 1.914 . . . . 0.0 111.474 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -80.9 -41.31 23.22 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 48.4 t -66.5 -41.77 89.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.537 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -54.02 -42.62 69.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.735 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.98 -32.75 15.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.154 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 11.3 t -59.67 -63.33 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.443 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -86.71 -29.96 22.03 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 121.004 -0.279 . . . . 0.0 111.514 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.056 0.455 . . . . 0.0 110.676 -179.496 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.985 0.421 . . . . 0.0 110.545 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.7 mt -80.71 110.38 16.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.636 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.5 mm -104.94 -24.34 4.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.448 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.465 0.317 0 CA-C-O 120.872 0.368 . . . . 0.0 111.198 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.486 ' C ' ' HZ2' ' A' ' 65' ' ' LYS . 24.5 t-20 . . . . . 0 N--CA 1.462 0.147 0 CA-C-O 120.499 0.19 . . . . 0.0 110.996 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.8 t -146.73 128.18 14.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.835 0.35 . . . . 0.0 110.613 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 33.3 mtm -109.01 154.12 22.65 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.555 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.5 mtpt -106.75 118.72 37.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.294 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.411 HD13 HG21 ' A' ' 17' ' ' ILE . 56.7 mt -96.28 121.99 47.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.709 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.1 m -86.79 124.5 33.11 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.415 ' C ' ' H ' ' A' ' 21' ' ' GLU . 27.5 mt -96.01 -154.09 0.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.322 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.8 m -63.91 -3.06 2.19 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.636 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' A' ' 19' ' ' LEU . 26.8 mt-10 . . . . . 0 C--O 1.233 0.205 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.846 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.0 tpp . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 120.547 0.213 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.419 ' CG2' ' H ' ' A' ' 28' ' ' SER . 0.6 OUTLIER 69.55 -161.51 0.17 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -178.867 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.419 ' H ' ' CG2' ' A' ' 27' ' ' THR . 97.8 p -159.06 144.73 16.33 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.306 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -161.14 156.68 24.72 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.787 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -132.18 128.1 37.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.454 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -107.03 128.83 54.71 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.478 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.8 p -117.76 4.51 12.26 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.485 ' O ' ' CG2' ' A' ' 34' ' ' VAL . 8.9 ttmm -155.55 -100.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.291 -1.322 . . . . 0.0 109.185 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.485 ' CG2' ' O ' ' A' ' 33' ' ' LYS . 59.5 t -166.27 97.72 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 114.686 -1.143 . . . . 0.0 109.823 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.416 ' C ' ' H ' ' A' ' 37' ' ' SER . 2.5 t0 -161.87 -147.88 0.14 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.304 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 62.66 3.75 1.22 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.968 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.416 ' H ' ' C ' ' A' ' 35' ' ' ASP . 3.4 p 65.8 17.65 10.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.342 -179.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.538 HE21 ' ND2' ' A' ' 43' ' ' ASN . 3.2 pt20 -55.52 175.81 0.19 Allowed Pre-proline 0 CA--C 1.528 0.105 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.77 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.436 ' CD ' ' HB2' ' A' ' 38' ' ' GLN . 3.7 Cg_exo -71.11 125.57 11.57 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 121.911 1.741 . . . . 0.0 111.4 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.52 -37.72 5.64 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.155 0.502 . . . . 0.0 109.978 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -53.79 -33.42 55.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.398 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.2 mm -78.58 -19.77 13.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.317 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.538 ' ND2' HE21 ' A' ' 38' ' ' GLN . 2.0 m120 -62.3 -37.69 86.53 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.584 ' O ' ' N ' ' A' ' 48' ' ' VAL . 22.6 t0 -57.78 -50.7 72.37 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.825 178.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.6 mt -48.66 -51.94 10.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.584 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.3 mt -65.14 -38.1 89.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.983 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 37.9 mttm -83.95 -9.82 58.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.722 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.584 ' N ' ' O ' ' A' ' 44' ' ' ASP . 2.6 t -78.21 123.66 35.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 -49.96 133.74 22.2 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.722 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.6 -44.68 1.39 Allowed Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 94.8 t -79.72 138.56 19.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.799 0.333 . . . . 0.0 110.413 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.457 ' NZ ' ' O ' ' A' ' 65' ' ' LYS . 5.6 ttpm? -105.49 -33.08 8.24 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.111 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -176.43 179.53 1.18 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.511 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 76.8 mt -141.06 153.36 20.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.775 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -140.11 107.56 5.56 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.55 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.424 ' CD2' ' N ' ' A' ' 57' ' ' VAL . 10.4 t-160 -96.11 142.22 28.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.906 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.429 HG13 ' SD ' ' A' ' 58' ' ' MET . 13.1 p -162.47 164.9 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.828 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.561 ' CG ' ' H ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER 27.96 -90.1 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.894 -179.602 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.561 ' H ' ' CG ' ' A' ' 58' ' ' MET . 8.5 p-10 -144.7 42.85 1.36 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.954 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.479 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 8.5 p90 -163.96 151.0 11.9 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.569 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 77.6 mt -113.99 134.49 56.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.518 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.5 t -106.58 111.62 24.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.556 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 16.0 t -99.17 106.03 18.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -96.13 138.85 33.15 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.883 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.503 ' NZ ' ' HE1' ' A' ' 71' ' ' TRP . 2.1 pttm -116.54 -171.59 2.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.212 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.429 ' O ' ' ND2' ' A' ' 13' ' ' ASN . 19.4 mt-10 -61.64 -151.89 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.41 0.444 . . . . 0.0 110.834 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.421 ' OD1' ' N ' ' A' ' 68' ' ' ASP . 5.5 p30 -64.95 -44.5 89.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.315 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.421 ' N ' ' OD1' ' A' ' 67' ' ' ASN . 1.9 t0 -143.4 -53.91 0.37 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.821 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.18 -151.78 0.22 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.486 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -140.56 129.93 23.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.299 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.503 ' HE1' ' NZ ' ' A' ' 65' ' ' LYS . 30.1 m95 -85.15 -44.28 13.09 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.519 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.47 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 16.6 mp0 -55.23 -22.42 17.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.158 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.7 m -90.9 -45.43 8.77 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.102 0.477 . . . . 0.0 110.641 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.25 -38.62 18.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.441 -178.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.53 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 4.4 tt -48.54 -58.08 9.2 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.306 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 2.8 Cg_endo -44.31 -31.24 4.21 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 122.587 2.192 . . . . 0.0 112.072 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -81.22 -49.45 10.77 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.181 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.3 t -50.39 -53.52 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.596 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -55.06 -40.61 70.49 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.824 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -51.87 -33.01 34.61 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.844 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.7 t -58.89 -54.39 34.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -84.98 39.76 0.78 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.42 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.055 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 59.1 pttt . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.681 0.277 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.6 mt -80.45 123.86 37.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.42 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.1 mm -109.59 -44.65 6.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.6 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.529 -179.795 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.476 ' O ' ' N ' ' A' ' 65' ' ' LYS . 1.2 m120 . . . . . 0 N--CA 1.462 0.165 0 CA-C-O 120.305 0.098 . . . . 0.0 110.854 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.409 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 11.1 t -148.35 135.46 20.23 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.656 0.265 . . . . 0.0 110.347 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.415 ' HG2' ' CZ2' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -114.75 164.61 13.82 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.992 -179.698 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -99.7 127.7 45.82 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.254 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.1 mt -99.03 121.95 50.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.344 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.0 m -87.76 134.03 33.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.593 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 15.8 mt -105.04 165.14 11.29 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.88 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t -70.18 -8.22 48.11 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 . . . . . 0 CA--C 1.531 0.214 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.526 -179.421 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 8.3 mtt . . . . . 0 CA--C 1.529 0.15 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.409 HG22 ' H ' ' A' ' 28' ' ' SER . 1.1 m -163.13 -141.53 0.06 Allowed 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.409 ' H ' HG22 ' A' ' 27' ' ' THR . 96.9 p -158.69 135.92 9.94 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.22 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -156.09 135.39 12.22 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.527 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.3 m -104.02 121.42 43.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.187 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -114.11 114.46 26.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.959 0.409 . . . . 0.0 110.949 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.7 p -124.38 -7.08 7.57 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.481 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.523 ' CG ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -158.41 50.96 0.4 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.955 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.447 ' CG1' ' N ' ' A' ' 35' ' ' ASP . 47.4 t 52.68 168.96 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.121 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.47 ' N ' ' OE1' ' A' ' 38' ' ' GLN . 46.2 t0 -162.62 -106.38 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.558 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -169.09 -52.08 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.522 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.9 p -48.39 -21.9 0.61 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.716 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.47 ' OE1' ' N ' ' A' ' 35' ' ' ASP . 2.3 pt20 -86.99 147.06 41.99 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.499 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -54.67 136.32 70.5 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 121.64 1.56 . . . . 0.0 110.716 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -47.31 -37.08 10.24 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -55.16 -34.82 64.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.441 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.9 mm -72.9 -22.02 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.581 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -62.1 -40.46 95.94 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 178.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -55.5 -51.9 65.46 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.173 179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.469 ' O ' HG21 ' A' ' 51' ' ' VAL . 9.0 mt -49.34 -60.65 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.684 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 68.1 mt -46.61 -35.14 5.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.224 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -14.39 58.14 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.513 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.13 109.85 12.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 120.845 0.355 . . . . 0.0 110.224 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -52.45 136.2 32.19 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.432 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 103.79 -5.13 46.77 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.632 ' O ' ' N ' ' A' ' 53' ' ' SER . 6.0 t -82.34 -21.23 9.76 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 CA-C-N 115.107 -0.547 . . . . 0.0 111.448 -179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 17.1 ttmt 54.92 -65.25 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.677 0.791 . . . . 0.0 111.163 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.632 ' N ' ' O ' ' A' ' 51' ' ' VAL . 1.1 t -172.97 172.06 4.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.587 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.415 ' N ' ' OG ' ' A' ' 53' ' ' SER . 95.4 mt -140.06 149.36 22.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.872 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -140.75 117.26 10.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.221 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -95.59 139.78 31.36 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.975 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.529 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 12.6 p -165.78 144.0 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.032 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.411 ' N ' HG22 ' A' ' 57' ' ' VAL . 16.6 ptp 37.3 -130.32 0.15 Allowed 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.288 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.408 ' N ' ' HG3' ' A' ' 58' ' ' MET . 4.2 p-10 -99.72 43.98 1.04 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.529 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 1.9 p90 -167.33 160.9 13.87 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.534 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 20.1 mt -128.86 136.03 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.346 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -103.32 107.68 18.6 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 39.4 t -101.87 120.31 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.175 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.617 ' O ' ' O ' ' A' ' 51' ' ' VAL . 0.8 OUTLIER -100.71 120.59 40.31 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.028 -179.501 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 13' ' ' ASN . 8.7 pttp -102.41 165.4 11.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.027 0.442 . . . . 0.0 111.137 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -82.6 130.35 35.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.109 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 -51.91 -33.43 37.0 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.875 0.369 . . . . 0.0 110.689 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -67.85 -35.52 78.71 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.817 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.42 162.53 16.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.517 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -111.19 158.65 18.68 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.824 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.415 ' CZ2' ' HG2' ' A' ' 15' ' ' MET . 32.1 m95 -71.5 -49.13 44.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.266 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -50.74 -20.52 1.28 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.535 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.5 m -88.38 -44.88 10.44 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.113 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -80.88 -38.91 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.927 -178.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.543 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -49.15 -57.76 10.66 Favored Pre-proline 0 N--CA 1.466 0.356 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.13 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -43.0 -36.27 5.29 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.648 2.232 . . . . 0.0 112.296 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -81.42 -40.15 23.84 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.84 0.353 . . . . 0.0 110.384 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 68.1 t -59.55 -53.41 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.579 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -52.02 -35.32 46.59 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.448 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -50.5 -32.6 18.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.998 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.9 t -60.55 -58.44 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.331 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' A' ' 82' ' ' PHE . 1.1 m-85 -81.52 8.13 10.33 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.255 -179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.529 0.169 0 CA-C-O 120.913 0.387 . . . . 0.0 110.472 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.415 ' CB ' ' HZ1' ' A' ' 2' ' ' LYS . 8.1 mtmp? . . . . . 0 N--CA 1.461 0.101 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 62.3 mt -79.32 108.14 12.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.241 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.8 mm -111.75 -76.96 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-N 115.912 -0.586 . . . . 0.0 109.557 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.415 ' HB2' ' HG1' ' A' ' 18' ' ' THR . 5.8 m . . . . . 0 C--O 1.235 0.335 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.127 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 30.4 m120 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.385 0.136 . . . . 0.0 110.968 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.0 t -148.54 127.07 12.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.188 0.518 . . . . 0.0 111.644 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.2 ptp -112.1 167.67 10.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.968 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.4 mttp -99.37 166.59 11.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.434 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.4 mt -145.05 105.12 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.978 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.415 ' HG1' ' HB2' ' A' ' 5' ' ' SER . 4.5 m -88.58 147.69 24.46 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.508 ' O ' ' CB ' ' A' ' 20' ' ' SER . 11.0 mt -102.85 -10.53 18.99 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.508 ' CB ' ' O ' ' A' ' 19' ' ' LEU . 4.0 p 91.65 -1.07 0.17 Allowed 'General case' 0 N--CA 1.472 0.629 0 O-C-N 123.447 0.467 . . . . 0.0 110.889 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 . . . . . 0 C--N 1.331 -0.2 0 CA-C-O 120.857 0.361 . . . . 0.0 110.964 -179.487 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.414 ' O ' ' CB ' ' A' ' 27' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.181 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.414 ' CB ' ' O ' ' A' ' 26' ' ' MET . 0.2 OUTLIER 80.82 159.76 0.16 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.218 -179.554 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 p -153.2 134.58 14.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.454 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -163.65 144.36 8.85 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.687 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.67 117.87 35.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.588 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.471 ' CG ' ' OE1' ' A' ' 38' ' ' GLN . 73.7 m-85 -109.24 111.66 23.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.438 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 81.9 p -118.32 -13.26 9.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.361 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.444 ' O ' ' C ' ' A' ' 34' ' ' VAL . 17.6 pttt -155.87 61.45 0.59 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.179 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.444 ' C ' ' O ' ' A' ' 33' ' ' LYS . 18.7 t 29.62 90.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.296 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -80.3 -102.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.442 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -175.01 90.28 0.05 Allowed 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.2 p 169.17 -40.58 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.584 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.501 HE22 ' CD1' ' A' ' 46' ' ' LEU . 19.3 pt20 -69.33 147.88 97.22 Favored Pre-proline 0 C--N 1.329 -0.305 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.436 ' O ' ' N ' ' A' ' 42' ' ' ILE . 3.3 Cg_exo -53.77 137.77 67.75 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 121.883 1.722 . . . . 0.0 111.588 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.39 -38.06 5.59 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.379 0.609 . . . . 0.0 109.455 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -55.33 -31.91 62.07 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.682 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.436 ' N ' ' O ' ' A' ' 39' ' ' PRO . 2.9 mm -77.55 -22.02 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.553 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -64.77 -36.09 83.17 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 48' ' ' VAL . 1.4 m-20 -58.84 -51.78 68.53 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.203 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.9 -50.81 13.57 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.873 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.501 ' CD1' HE22 ' A' ' 38' ' ' GLN . 12.0 mt -64.43 -36.18 83.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.054 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -82.54 -6.89 59.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.616 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.425 ' N ' ' O ' ' A' ' 44' ' ' ASP . 8.7 t -75.39 111.54 11.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -51.62 100.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.726 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 156.53 -44.52 0.52 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 39.9 t -77.66 149.11 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -105.02 -33.35 8.35 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.496 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.456 ' OG ' ' N ' ' A' ' 54' ' ' ILE . 1.4 t -178.71 175.31 1.08 Allowed 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.129 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.456 ' N ' ' OG ' ' A' ' 53' ' ' SER . 46.8 mt -142.48 152.26 17.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.788 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.405 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 19.8 t80 -137.83 108.52 6.62 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.139 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 -95.45 132.54 40.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.199 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.495 ' CG2' ' H ' ' A' ' 58' ' ' MET . 9.8 p -162.29 175.72 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.327 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.495 ' H ' ' CG2' ' A' ' 57' ' ' VAL . 14.8 ttt 34.54 -100.34 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.357 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -140.58 11.36 2.29 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.83 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -128.35 172.31 11.2 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.142 0.496 . . . . 0.0 111.23 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.1 mt -135.01 133.79 53.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.884 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.5 t -104.78 110.18 22.42 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.507 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.7 t -100.09 114.35 38.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.437 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -109.1 140.51 42.56 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.071 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -133.12 -172.09 2.85 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.703 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -98.4 -172.52 2.35 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -87.5 -47.21 8.92 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.054 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -48.94 -34.13 12.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.798 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.16 170.07 11.81 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.602 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -134.18 173.66 11.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.554 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.7 m95 -85.46 -54.77 4.37 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.451 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -51.53 -20.79 2.07 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 m -87.39 -45.48 10.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.909 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -76.54 -37.21 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.333 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.455 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.3 mm? -48.18 -61.95 2.66 Favored Pre-proline 0 N--CA 1.466 0.356 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.349 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -42.96 -32.73 2.82 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 C-N-CA 122.853 2.369 . . . . 0.0 112.587 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -83.29 -49.57 9.27 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.568 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 17.6 t -57.15 -48.55 81.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.158 -179.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -53.14 -40.73 64.46 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.038 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -51.38 -34.64 35.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 t -53.23 -60.19 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.08 -179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.84 49.65 1.76 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.378 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 . . . . . 0 C--O 1.234 0.258 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.08 179.391 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.2 mtm . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -166.84 62.8 0.09 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.624 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 52.6 mt 55.1 101.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.326 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 mm -105.44 -30.06 2.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.486 -179.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 89.0 p -172.59 139.99 0.99 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.035 0.445 . . . . 0.0 111.608 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.43 ' CG2' ' H ' ' A' ' 7' ' ' SER . 19.3 mm -94.51 175.89 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.68 178.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.43 ' H ' ' CG2' ' A' ' 6' ' ' ILE . 3.4 t -140.85 139.19 34.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.918 0.39 . . . . 0.0 110.641 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -76.56 147.93 37.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.307 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.46 151.36 33.28 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.851 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -46.99 -41.51 25.99 Favored 'Trans proline' 0 C--N 1.307 -1.635 0 C-N-CA 122.407 2.071 . . . . 0.0 112.05 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -95.74 178.59 5.4 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.229 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -140.76 20.13 2.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.379 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -88.37 -24.15 23.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.377 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.413 ' HG1' ' C ' ' A' ' 63' ' ' VAL . 12.5 t -150.14 129.64 13.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.967 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -116.55 154.48 30.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.265 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.05 134.61 37.55 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.937 0.399 . . . . 0.0 110.721 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.4 mt -98.34 123.24 50.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.318 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 86.1 m -85.53 131.47 34.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.002 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.4 mt -101.16 162.17 13.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.363 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 62.2 p -67.5 -5.55 15.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.293 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -92.07 165.64 13.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.714 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 92.5 p -150.65 171.51 17.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.474 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 24' ' ' GLU . 27.1 mmt180 44.1 -158.56 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.794 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.401 ' C ' ' O ' ' A' ' 23' ' ' ARG . 50.3 mt-10 32.56 -96.95 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.623 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 134.62 139.02 4.02 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 21.7 mtp -90.49 -123.61 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.4 p -75.47 164.1 26.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.735 0.302 . . . . 0.0 110.537 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.1 p -158.2 101.26 1.73 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.505 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -162.82 160.24 24.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.752 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 m -102.58 135.23 44.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.286 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -119.16 106.57 12.5 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.168 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.88 -3.05 8.19 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.725 -179.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.0 pttt -154.09 34.76 0.43 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.545 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.533 ' CG1' ' H ' ' A' ' 35' ' ' ASP . 17.8 t 51.57 177.93 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.555 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.533 ' H ' ' CG1' ' A' ' 34' ' ' VAL . 12.7 t70 62.52 109.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.846 0.355 . . . . 0.0 110.859 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 175.24 21.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.74 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 p 74.69 18.23 2.79 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.055 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.21 172.07 9.87 Favored Pre-proline 0 C--N 1.332 -0.166 0 N-CA-C 109.929 -0.396 . . . . 0.0 109.929 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -73.11 130.13 14.99 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.519 2.146 . . . . 0.0 111.388 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.85 -37.2 8.39 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.024 0.44 . . . . 0.0 110.28 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -54.21 -33.28 57.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.721 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.0 mm -77.47 -23.62 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.163 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.411 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.559 ' N ' HD21 ' A' ' 43' ' ' ASN . 0.9 OUTLIER -60.81 -35.76 77.3 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.715 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.445 ' O ' ' N ' ' A' ' 48' ' ' VAL . 3.9 t70 -58.33 -51.66 68.87 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.526 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 61.4 mt -50.31 -50.14 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.805 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -62.92 -37.33 86.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.525 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -83.6 -10.07 58.49 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.06 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.445 ' N ' ' O ' ' A' ' 44' ' ' ASP . 27.5 t -76.3 116.86 20.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -51.73 134.39 30.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.681 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 113.49 -30.21 7.4 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 43.0 t -79.47 145.0 10.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.738 0.304 . . . . 0.0 110.202 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -103.11 -52.34 3.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.224 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 p -169.98 178.45 3.95 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.637 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 82.7 mt -138.59 151.4 24.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.184 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.405 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 17.9 t80 -138.23 107.59 6.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.005 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -94.57 131.64 40.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.248 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.448 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 1.5 p -165.59 156.9 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.444 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 7.7 ttm 44.0 -138.99 0.31 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.45 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -103.68 38.99 1.69 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.695 0.283 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.448 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 37.2 p90 -158.26 170.82 21.4 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.987 0.422 . . . . 0.0 111.009 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 58.0 mt -138.06 133.21 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.656 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 m -101.04 111.41 23.61 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.155 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.413 ' C ' ' HG1' ' A' ' 14' ' ' THR . 60.3 t -103.53 117.38 48.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.06 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 64' ' ' ASP . 0.2 OUTLIER -106.19 141.88 36.8 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.46 -179.632 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -121.78 -171.57 2.26 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.957 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -97.19 131.73 43.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -50.57 -26.68 5.57 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.84 0.353 . . . . 0.0 110.608 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -71.46 -33.22 69.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.66 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.87 -172.93 4.22 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.835 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -134.17 -175.36 3.83 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.277 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -99.06 -46.81 5.46 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.185 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.511 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 2.1 mp0 -53.26 -21.89 6.1 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.233 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.2 t -86.29 -43.78 12.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.163 0.506 . . . . 0.0 110.222 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -78.68 -37.77 21.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.838 -178.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.524 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.8 mp -47.65 -57.47 9.83 Favored Pre-proline 0 N--CA 1.467 0.396 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.0 Cg_exo -44.32 -32.25 5.08 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 122.497 2.131 . . . . 0.0 112.217 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -81.84 -41.21 21.37 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.249 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 85.9 t -60.67 -45.1 98.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.842 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -53.76 -40.98 66.67 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.575 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.27 -32.89 62.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.367 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.7 t -56.74 -66.63 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.887 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -83.26 27.23 0.59 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.754 0.311 . . . . 0.0 110.999 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -160.26 88.11 0.8 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.073 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.454 ' O ' ' CB ' ' A' ' 85' ' ' GLU . 0.4 OUTLIER -164.17 21.63 0.07 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.799 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.454 ' CB ' ' O ' ' A' ' 84' ' ' LEU . 4.2 tp10 83.32 123.71 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.29 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -109.14 115.2 29.58 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.658 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -152.05 -178.83 7.01 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.31 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -121.6 71.24 0.96 Allowed 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.076 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -45.47 120.23 2.45 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.6 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 78.4 t60 -155.99 -36.36 0.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.714 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . 0.412 ' HD1' ' C ' ' A' ' 91' ' ' HIS . 1.6 t-80 . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 117.815 -1.088 . . . . 0.0 110.48 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.525 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.489 1.499 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -150.77 158.53 44.26 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.918 -179.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 mt -80.81 122.96 36.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.159 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.5 mm -107.24 -19.11 6.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.609 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.4 t -167.62 126.8 1.32 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.98 0.419 . . . . 0.0 111.183 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.55 ' CG2' ' H ' ' A' ' 7' ' ' SER . 29.5 mt -98.87 178.6 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.271 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.55 ' H ' ' CG2' ' A' ' 6' ' ' ILE . 51.6 p -140.16 145.37 37.42 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.403 ' H ' ' H ' ' A' ' 9' ' ' THR . 1.8 tm-20 -161.2 -12.39 0.04 OUTLIER 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.751 0.786 . . . . 0.0 110.131 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.577 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 1.7 m -111.65 -38.8 0.11 Allowed Pre-proline 0 C--N 1.309 -1.156 0 CA-C-N 114.08 -1.418 . . . . 0.0 111.721 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 9' ' ' THR . 3.0 Cg_exo -71.6 -13.76 30.09 Favored 'Trans proline' 0 N--CA 1.491 1.364 0 C-N-CA 121.862 1.708 . . . . 0.0 111.941 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -145.19 -152.45 0.42 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.684 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.514 ' C ' ' H ' ' A' ' 14' ' ' THR . 13.9 t-160 -175.97 149.33 0.9 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.466 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 5.5 m120 69.36 -16.93 0.23 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.458 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.514 ' H ' ' C ' ' A' ' 12' ' ' HIS . 9.9 t -148.05 128.01 13.58 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.76 0.314 . . . . 0.0 110.449 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.49 ' SD ' ' O ' ' A' ' 7' ' ' SER . 52.2 mtm -107.91 143.73 36.13 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.674 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 131.66 44.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.836 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.6 mt -95.92 115.36 34.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.641 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.1 m -84.48 127.78 34.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.388 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.44 ' C ' ' H ' ' A' ' 21' ' ' GLU . 36.7 mt -99.57 -173.48 2.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.273 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 96.8 p -63.35 -1.79 1.24 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.706 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.44 ' H ' ' C ' ' A' ' 19' ' ' LEU . 62.7 mt-10 56.92 83.15 0.1 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.72 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.3 t -91.9 138.29 31.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.342 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 45.2 mtp85 -70.75 121.11 17.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.689 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 38.94 68.37 0.35 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.932 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -143.25 -38.89 0.07 OUTLIER Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 6.2 mmt -94.41 110.08 21.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.665 0.269 . . . . 0.0 110.516 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 75.3 p -76.73 -124.18 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.291 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 81.1 p -156.19 143.11 18.87 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.248 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -154.01 164.7 38.02 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.816 0.341 . . . . 0.0 110.822 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 57.5 m -144.84 115.19 7.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.886 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -104.28 132.39 50.58 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.341 0.591 . . . . 0.0 111.45 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.419 ' O ' ' CB ' ' A' ' 33' ' ' LYS . 11.9 p -120.6 57.42 0.96 Allowed 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER 89.52 106.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.792 -177.818 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.444 ' C ' ' O ' ' A' ' 33' ' ' LYS . 0.3 OUTLIER 15.57 108.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 114.47 -1.241 . . . . 0.0 113.378 -178.592 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.617 ' H ' ' NE2' ' A' ' 38' ' ' GLN . 8.7 p30 -158.4 -175.02 5.09 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.126 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 50.69 -100.2 0.08 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.436 0.16 . . . . 0.0 110.994 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.3 t -174.43 61.02 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.097 0.475 . . . . 0.0 110.867 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.617 ' NE2' ' H ' ' A' ' 35' ' ' ASP . 1.8 pm0 -82.53 153.68 68.25 Favored Pre-proline 0 N--CA 1.463 0.203 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.441 ' O ' ' N ' ' A' ' 42' ' ' ILE . 3.2 Cg_exo -55.0 137.6 76.64 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 121.716 1.611 . . . . 0.0 110.902 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.23 -38.98 9.14 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.424 0.63 . . . . 0.0 109.41 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -55.2 -34.82 64.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.429 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.441 ' N ' ' O ' ' A' ' 39' ' ' PRO . 2.4 mm -76.55 -22.7 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.3 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.41 ' N ' HD21 ' A' ' 43' ' ' ASN . 2.4 m120 -62.15 -36.34 81.54 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.551 ' O ' ' N ' ' A' ' 48' ' ' VAL . 6.2 m-20 -55.93 -53.6 54.84 Favored 'General case' 0 CA--C 1.523 -0.095 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.593 178.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 53.0 mt -47.71 -52.46 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.485 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -65.32 -37.42 87.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.901 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.8 mttm -82.22 -10.9 58.98 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.741 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.551 ' N ' ' O ' ' A' ' 44' ' ' ASP . 4.4 t -77.06 121.09 28.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.255 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -52.62 145.48 11.8 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.795 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.92 -29.95 10.24 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 86.7 t -78.29 150.66 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 120.813 0.339 . . . . 0.0 110.724 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.459 ' HZ3' ' CB ' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -109.07 -58.8 1.98 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.317 -179.454 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 91.6 p -166.38 -176.94 3.83 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.521 -178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 63.9 mt -137.74 152.21 26.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.985 0.421 . . . . 0.0 111.212 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -139.09 109.71 6.63 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.283 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -97.81 136.63 37.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.366 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.413 ' CG2' ' H ' ' A' ' 58' ' ' MET . 11.6 p -166.55 169.51 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.049 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.413 ' H ' ' CG2' ' A' ' 57' ' ' VAL . 3.1 ttm 41.03 -107.53 0.08 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.937 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -139.69 44.77 1.94 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.149 0.5 . . . . 0.0 109.949 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -161.96 168.76 22.31 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.604 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 75.2 mt -129.31 126.15 63.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.422 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.0 t -97.08 116.22 28.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.288 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 39.7 t -105.81 118.54 53.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.348 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -105.26 142.04 35.72 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.99 0.424 . . . . 0.0 110.54 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.426 ' NZ ' ' CD1' ' A' ' 71' ' ' TRP . 45.1 pttt -128.92 -171.1 2.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.666 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -98.39 137.86 36.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.507 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.485 ' N ' ' OD1' ' A' ' 67' ' ' ASN . 6.1 p-10 -54.18 -27.9 36.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.676 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.64 -33.02 74.92 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.98 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.95 177.51 6.94 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.899 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -131.68 163.19 28.69 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.75 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.432 ' CZ2' ' HG3' ' A' ' 15' ' ' MET . 54.7 m95 -77.88 -55.28 5.44 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.275 -179.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -46.87 -21.07 0.17 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.768 0.318 . . . . 0.0 111.06 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.3 m -88.23 -45.74 9.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.283 0.563 . . . . 0.0 110.467 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -84.22 -38.36 13.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.062 -178.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.567 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 0.9 OUTLIER -47.59 -55.1 18.11 Favored Pre-proline 0 N--CA 1.464 0.239 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 -178.851 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.4 Cg_exo -41.99 -33.06 2.03 Favored 'Trans proline' 0 N--CA 1.49 1.319 0 C-N-CA 122.545 2.163 . . . . 0.0 112.246 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.72 -51.46 7.68 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.329 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 45.1 t -43.87 -53.9 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.593 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -54.25 -40.83 68.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.638 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.18 -32.48 10.37 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.327 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.0 t -61.38 -59.64 3.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.56 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -85.7 44.55 1.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.016 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -160.59 -35.08 0.05 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.533 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 15.1 mt 39.72 56.16 2.39 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.892 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 42.22 -150.93 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.682 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -114.39 126.52 55.08 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 46.9 m-70 -151.55 -168.98 3.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.585 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 62.37 3.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.213 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.466 ' CG ' ' N ' ' A' ' 90' ' ' HIS . 16.1 t60 -60.6 -103.5 0.0 OUTLIER 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.197 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.466 ' N ' ' CG ' ' A' ' 89' ' ' HIS . 2.3 m-70 -130.96 -36.9 1.32 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.343 . . . . 0.0 110.124 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 14.2 t60 . . . . . 0 C--O 1.221 -0.408 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.459 179.782 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.2 mtm . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.4 mtmm -130.28 -169.93 2.23 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.337 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 55.3 mt -81.94 127.09 39.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.337 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 mp -109.19 -55.93 4.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.473 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.8 p -171.13 147.42 2.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.664 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mt -91.32 152.25 3.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.014 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 54.1 p -93.63 -157.82 0.57 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.741 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -72.96 154.8 40.38 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.976 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.555 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 0.3 OUTLIER -149.95 59.85 4.01 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.137 -179.254 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.555 ' HD3' ' N ' ' A' ' 9' ' ' THR . 2.8 Cg_endo -76.73 20.43 0.61 Allowed 'Trans proline' 0 C--N 1.308 -1.579 0 C-N-CA 122.645 2.23 . . . . 0.0 112.181 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -142.75 -16.92 0.69 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.689 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.445 ' CG ' ' H ' ' A' ' 13' ' ' ASN . 3.8 t60 63.27 -157.18 0.33 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.754 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.445 ' H ' ' CG ' ' A' ' 12' ' ' HIS . 16.5 m120 71.55 -51.79 0.69 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.21 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.492 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 8.8 t -145.72 129.24 16.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 0.0 111.164 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.9 mtm -109.77 158.71 17.85 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.369 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -97.6 124.23 41.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.376 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 54.5 mt -98.1 122.31 49.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.751 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 96.7 m -86.39 132.11 34.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.441 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.8 mt -102.02 174.13 6.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.334 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 88.8 p -65.18 -5.24 6.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.098 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 66.07 131.29 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.566 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.6 t -149.23 117.06 6.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.021 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 39.28 90.28 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.676 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 51.31 -91.31 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.855 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -156.13 -162.62 11.54 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -146.11 80.79 1.58 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.866 0.365 . . . . 0.0 110.172 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.0 t 38.79 -151.87 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.629 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.2 p -157.01 141.85 16.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.444 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -156.77 136.06 12.08 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.762 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.1 m -99.36 128.92 45.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.032 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.526 ' CZ ' ' HB3' ' A' ' 38' ' ' GLN . 54.0 m-85 -113.49 118.55 34.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.726 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.3 p -125.22 -12.01 6.91 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.356 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.474 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 19.7 pttm -155.38 31.87 0.38 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.612 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 33' ' ' LYS . 59.6 t 73.71 166.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.468 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.451 ' N ' ' CG1' ' A' ' 34' ' ' VAL . 33.3 t70 -155.6 -110.32 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.425 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -167.94 -39.45 0.02 OUTLIER 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.733 0.301 . . . . 0.0 110.435 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.0 t -57.92 -31.49 66.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.282 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.526 ' HB3' ' CZ ' ' A' ' 31' ' ' TYR . 2.5 pt20 -80.16 153.79 74.6 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.472 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -59.25 138.85 87.21 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.057 1.838 . . . . 0.0 111.386 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.61 -39.96 12.12 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.109 0.48 . . . . 0.0 109.885 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -54.28 -47.52 72.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.772 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.6 mm -55.91 -27.65 22.99 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.386 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.21 -43.92 97.75 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.75 -37.62 68.73 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.157 179.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.423 ' CG1' HG22 ' A' ' 81' ' ' VAL . 22.1 mt -62.5 -48.81 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.158 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.486 ' O ' HG22 ' A' ' 51' ' ' VAL . 51.1 mt -55.49 -32.9 63.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.838 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -78.81 -4.51 49.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.28 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.0 t -77.91 103.57 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -46.92 110.87 0.33 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.661 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 125.26 6.25 6.34 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.757 ' O ' ' N ' ' A' ' 53' ' ' SER . 0.0 OUTLIER -78.8 -21.65 12.9 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.204 0 CA-C-O 118.759 -0.639 . . . . 0.0 112.51 -179.51 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.9 ttmm 51.83 -64.19 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.231 0.469 . . . . 0.0 111.074 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.757 ' N ' ' O ' ' A' ' 51' ' ' VAL . 1.3 p -172.62 165.76 5.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.163 0.506 . . . . 0.0 111.654 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 83.4 mt -140.78 149.64 21.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.24 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -136.8 115.83 12.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.771 0.32 . . . . 0.0 111.006 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -100.2 132.94 45.28 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.977 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 6.2 p -164.37 153.27 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.825 0.345 . . . . 0.0 110.902 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 13.0 ttt 46.04 -106.83 0.13 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.185 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -133.15 16.5 4.14 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.647 0.261 . . . . 0.0 110.931 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -131.1 164.3 25.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.116 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.8 mt -133.9 130.08 55.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.146 -179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.09 109.56 21.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.7 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 14' ' ' THR . 59.6 t -101.17 119.74 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.682 ' O ' ' O ' ' A' ' 51' ' ' VAL . 0.9 OUTLIER -97.86 154.33 17.71 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.251 179.799 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.0 pttt -132.42 165.35 24.49 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.237 179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -52.4 168.84 0.09 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.204 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -34.97 -42.92 0.17 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.066 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -133.55 -54.2 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.139 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 48.84 -159.21 0.05 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.0 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -145.26 114.51 7.06 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.744 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -71.6 -38.4 70.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.169 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.11 -26.18 48.81 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.951 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.6 m -89.39 -45.84 9.17 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.108 0.48 . . . . 0.0 110.54 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.2 t -66.97 -39.43 83.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.715 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.446 ' CB ' ' CD ' ' A' ' 76' ' ' PRO . 1.4 mm? -49.26 -62.1 2.76 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.83 -0.168 . . . . 0.0 111.385 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' A' ' 75' ' ' LEU . 2.9 Cg_endo -50.29 -31.75 30.68 Favored 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.495 2.13 . . . . 0.0 112.556 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -78.32 -47.12 18.43 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.329 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.72 -39.38 70.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.475 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -55.78 -43.45 76.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.368 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.58 -34.02 48.75 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.378 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.423 HG22 ' CG1' ' A' ' 45' ' ' ILE . 12.9 t -60.4 -61.68 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.756 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -84.39 10.81 9.74 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.918 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -157.48 76.59 0.83 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.138 0.494 . . . . 0.0 110.179 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.409 ' CD1' ' H ' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -73.99 -78.93 0.09 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.885 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.99 147.27 38.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.154 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -63.8 127.96 33.7 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.221 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -84.08 86.99 7.13 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.63 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -163.64 89.94 0.61 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.645 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -98.11 -129.39 0.18 Allowed 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -76.96 168.21 20.5 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.471 0.177 . . . . 0.0 110.565 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.3 t60 . . . . . 0 C--O 1.218 -0.553 0 CA-C-O 117.824 -1.084 . . . . 0.0 110.65 179.873 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 ttt . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 32.1 pttt -169.72 -164.14 0.42 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.928 0.394 . . . . 0.0 111.111 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 96.7 mt -84.62 122.63 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.759 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.526 ' N ' ' CD1' ' A' ' 4' ' ' ILE . 1.8 mp -109.68 -31.73 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-O 121.203 0.525 . . . . 0.0 109.752 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.414 ' HG ' ' N ' ' A' ' 6' ' ' ILE . 48.0 t -167.88 158.03 10.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.159 -179.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.414 ' N ' ' HG ' ' A' ' 5' ' ' SER . 7.8 mt -148.14 111.56 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.063 0.459 . . . . 0.0 111.165 -179.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 26.1 p 43.83 -145.3 0.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.828 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.402 ' H ' ' H ' ' A' ' 9' ' ' THR . 1.0 OUTLIER -151.77 -8.32 0.22 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.066 0.936 . . . . 0.0 109.247 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.555 ' CG2' ' O ' ' A' ' 9' ' ' THR . 15.3 t -129.71 93.86 33.56 Favored Pre-proline 0 C--N 1.312 -1.052 0 CA-C-N 113.427 -1.715 . . . . 0.0 109.825 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -70.73 26.18 0.2 Allowed 'Trans proline' 0 C--N 1.302 -1.894 0 C-N-CA 122.358 2.039 . . . . 0.0 112.229 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.533 ' H ' ' C ' ' A' ' 9' ' ' THR . 58.3 t30 -141.95 89.67 2.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.124 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 45.1 t60 -155.32 -114.45 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.997 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -149.18 -35.27 0.18 Allowed 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.8 t -136.73 126.66 25.86 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.87 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.414 ' HG2' ' CH2' ' A' ' 71' ' ' TRP . 13.1 ptp -107.78 154.79 21.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.12 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.4 tttt -102.03 128.12 48.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.464 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.7 mt -99.14 114.12 36.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.91 0.386 . . . . 0.0 111.086 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 84.4 m -88.5 128.04 35.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.497 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.1 mt -102.06 161.48 13.65 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.531 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.42 -1.49 6.6 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.47 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -94.19 114.58 26.72 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.255 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 36.7 m -151.74 76.92 1.21 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.908 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.7 ttp85 -168.08 -5.45 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.644 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -166.47 -46.62 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.157 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.03 166.27 38.42 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 11.8 mtt -94.92 -82.77 0.36 Allowed 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.01 -0.276 . . . . 0.0 110.307 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.495 ' CG2' ' H ' ' A' ' 28' ' ' SER . 1.8 m -162.98 -143.67 0.08 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.885 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.495 ' H ' ' CG2' ' A' ' 27' ' ' THR . 11.7 p -156.08 130.3 8.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.245 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -162.28 138.54 7.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.283 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 52.0 m -98.76 148.12 24.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.27 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.401 ' CD1' ' OE1' ' A' ' 38' ' ' GLN . 22.7 m-85 -135.58 120.07 18.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.479 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.3 p -125.06 -7.49 7.16 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.531 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 34' ' ' VAL . 33.4 pttt -158.45 58.38 0.45 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.234 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.423 ' C ' ' O ' ' A' ' 33' ' ' LYS . 19.2 t 26.56 101.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 O-C-N 123.649 0.593 . . . . 0.0 112.521 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -159.49 -156.74 0.53 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.285 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 56.55 -100.24 0.11 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.841 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.5 t -168.2 63.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.401 ' OE1' ' CD1' ' A' ' 31' ' ' TYR . 9.6 mt-30 -92.9 144.9 29.21 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.16 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.462 ' O ' ' N ' ' A' ' 42' ' ' ILE . 3.1 Cg_exo -55.59 134.22 62.66 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 121.596 1.531 . . . . 0.0 110.201 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.408 ' C ' ' O ' ' A' ' 39' ' ' PRO . . . -41.29 -41.44 1.9 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.401 0.619 . . . . 0.0 109.852 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -52.69 -37.98 59.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.202 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.462 ' N ' ' O ' ' A' ' 39' ' ' PRO . 2.0 mm -70.01 -26.3 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.816 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.527 ' N ' HD21 ' A' ' 43' ' ' ASN . 1.0 OUTLIER -61.17 -38.47 86.6 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.673 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 48' ' ' VAL . 33.6 t70 -55.53 -53.79 52.07 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.829 179.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 84.4 mt -45.76 -53.76 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.241 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.5 mt -67.18 -36.88 82.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.871 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -81.18 -8.46 59.76 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.078 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.56 ' N ' ' O ' ' A' ' 44' ' ' ASP . 3.9 t -79.52 115.05 21.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -51.19 113.23 0.88 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.637 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 139.68 -39.94 1.47 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.5 t -78.62 147.75 6.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -108.95 -35.58 6.31 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.375 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.469 ' OG ' ' N ' ' A' ' 54' ' ' ILE . 3.1 t -172.96 176.54 3.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.123 0.487 . . . . 0.0 111.189 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.469 ' N ' ' OG ' ' A' ' 53' ' ' SER . 83.2 mt -137.11 154.5 31.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.655 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.438 ' HB3' ' HG ' ' A' ' 62' ' ' SER . 37.7 t80 -138.3 109.14 6.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.262 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -95.48 129.39 42.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.988 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.422 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 5.0 p -163.33 162.91 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.214 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.429 ' CG ' ' H ' ' A' ' 59' ' ' ASP . 3.1 ttt 37.29 -137.02 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.023 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.429 ' H ' ' CG ' ' A' ' 58' ' ' MET . 1.2 p30 -102.87 39.87 1.47 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.737 0.303 . . . . 0.0 110.663 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.422 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 38.6 p90 -161.88 169.58 21.0 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.965 0.412 . . . . 0.0 111.373 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.0 mp -138.19 135.4 44.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.431 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.438 ' HG ' ' HB3' ' A' ' 55' ' ' PHE . 0.3 OUTLIER -99.07 154.83 17.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.167 179.581 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.2 t -142.74 112.49 2.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.581 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.7 p-10 -99.04 143.46 29.3 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.011 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.485 ' NZ ' ' NE1' ' A' ' 71' ' ' TRP . 16.6 pttm -124.41 -176.23 3.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.524 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -90.59 129.83 36.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.082 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.34 -34.69 7.15 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -34.42 76.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.562 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.32 166.08 14.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.691 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -108.11 177.48 4.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.584 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.485 ' NE1' ' NZ ' ' A' ' 65' ' ' LYS . 12.2 m95 -98.05 -44.78 6.5 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.591 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.415 ' O ' ' CD ' ' A' ' 76' ' ' PRO . 2.7 pp20? -56.05 -21.27 20.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.673 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.423 ' CG2' ' N ' ' A' ' 74' ' ' VAL . 15.4 t -86.22 -44.65 11.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.313 0.577 . . . . 0.0 109.71 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.423 ' N ' ' CG2' ' A' ' 73' ' ' THR . 0.9 OUTLIER -75.39 -37.51 38.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.961 -179.813 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.451 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 2.5 mt -48.56 -61.34 3.31 Favored Pre-proline 0 N--CA 1.466 0.365 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.3 Cg_exo -42.51 -31.65 1.99 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 C-N-CA 122.415 2.076 . . . . 0.0 112.126 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.44 -41.97 23.52 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.07 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.4 t -52.36 -56.15 7.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.216 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -53.09 -33.95 54.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.022 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -54.4 -32.85 58.07 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.219 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.0 t -56.95 -64.37 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.018 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.452 ' CD1' ' N ' ' A' ' 82' ' ' PHE . 0.7 OUTLIER -85.22 29.88 0.63 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.101 -179.541 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -162.77 90.13 0.69 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.756 0.312 . . . . 0.0 110.821 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.442 ' O ' ' C ' ' A' ' 85' ' ' GLU . 0.5 OUTLIER -164.25 12.77 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.815 -179.718 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 84' ' ' LEU . 71.9 mm-40 30.61 67.63 0.12 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.702 0.287 . . . . 0.0 111.458 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 19.9 t-160 -61.84 -78.54 0.04 OUTLIER 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.879 0.371 . . . . 0.0 110.185 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -89.67 -170.32 2.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.63 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 34.0 p-80 -141.81 -4.32 1.08 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.6 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -54.23 133.18 44.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.386 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -64.45 114.62 4.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.822 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.178 179.724 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mtt . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -125.22 170.43 11.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.778 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.417 HG22 HD12 ' A' ' 3' ' ' ILE . 66.8 mt -81.7 126.34 39.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.799 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.3 mm -110.06 -17.71 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.205 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -169.99 137.54 1.62 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.796 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.501 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 2.1 mp -94.39 94.46 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.407 -179.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.451 ' CB ' ' H ' ' A' ' 16' ' ' LYS . 19.4 p 44.14 -149.21 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.356 178.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -115.38 -137.83 0.37 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.416 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.641 ' H ' ' CD ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -124.88 -40.37 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.878 -179.459 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.641 ' CD ' ' H ' ' A' ' 9' ' ' THR . 3.7 Cg_exo -71.11 9.9 0.77 Allowed 'Trans proline' 0 C--N 1.314 -1.28 0 C-N-CA 121.969 1.779 . . . . 0.0 112.121 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.416 ' H ' ' C ' ' A' ' 9' ' ' THR . 0.3 OUTLIER -93.99 169.15 10.49 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.238 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -172.24 -41.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.034 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -89.3 -19.4 25.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.01 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.6 t -149.25 126.48 11.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.425 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.652 ' SD ' ' CE2' ' A' ' 71' ' ' TRP . 6.7 mtp -108.21 132.21 53.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.39 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.451 ' H ' ' CB ' ' A' ' 7' ' ' SER . 10.7 ttmm -94.27 121.65 36.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.57 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 58.2 mt -93.6 126.3 46.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.844 0.354 . . . . 0.0 110.684 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.3 m -88.13 137.03 32.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.656 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.423 ' C ' ' H ' ' A' ' 21' ' ' GLU . 49.3 mt -114.98 155.02 27.71 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.398 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.7 p -68.64 2.99 2.07 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.916 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.423 ' H ' ' C ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -89.48 173.74 8.18 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.292 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.6 t -151.87 85.23 1.29 Allowed 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.65 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.415 ' O ' ' N ' ' A' ' 25' ' ' GLY . 25.3 ptt-85 36.45 -153.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 O-C-N 123.339 0.399 . . . . 0.0 110.635 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 36.36 32.48 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.778 0.323 . . . . 0.0 111.353 179.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 23' ' ' ARG . . . -171.68 -47.27 0.04 OUTLIER Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 8.0 mmm -91.44 114.1 26.55 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.344 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.0 m -73.59 -131.53 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.243 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.3 p -156.98 133.77 10.17 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.615 0.245 . . . . 0.0 110.419 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -156.43 130.12 8.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.499 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.69 150.5 21.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.403 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -130.76 117.53 19.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.975 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.7 p -118.69 -10.22 10.05 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.187 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.526 ' CB ' ' HZ2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -159.11 48.89 0.33 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.816 179.733 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.442 ' CG1' ' N ' ' A' ' 35' ' ' ASP . 53.8 t 53.68 167.69 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.488 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.442 ' N ' ' CG1' ' A' ' 34' ' ' VAL . 13.2 m-20 -160.07 -101.93 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.496 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.42 ' C ' ' N ' ' A' ' 38' ' ' GLN . 24.2 t0 -172.48 -50.23 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.455 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.8 m -49.49 -15.35 0.15 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.852 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.42 ' N ' ' C ' ' A' ' 36' ' ' ASP . 1.4 pt20 -93.48 147.52 33.82 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.14 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -55.77 137.59 78.93 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 C-N-CA 121.805 1.67 . . . . 0.0 110.584 179.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.97 -39.09 8.44 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.321 0.582 . . . . 0.0 109.463 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -55.75 -31.03 62.2 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.264 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.7 mm -77.02 -24.53 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 N-CA-C 110.156 -0.312 . . . . 0.0 110.156 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.419 ' ND2' ' CG ' ' A' ' 38' ' ' GLN . 9.2 m120 -62.53 -39.65 94.26 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.585 ' O ' ' N ' ' A' ' 48' ' ' VAL . 25.4 t70 -57.7 -52.14 66.66 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.789 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.408 HD11 HG21 ' A' ' 45' ' ' ILE . 56.4 mt -45.41 -52.95 2.06 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.472 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 26.5 mt -61.62 -38.07 86.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.053 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.6 mtpt -84.61 -6.88 59.39 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.172 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.585 ' N ' ' O ' ' A' ' 44' ' ' ASP . 3.7 t -79.86 119.4 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.038 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -52.99 126.24 19.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.82 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 127.22 -39.34 1.96 Allowed Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.5 t -79.75 147.96 6.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.76 0.314 . . . . 0.0 110.735 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -108.97 -34.55 6.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.709 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.1 t -174.09 179.12 1.97 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.067 0.461 . . . . 0.0 110.968 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.0 mt -145.9 138.98 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.075 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -126.6 112.79 15.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.086 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.2 t-160 -93.53 131.24 38.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.418 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.505 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 2.0 p -164.02 156.58 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.837 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.6 ttt 41.27 -141.43 0.08 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.494 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -100.31 27.67 5.53 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 121.173 -0.211 . . . . 0.0 111.069 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.505 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 14.1 p90 -144.62 169.69 17.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.995 0.426 . . . . 0.0 111.056 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.2 mt -136.45 136.86 48.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.307 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.11 110.14 22.12 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.481 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.6 t -98.7 112.5 30.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.683 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 -104.29 134.01 48.23 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.469 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.3 pttt -122.09 -172.91 2.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.404 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -96.32 127.13 42.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.462 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -45.86 -24.75 0.43 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.969 0.414 . . . . 0.0 110.461 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -68.61 -35.22 77.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.004 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.09 163.05 17.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.755 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -111.59 174.03 6.06 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.487 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.652 ' CE2' ' SD ' ' A' ' 15' ' ' MET . 41.0 m95 -92.52 -48.07 6.81 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.019 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -50.59 -22.31 1.95 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.782 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.473 ' CG2' ' N ' ' A' ' 74' ' ' VAL . 4.7 t -88.88 -44.26 10.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.284 0.564 . . . . 0.0 110.166 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.473 ' N ' ' CG2' ' A' ' 73' ' ' THR . 0.9 OUTLIER -77.47 -37.65 25.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.321 -179.16 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.489 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.0 OUTLIER -48.42 -60.25 4.77 Favored Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.479 -179.109 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.7 Cg_exo -42.91 -31.31 2.16 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.507 2.138 . . . . 0.0 111.893 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -81.4 -41.1 22.42 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.08 -53.76 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.035 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -51.39 -40.97 60.32 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.635 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.41 -33.09 42.14 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.97 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.1 t -58.85 -63.12 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.753 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -83.65 23.36 0.97 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.887 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -155.99 95.25 1.61 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.053 0.454 . . . . 0.0 110.16 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.486 ' CD1' ' H ' ' A' ' 85' ' ' GLU . 0.3 OUTLIER -159.69 -107.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.307 179.635 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.486 ' H ' ' CD1' ' A' ' 84' ' ' LEU . 11.5 mm-40 44.3 -162.54 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.718 0.294 . . . . 0.0 110.607 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -78.98 149.21 32.32 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.4 ' ND1' ' C ' ' A' ' 87' ' ' HIS . 13.6 t-80 -82.19 -53.76 5.81 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 65.3 112.17 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.233 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -73.83 107.68 6.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.666 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -171.76 3.66 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.132 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 118.195 -0.907 . . . . 0.0 111.078 -179.977 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.418 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 36.7 pttt -150.81 -163.99 1.91 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.398 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.41 HG22 HD13 ' A' ' 3' ' ' ILE . 82.0 mt -80.21 131.7 33.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.766 0.317 . . . . 0.0 110.842 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.42 ' N ' ' CD1' ' A' ' 4' ' ' ILE . 1.7 mp -108.56 -47.61 7.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.007 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.5 p -172.1 148.67 2.24 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.896 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.565 ' CG2' ' H ' ' A' ' 7' ' ' SER . 34.9 mt -92.52 178.98 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.028 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.565 ' H ' ' CG2' ' A' ' 6' ' ' ILE . 12.3 t -92.56 -163.82 1.1 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.507 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -90.16 -6.27 55.52 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.84 0.828 . . . . 0.0 110.462 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.463 ' C ' ' H ' ' A' ' 11' ' ' ASN . 11.6 t -123.09 55.15 7.31 Favored Pre-proline 0 C--N 1.311 -1.087 0 CA-C-N 113.931 -1.486 . . . . 0.0 110.22 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.418 ' CD ' ' N ' ' A' ' 9' ' ' THR . 2.3 Cg_endo -52.52 -3.67 0.11 Allowed 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 122.924 2.416 . . . . 0.0 113.169 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.463 ' H ' ' C ' ' A' ' 9' ' ' THR . 0.5 OUTLIER -137.47 -159.48 0.96 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.572 0.225 . . . . 0.0 110.563 -179.242 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.449 ' CD2' ' N ' ' A' ' 12' ' ' HIS . 3.7 m170 79.49 77.26 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.104 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.4 m120 67.04 -54.96 0.45 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.492 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.2 t -147.84 157.13 43.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.886 0.374 . . . . 0.0 110.971 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.75 161.3 35.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.44 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.438 ' HG2' ' H ' ' A' ' 17' ' ' ILE . 6.7 ttmm -92.03 162.44 14.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.805 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.438 ' H ' ' HG2' ' A' ' 16' ' ' LYS . 71.3 mt -138.68 113.96 8.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.14 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.8 m -84.9 119.2 25.08 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.255 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.589 ' C ' ' H ' ' A' ' 21' ' ' GLU . 64.4 mt -104.5 166.96 10.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.379 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.8 m -69.6 34.3 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.321 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.589 ' H ' ' C ' ' A' ' 19' ' ' LEU . 10.0 mm-40 -87.08 -170.31 3.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.299 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.566 ' O ' ' CB ' ' A' ' 23' ' ' ARG . 34.3 t -149.06 -29.9 0.26 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.23 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.566 ' CB ' ' O ' ' A' ' 22' ' ' SER . 40.2 ttt180 102.29 155.81 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 113.588 -1.642 . . . . 0.0 109.612 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.468 ' CB ' ' O ' ' A' ' 23' ' ' ARG . 6.6 tt0 83.53 27.29 0.1 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.669 -178.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -151.2 -43.34 0.02 OUTLIER Glycine 0 CA--C 1.527 0.827 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 14.8 mtt -91.24 125.28 35.96 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.786 0.327 . . . . 0.0 110.865 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.8 t -75.91 -135.88 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.214 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.2 p -155.73 135.25 12.47 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.673 0.273 . . . . 0.0 110.553 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -158.7 142.13 14.99 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.24 148.56 26.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.324 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -129.73 111.99 13.19 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.201 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.2 p -123.62 -0.83 8.57 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.088 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 35.6 mtmt -151.77 25.44 0.66 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.738 0.304 . . . . 0.0 110.84 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.484 ' CG1' ' N ' ' A' ' 35' ' ' ASP . 60.0 t 54.85 170.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.052 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.484 ' N ' ' CG1' ' A' ' 34' ' ' VAL . 12.6 t0 70.54 99.1 0.06 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.546 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -172.73 21.08 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.091 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.1 p 76.93 13.49 2.16 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.169 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.46 174.2 6.5 Favored Pre-proline 0 N--CA 1.465 0.279 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -71.68 129.04 15.02 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.32 2.013 . . . . 0.0 111.192 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.68 -36.88 7.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.958 0.409 . . . . 0.0 110.342 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 -54.49 -32.94 58.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.841 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.0 mm -76.52 -20.81 14.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.285 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.498 ' N ' HD21 ' A' ' 43' ' ' ASN . 1.8 m120 -62.65 -40.18 96.2 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.411 ' O ' ' N ' ' A' ' 48' ' ' VAL . 21.5 m-20 -57.11 -52.5 65.06 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.726 178.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.8 mt -49.04 -49.76 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.599 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.9 mt -63.34 -36.8 84.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.687 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -83.16 -10.9 58.38 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.22 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.411 ' N ' ' O ' ' A' ' 44' ' ' ASP . 19.7 t -76.3 124.9 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.911 0.386 . . . . 0.0 110.165 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 49' ' ' GLU . 1.8 pm0 -51.14 138.54 19.95 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.142 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 106.35 -35.59 4.95 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.762 -0.935 . . . . 0.0 110.762 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 31.3 t -78.71 138.61 19.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.867 0.365 . . . . 0.0 110.63 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -103.04 -55.13 2.48 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.129 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 64.7 m -161.19 -179.49 7.5 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.465 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 93.7 mt -138.02 153.02 26.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.12 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.4 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 20.2 t80 -139.1 110.58 7.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.462 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -98.42 133.09 43.29 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.437 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.4 ' HB ' ' CZ ' ' A' ' 55' ' ' PHE . 9.3 p -164.5 158.74 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.715 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.409 ' CG ' ' H ' ' A' ' 59' ' ' ASP . 0.2 OUTLIER 46.22 -137.98 0.61 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.383 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.409 ' H ' ' CG ' ' A' ' 58' ' ' MET . 20.3 p-10 -105.06 44.04 1.06 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.001 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -165.75 172.27 11.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.777 0.322 . . . . 0.0 110.653 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 68.7 mt -135.13 143.55 36.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.385 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.3 t -114.46 114.32 25.65 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.713 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.2 t -99.53 111.93 30.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.886 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.28 146.85 27.43 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.955 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.407 ' HZ2' ' C ' ' A' ' 70' ' ' ASN . 11.5 ptpt -124.52 -164.01 1.22 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.138 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -66.11 -153.6 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.684 0.278 . . . . 0.0 110.506 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.04 -48.2 73.74 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.746 0.308 . . . . 0.0 110.367 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -154.06 -42.98 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.453 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 46.79 -137.45 0.72 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.738 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.425 ' N ' ' OD1' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -141.88 135.42 29.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.036 179.724 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -91.53 -45.17 8.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.942 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -54.63 -21.93 12.02 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.85 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.452 ' CG2' ' N ' ' A' ' 74' ' ' VAL . 6.0 t -86.02 -44.11 12.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.115 0.483 . . . . 0.0 110.16 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.452 ' N ' ' CG2' ' A' ' 73' ' ' THR . 1.1 t -74.26 -38.75 48.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.485 -179.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.1 mp -48.58 -58.97 6.94 Favored Pre-proline 0 N--CA 1.465 0.299 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 2.9 Cg_endo -46.39 -32.45 11.0 Favored 'Trans proline' 0 N--CA 1.491 1.334 0 C-N-CA 122.471 2.114 . . . . 0.0 111.931 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.68 -42.07 22.65 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.962 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 74.3 t -58.62 -43.84 88.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.095 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -53.7 -44.86 70.13 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.031 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.38 -32.71 40.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.396 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.2 t -57.84 -62.75 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.469 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -87.9 -33.84 18.36 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -79.56 50.34 1.12 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.828 0.347 . . . . 0.0 111.351 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.3 mt -77.46 52.45 0.96 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.107 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -72.02 117.32 13.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.986 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -95.06 -83.15 0.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.038 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.3 t-160 -154.9 -42.91 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.782 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -67.45 134.58 51.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.121 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -56.22 156.21 5.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.564 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -142.55 82.23 1.77 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.058 0.456 . . . . 0.0 110.702 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.219 -0.51 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.158 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.494 ' H2 ' ' H ' ' A' ' 20' ' ' SER . 23.1 mtt . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.9 pttt -149.68 56.88 0.98 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.691 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 39.6 mt 57.43 101.83 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.605 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.6 mm -102.72 -17.72 6.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.798 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.0 t -168.07 118.2 0.79 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.481 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.453 ' CG2' ' N ' ' A' ' 7' ' ' SER . 5.4 mm -93.98 154.32 3.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.852 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.453 ' N ' ' CG2' ' A' ' 6' ' ' ILE . 15.1 t 62.22 140.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.276 -0.875 . . . . 0.0 112.399 178.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -173.7 -7.63 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.572 -1.195 . . . . 0.0 109.91 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 11' ' ' ASN . 23.6 m -105.6 131.52 21.68 Favored Pre-proline 0 C--N 1.311 -1.078 0 CA-C-N 113.907 -1.497 . . . . 0.0 109.186 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -58.64 3.52 0.15 Allowed 'Trans proline' 0 C--N 1.307 -1.614 0 C-N-CA 121.944 1.763 . . . . 0.0 112.745 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.492 ' H ' ' C ' ' A' ' 9' ' ' THR . 35.8 t30 -91.28 179.04 5.81 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.4 p-80 -140.36 -3.48 1.35 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.261 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -85.05 -16.78 39.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.822 0.344 . . . . 0.0 110.352 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.492 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 4.3 t -150.63 131.91 14.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.579 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 63.0 mtm -100.04 156.87 16.93 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.401 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.81 120.7 37.63 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.29 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.8 mt -97.56 110.32 25.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.485 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.2 m -85.2 139.91 31.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.473 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.7 mt -113.69 151.28 32.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.496 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.494 ' H ' ' H2 ' ' A' ' 1' ' ' MET . 41.9 t -67.27 -2.25 5.7 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.194 179.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.421 ' C ' ' HG ' ' A' ' 22' ' ' SER . 0.1 OUTLIER -90.83 158.41 16.83 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.636 -179.527 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.421 ' HG ' ' C ' ' A' ' 21' ' ' GLU . 14.9 m -147.48 -161.98 1.45 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.927 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.459 ' O ' ' N ' ' A' ' 25' ' ' GLY . 11.3 mtt85 41.53 -142.88 0.07 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.497 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 36.84 -92.49 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.394 0.434 . . . . 0.0 111.126 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 23' ' ' ARG . . . 147.5 -13.98 1.4 Allowed Glycine 0 CA--C 1.523 0.569 0 N-CA-C 110.864 -0.894 . . . . 0.0 110.864 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 10.8 tpp 52.81 23.19 2.65 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.819 0.342 . . . . 0.0 110.111 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.2 p 48.9 -162.86 0.03 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.693 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.2 p -156.76 135.23 11.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.332 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -157.38 143.86 17.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 27.6 m -102.05 121.55 42.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.79 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.423 ' CD1' ' NE2' ' A' ' 38' ' ' GLN . 25.7 m-85 -107.14 114.51 28.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.845 0.355 . . . . 0.0 110.595 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.1 p -132.96 1.72 3.59 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.889 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -157.74 25.84 0.28 Allowed 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.935 -0.306 . . . . 0.0 111.437 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.531 ' CG1' ' H ' ' A' ' 35' ' ' ASP . 13.9 t 50.2 177.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.264 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.531 ' H ' ' CG1' ' A' ' 34' ' ' VAL . 9.8 m-20 58.08 94.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -168.14 -43.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.919 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.5 t 164.65 -22.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.68 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.423 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 0.9 OUTLIER -49.39 147.8 5.26 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.985 -179.662 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -56.8 141.23 92.6 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.229 1.953 . . . . 0.0 111.33 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -47.82 -42.69 26.82 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -54.13 -37.08 63.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.676 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.0 mm -71.67 -24.96 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.383 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.531 ' N ' HD21 ' A' ' 43' ' ' ASN . 1.5 m120 -60.41 -40.84 92.39 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -55.48 -44.46 76.52 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.922 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.49 ' O ' HG23 ' A' ' 51' ' ' VAL . 19.3 mt -58.08 -62.7 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.192 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.368 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 49.0 mt -43.15 -35.52 1.39 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.799 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -81.74 -13.83 57.28 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.8 t -77.29 119.46 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.827 0.346 . . . . 0.0 110.616 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -54.49 143.75 23.25 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.827 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 90.31 -0.55 78.27 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.666 ' O ' ' N ' ' A' ' 53' ' ' SER . 4.1 t -80.41 -19.28 12.0 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt 52.34 -68.1 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 123.412 0.685 . . . . 0.0 111.233 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.666 ' N ' ' O ' ' A' ' 51' ' ' VAL . 18.5 p -174.62 174.45 2.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.107 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 86.1 mt -135.55 147.07 28.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.642 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -135.04 108.75 8.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.253 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -93.8 129.39 40.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.281 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 8.4 p -162.92 148.18 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.126 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.415 ' CG ' ' H ' ' A' ' 59' ' ' ASP . 7.2 tpp 50.28 -146.3 0.42 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.394 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.415 ' H ' ' CG ' ' A' ' 58' ' ' MET . 40.4 p-10 -95.83 43.33 1.08 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.619 0.247 . . . . 0.0 111.482 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -163.62 173.7 12.65 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.8 0.333 . . . . 0.0 110.84 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 14.3 mt -137.95 132.9 44.11 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.608 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 t -100.58 109.09 21.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.13 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.3 t -99.95 110.18 26.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.538 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.633 ' O ' ' O ' ' A' ' 51' ' ' VAL . 1.4 m-20 -89.43 146.46 24.63 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.291 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.0 pttp -120.15 171.6 8.36 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.313 0.383 . . . . 0.0 110.392 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.434 ' O ' ' C ' ' A' ' 67' ' ' ASN . 0.3 OUTLIER -58.49 -176.64 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.97 -179.583 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.434 ' C ' ' O ' ' A' ' 66' ' ' GLU . 2.6 m120 -32.06 -60.25 0.27 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.058 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -138.25 -52.19 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.899 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 47.92 -150.25 0.14 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.06 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -142.44 125.08 15.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.467 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 39.6 m95 -73.5 -45.53 53.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.209 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -56.35 -21.34 23.97 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.077 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 m -86.29 -45.08 11.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.197 0.523 . . . . 0.0 110.128 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.97 -38.96 44.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.435 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.489 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.5 mt -49.26 -58.05 9.97 Favored Pre-proline 0 N--CA 1.464 0.232 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -46.17 -32.33 10.14 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 122.171 1.914 . . . . 0.0 111.474 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -80.9 -41.31 23.22 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 48.4 t -66.5 -41.77 89.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.537 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -54.02 -42.62 69.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.735 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.98 -32.75 15.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.154 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 11.3 t -59.67 -63.33 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.443 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -86.71 -29.96 22.03 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 121.004 -0.279 . . . . 0.0 111.514 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.485 ' C ' ' H ' ' A' ' 85' ' ' GLU . 8.7 tt0 -79.04 57.36 2.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.056 0.455 . . . . 0.0 110.676 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.9 mt -76.58 36.83 0.16 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.35 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.485 ' H ' ' C ' ' A' ' 83' ' ' GLU . 2.3 pt-20 33.2 80.27 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.531 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -58.99 127.47 32.38 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.436 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 32.6 t-80 -152.91 -59.75 0.14 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.382 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -55.29 151.7 9.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.374 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.424 ' H ' ' HD1' ' A' ' 89' ' ' HIS . 21.2 m80 -56.4 174.29 0.14 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.862 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -44.05 147.33 0.52 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.06 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.066 -0.968 . . . . 0.0 110.767 -179.954 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpp? . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -135.03 161.78 34.33 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.545 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.7 mt -80.71 110.38 16.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.636 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.5 mm -104.94 -24.34 4.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.448 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -165.94 125.55 1.67 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.872 0.368 . . . . 0.0 111.198 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.507 ' CG2' ' H ' ' A' ' 7' ' ' SER . 26.5 mt -95.64 178.72 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.507 ' H ' ' CG2' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -142.12 113.7 7.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.997 0.427 . . . . 0.0 110.327 179.696 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.48 140.96 29.59 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.85 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.05 171.88 6.24 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.781 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -71.68 -12.35 28.9 Favored 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.287 1.991 . . . . 0.0 111.399 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -102.3 112.81 25.65 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.217 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.534 ' O ' ' CG ' ' A' ' 12' ' ' HIS . 24.1 p-80 -98.28 83.47 3.07 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.086 0.469 . . . . 0.0 110.669 -179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.486 ' C ' ' HZ2' ' A' ' 65' ' ' LYS . 24.5 t-20 -153.08 -31.86 0.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.996 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.8 t -146.73 128.18 14.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.835 0.35 . . . . 0.0 110.613 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 33.3 mtm -109.01 154.12 22.65 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.555 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.5 mtpt -106.75 118.72 37.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.294 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.411 HD13 HG21 ' A' ' 17' ' ' ILE . 56.7 mt -96.28 121.99 47.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.709 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.1 m -86.79 124.5 33.11 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.415 ' C ' ' H ' ' A' ' 21' ' ' GLU . 27.5 mt -96.01 -154.09 0.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.322 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.8 m -63.91 -3.06 2.19 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.636 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' A' ' 19' ' ' LEU . 26.8 mt-10 57.81 91.85 0.04 OUTLIER 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.846 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 6.3 m -89.51 -170.15 2.74 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.509 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.42 ' O ' ' C ' ' A' ' 24' ' ' GLU . 0.2 OUTLIER -72.92 63.67 0.66 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.194 -179.445 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.42 ' C ' ' O ' ' A' ' 23' ' ' ARG . 27.0 mt-10 34.44 53.99 0.61 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.047 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.521 ' C ' ' H ' ' A' ' 27' ' ' THR . . . -146.06 -91.45 0.11 Allowed Glycine 0 CA--C 1.523 0.588 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.0 tpp 49.63 9.06 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.547 0.213 . . . . 0.0 111.068 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.521 ' H ' ' C ' ' A' ' 25' ' ' GLY . 0.6 OUTLIER 69.55 -161.51 0.17 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -178.867 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.419 ' H ' ' CG2' ' A' ' 27' ' ' THR . 97.8 p -159.06 144.73 16.33 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.306 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -161.14 156.68 24.72 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.787 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -132.18 128.1 37.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.454 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -107.03 128.83 54.71 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.478 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.8 p -117.76 4.51 12.26 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.485 ' O ' ' CG2' ' A' ' 34' ' ' VAL . 8.9 ttmm -155.55 -100.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.291 -1.322 . . . . 0.0 109.185 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.485 ' CG2' ' O ' ' A' ' 33' ' ' LYS . 59.5 t -166.27 97.72 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 114.686 -1.143 . . . . 0.0 109.823 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.416 ' C ' ' H ' ' A' ' 37' ' ' SER . 2.5 t0 -161.87 -147.88 0.14 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.304 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 62.66 3.75 1.22 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.968 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.416 ' H ' ' C ' ' A' ' 35' ' ' ASP . 3.4 p 65.8 17.65 10.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.342 -179.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.538 HE21 ' ND2' ' A' ' 43' ' ' ASN . 3.2 pt20 -55.52 175.81 0.19 Allowed Pre-proline 0 CA--C 1.528 0.105 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.77 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.436 ' CD ' ' HB2' ' A' ' 38' ' ' GLN . 3.7 Cg_exo -71.11 125.57 11.57 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 121.911 1.741 . . . . 0.0 111.4 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.52 -37.72 5.64 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.155 0.502 . . . . 0.0 109.978 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -53.79 -33.42 55.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.398 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.2 mm -78.58 -19.77 13.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.317 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.538 ' ND2' HE21 ' A' ' 38' ' ' GLN . 2.0 m120 -62.3 -37.69 86.53 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.584 ' O ' ' N ' ' A' ' 48' ' ' VAL . 22.6 t0 -57.78 -50.7 72.37 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.825 178.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.6 mt -48.66 -51.94 10.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.584 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.3 mt -65.14 -38.1 89.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.983 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 37.9 mttm -83.95 -9.82 58.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.722 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.584 ' N ' ' O ' ' A' ' 44' ' ' ASP . 2.6 t -78.21 123.66 35.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 -49.96 133.74 22.2 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.722 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.6 -44.68 1.39 Allowed Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 94.8 t -79.72 138.56 19.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.799 0.333 . . . . 0.0 110.413 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.457 ' NZ ' ' O ' ' A' ' 65' ' ' LYS . 5.6 ttpm? -105.49 -33.08 8.24 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.111 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -176.43 179.53 1.18 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.511 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 76.8 mt -141.06 153.36 20.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.775 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -140.11 107.56 5.56 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.55 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.424 ' CD2' ' N ' ' A' ' 57' ' ' VAL . 10.4 t-160 -96.11 142.22 28.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.906 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.429 HG13 ' SD ' ' A' ' 58' ' ' MET . 13.1 p -162.47 164.9 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.828 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.561 ' CG ' ' H ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER 27.96 -90.1 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.894 -179.602 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.561 ' H ' ' CG ' ' A' ' 58' ' ' MET . 8.5 p-10 -144.7 42.85 1.36 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.954 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.479 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 8.5 p90 -163.96 151.0 11.9 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.569 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 77.6 mt -113.99 134.49 56.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.518 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.5 t -106.58 111.62 24.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.556 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 16.0 t -99.17 106.03 18.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -96.13 138.85 33.15 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.883 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.503 ' NZ ' ' HE1' ' A' ' 71' ' ' TRP . 2.1 pttm -116.54 -171.59 2.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.212 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.429 ' O ' ' ND2' ' A' ' 13' ' ' ASN . 19.4 mt-10 -61.64 -151.89 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.41 0.444 . . . . 0.0 110.834 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.421 ' OD1' ' N ' ' A' ' 68' ' ' ASP . 5.5 p30 -64.95 -44.5 89.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.315 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.421 ' N ' ' OD1' ' A' ' 67' ' ' ASN . 1.9 t0 -143.4 -53.91 0.37 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.821 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.18 -151.78 0.22 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.486 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -140.56 129.93 23.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.299 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.503 ' HE1' ' NZ ' ' A' ' 65' ' ' LYS . 30.1 m95 -85.15 -44.28 13.09 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.519 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.47 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 16.6 mp0 -55.23 -22.42 17.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.158 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.7 m -90.9 -45.43 8.77 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.102 0.477 . . . . 0.0 110.641 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.25 -38.62 18.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.441 -178.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.53 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 4.4 tt -48.54 -58.08 9.2 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.306 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 2.8 Cg_endo -44.31 -31.24 4.21 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 122.587 2.192 . . . . 0.0 112.072 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -81.22 -49.45 10.77 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.181 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.3 t -50.39 -53.52 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.596 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -55.06 -40.61 70.49 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.824 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -51.87 -33.01 34.61 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.844 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.7 t -58.89 -54.39 34.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -84.98 39.76 0.78 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.42 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.548 ' C ' ' H ' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -159.91 -78.36 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.055 179.747 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 14.4 mt 70.31 -35.26 0.32 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.894 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.548 ' H ' ' C ' ' A' ' 83' ' ' GLU . 1.3 tm-20 -70.42 132.7 46.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.254 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.465 ' C ' ' HD1' ' A' ' 86' ' ' HIS . 1.7 p80 -50.54 162.36 0.25 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.936 0.398 . . . . 0.0 111.31 -179.143 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.443 ' CG ' ' O ' ' A' ' 87' ' ' HIS . 21.9 p-80 -157.01 91.38 1.19 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.25 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.6 m170 -73.9 -132.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.134 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 38.8 t60 -158.65 -51.22 0.06 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.43 . . . . 0.0 109.997 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -59.6 145.54 44.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.455 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . 0.404 ' CG ' ' O ' ' A' ' 91' ' ' HIS . 12.2 t-80 . . . . . 0 C--O 1.221 -0.4 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.794 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.8 mtt . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -141.83 -163.21 1.53 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.564 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.6 mt -80.45 123.86 37.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.42 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.1 mm -109.59 -44.65 6.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.6 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 t -171.08 153.58 3.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.529 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.445 HD11 HG22 ' A' ' 6' ' ' ILE . 1.1 mm -97.41 -161.63 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 42.0 m -147.88 73.52 1.27 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.776 0.322 . . . . 0.0 110.404 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' A' ' 8' ' ' GLU . 0.8 OUTLIER -41.27 130.64 2.86 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.258 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.5 ' HG1' ' H ' ' A' ' 11' ' ' ASN . 1.3 t -148.27 148.38 28.92 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.292 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -49.44 -13.55 0.45 Allowed 'Trans proline' 0 C--N 1.311 -1.441 0 C-N-CA 122.429 2.086 . . . . 0.0 111.895 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.5 ' H ' ' HG1' ' A' ' 9' ' ' THR . 3.1 t-20 -98.41 163.55 12.65 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.406 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.47 ' C ' ' H ' ' A' ' 14' ' ' THR . 56.1 m80 -140.03 -144.86 0.17 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.041 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.476 ' O ' ' N ' ' A' ' 65' ' ' LYS . 1.2 m120 70.05 -41.68 0.49 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.854 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.47 ' H ' ' C ' ' A' ' 12' ' ' HIS . 11.1 t -148.35 135.46 20.23 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.656 0.265 . . . . 0.0 110.347 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.415 ' HG2' ' CZ2' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -114.75 164.61 13.82 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.992 -179.698 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -99.7 127.7 45.82 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.254 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.1 mt -99.03 121.95 50.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.344 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.0 m -87.76 134.03 33.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.593 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 15.8 mt -105.04 165.14 11.29 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.88 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t -70.18 -8.22 48.11 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -98.17 99.45 10.7 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.526 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.425 ' O ' ' C ' ' A' ' 23' ' ' ARG . 7.3 t -90.85 179.92 5.66 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.797 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 24' ' ' GLU . 37.7 mmm-85 33.04 -122.96 0.08 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.81 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.435 ' C ' ' O ' ' A' ' 23' ' ' ARG . 2.4 mp0 34.01 -106.93 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 O-C-N 123.319 0.387 . . . . 0.0 110.595 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 134.52 127.93 2.77 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 8.3 mtt -92.64 -92.91 0.16 Allowed 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.409 HG22 ' H ' ' A' ' 28' ' ' SER . 1.1 m -163.13 -141.53 0.06 Allowed 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.409 ' H ' HG22 ' A' ' 27' ' ' THR . 96.9 p -158.69 135.92 9.94 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.22 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -156.09 135.39 12.22 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.527 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.3 m -104.02 121.42 43.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.187 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -114.11 114.46 26.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.959 0.409 . . . . 0.0 110.949 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.7 p -124.38 -7.08 7.57 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.481 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.523 ' O ' ' CG ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -158.41 50.96 0.4 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.955 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.447 ' CG1' ' N ' ' A' ' 35' ' ' ASP . 47.4 t 52.68 168.96 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.121 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.47 ' N ' ' OE1' ' A' ' 38' ' ' GLN . 46.2 t0 -162.62 -106.38 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.558 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -169.09 -52.08 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.522 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.9 p -48.39 -21.9 0.61 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.716 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.47 ' OE1' ' N ' ' A' ' 35' ' ' ASP . 2.3 pt20 -86.99 147.06 41.99 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.499 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -54.67 136.32 70.5 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 121.64 1.56 . . . . 0.0 110.716 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -47.31 -37.08 10.24 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -55.16 -34.82 64.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.441 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.9 mm -72.9 -22.02 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.581 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -62.1 -40.46 95.94 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 178.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -55.5 -51.9 65.46 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.173 179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.469 ' O ' HG21 ' A' ' 51' ' ' VAL . 9.0 mt -49.34 -60.65 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.684 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 68.1 mt -46.61 -35.14 5.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.224 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -14.39 58.14 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.513 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.13 109.85 12.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 120.845 0.355 . . . . 0.0 110.224 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -52.45 136.2 32.19 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.432 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 103.79 -5.13 46.77 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.632 ' O ' ' N ' ' A' ' 53' ' ' SER . 6.0 t -82.34 -21.23 9.76 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 CA-C-N 115.107 -0.547 . . . . 0.0 111.448 -179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 17.1 ttmt 54.92 -65.25 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.677 0.791 . . . . 0.0 111.163 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.632 ' N ' ' O ' ' A' ' 51' ' ' VAL . 1.1 t -172.97 172.06 4.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.587 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.415 ' N ' ' OG ' ' A' ' 53' ' ' SER . 95.4 mt -140.06 149.36 22.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.872 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -140.75 117.26 10.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.221 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -95.59 139.78 31.36 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.975 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.529 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 12.6 p -165.78 144.0 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.032 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.411 ' N ' HG22 ' A' ' 57' ' ' VAL . 16.6 ptp 37.3 -130.32 0.15 Allowed 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.288 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.408 ' N ' ' HG3' ' A' ' 58' ' ' MET . 4.2 p-10 -99.72 43.98 1.04 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.529 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 1.9 p90 -167.33 160.9 13.87 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.534 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 20.1 mt -128.86 136.03 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.346 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -103.32 107.68 18.6 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 39.4 t -101.87 120.31 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.175 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.617 ' O ' ' O ' ' A' ' 51' ' ' VAL . 0.8 OUTLIER -100.71 120.59 40.31 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.028 -179.501 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 13' ' ' ASN . 8.7 pttp -102.41 165.4 11.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.027 0.442 . . . . 0.0 111.137 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -82.6 130.35 35.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.109 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 -51.91 -33.43 37.0 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.875 0.369 . . . . 0.0 110.689 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -67.85 -35.52 78.71 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.817 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.42 162.53 16.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.517 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -111.19 158.65 18.68 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.824 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.415 ' CZ2' ' HG2' ' A' ' 15' ' ' MET . 32.1 m95 -71.5 -49.13 44.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.266 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -50.74 -20.52 1.28 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.535 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.5 m -88.38 -44.88 10.44 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.113 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -80.88 -38.91 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.927 -178.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.543 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -49.15 -57.76 10.66 Favored Pre-proline 0 N--CA 1.466 0.356 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.13 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -43.0 -36.27 5.29 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.648 2.232 . . . . 0.0 112.296 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -81.42 -40.15 23.84 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.84 0.353 . . . . 0.0 110.384 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 68.1 t -59.55 -53.41 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.579 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -52.02 -35.32 46.59 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.448 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -50.5 -32.6 18.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.998 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.9 t -60.55 -58.44 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.331 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' A' ' 82' ' ' PHE . 1.1 m-85 -81.52 8.13 10.33 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.255 -179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -159.81 82.7 0.73 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 120.913 0.387 . . . . 0.0 110.472 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.9 mt -76.43 52.18 0.76 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.191 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 53.28 -177.24 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -72.01 -34.29 68.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.7 -179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 22.7 t-80 -86.72 103.71 15.43 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.58 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.613 ' HD1' ' HD1' ' A' ' 90' ' ' HIS . 59.4 t-80 -61.82 160.24 12.34 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.513 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.457 ' N ' ' ND1' ' A' ' 88' ' ' HIS . 20.8 t-80 -74.12 -82.78 0.06 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.909 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.613 ' HD1' ' HD1' ' A' ' 88' ' ' HIS . 40.4 p-80 42.02 -155.1 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.119 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . 0.535 ' N ' ' HD1' ' A' ' 91' ' ' HIS . 2.5 p-80 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.522 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 mtt . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.415 ' CB ' ' HZ1' ' A' ' 2' ' ' LYS . 8.1 mtmp? -151.68 179.22 8.59 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.263 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 62.3 mt -79.32 108.14 12.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.241 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.8 mm -111.75 -76.96 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-N 115.912 -0.586 . . . . 0.0 109.557 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.415 ' HB2' ' HG1' ' A' ' 18' ' ' THR . 5.8 m -74.78 122.96 24.11 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.127 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.427 ' O ' ' N ' ' A' ' 16' ' ' LYS . 7.5 mt -98.05 -67.6 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 CA-C-O 121.816 0.817 . . . . 0.0 110.547 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.4 t 64.97 128.66 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 113.998 -1.456 . . . . 0.0 110.05 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.423 ' CD ' ' N ' ' A' ' 8' ' ' GLU . 1.7 pm0 -127.49 -165.0 1.42 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.34 166.93 15.8 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.805 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -69.39 -14.37 37.14 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.197 1.932 . . . . 0.0 112.387 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.462 ' ND2' ' OD1' ' A' ' 13' ' ' ASN . 1.6 p-10 -106.73 -10.85 15.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.476 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.417 ' O ' ' ND2' ' A' ' 13' ' ' ASN . 81.0 m80 48.61 94.04 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.378 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.462 ' OD1' ' ND2' ' A' ' 11' ' ' ASN . 30.4 m120 -149.96 -38.98 0.14 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.968 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.0 t -148.54 127.07 12.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.188 0.518 . . . . 0.0 111.644 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.2 ptp -112.1 167.67 10.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.968 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.427 ' N ' ' O ' ' A' ' 6' ' ' ILE . 32.4 mttp -99.37 166.59 11.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.434 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.4 mt -145.05 105.12 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.978 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.415 ' HG1' ' HB2' ' A' ' 5' ' ' SER . 4.5 m -88.58 147.69 24.46 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.508 ' O ' ' CB ' ' A' ' 20' ' ' SER . 11.0 mt -102.85 -10.53 18.99 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.508 ' CB ' ' O ' ' A' ' 19' ' ' LEU . 4.0 p 91.65 -1.07 0.17 Allowed 'General case' 0 N--CA 1.472 0.629 0 O-C-N 123.447 0.467 . . . . 0.0 110.889 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -143.87 155.55 44.14 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.857 0.361 . . . . 0.0 110.964 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.0 m -150.77 177.46 10.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.085 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.403 ' O ' ' C ' ' A' ' 24' ' ' GLU . 11.0 ttm180 -168.6 36.48 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.787 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.403 ' C ' ' O ' ' A' ' 23' ' ' ARG . 9.6 mp0 38.22 36.12 0.11 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.177 0.513 . . . . 0.0 110.458 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 161.76 60.3 0.02 OUTLIER Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.817 -0.913 . . . . 0.0 110.817 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.414 ' O ' ' CB ' ' A' ' 27' ' ' THR . 0.4 OUTLIER -91.45 21.36 4.6 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.414 ' CB ' ' O ' ' A' ' 26' ' ' MET . 0.2 OUTLIER 80.82 159.76 0.16 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.218 -179.554 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 p -153.2 134.58 14.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.454 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -163.65 144.36 8.85 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.687 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.67 117.87 35.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.588 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.471 ' CG ' ' OE1' ' A' ' 38' ' ' GLN . 73.7 m-85 -109.24 111.66 23.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.438 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 81.9 p -118.32 -13.26 9.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.361 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.444 ' O ' ' C ' ' A' ' 34' ' ' VAL . 17.6 pttt -155.87 61.45 0.59 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.179 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.444 ' C ' ' O ' ' A' ' 33' ' ' LYS . 18.7 t 29.62 90.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.296 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -80.3 -102.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.442 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -175.01 90.28 0.05 Allowed 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.2 p 169.17 -40.58 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.584 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.501 HE22 ' CD1' ' A' ' 46' ' ' LEU . 19.3 pt20 -69.33 147.88 97.22 Favored Pre-proline 0 C--N 1.329 -0.305 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.436 ' O ' ' N ' ' A' ' 42' ' ' ILE . 3.3 Cg_exo -53.77 137.77 67.75 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 121.883 1.722 . . . . 0.0 111.588 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.39 -38.06 5.59 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.379 0.609 . . . . 0.0 109.455 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -55.33 -31.91 62.07 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.682 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.436 ' N ' ' O ' ' A' ' 39' ' ' PRO . 2.9 mm -77.55 -22.02 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.553 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -64.77 -36.09 83.17 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 48' ' ' VAL . 1.4 m-20 -58.84 -51.78 68.53 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.203 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.9 -50.81 13.57 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.873 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.501 ' CD1' HE22 ' A' ' 38' ' ' GLN . 12.0 mt -64.43 -36.18 83.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.054 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -82.54 -6.89 59.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.616 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.425 ' N ' ' O ' ' A' ' 44' ' ' ASP . 8.7 t -75.39 111.54 11.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -51.62 100.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.726 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 156.53 -44.52 0.52 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 39.9 t -77.66 149.11 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -105.02 -33.35 8.35 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.496 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.456 ' OG ' ' N ' ' A' ' 54' ' ' ILE . 1.4 t -178.71 175.31 1.08 Allowed 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.129 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.456 ' N ' ' OG ' ' A' ' 53' ' ' SER . 46.8 mt -142.48 152.26 17.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.788 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.405 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 19.8 t80 -137.83 108.52 6.62 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.139 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 -95.45 132.54 40.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.199 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.495 ' CG2' ' H ' ' A' ' 58' ' ' MET . 9.8 p -162.29 175.72 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.327 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.495 ' H ' ' CG2' ' A' ' 57' ' ' VAL . 14.8 ttt 34.54 -100.34 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.357 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -140.58 11.36 2.29 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.83 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -128.35 172.31 11.2 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.142 0.496 . . . . 0.0 111.23 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.1 mt -135.01 133.79 53.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.884 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.5 t -104.78 110.18 22.42 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.507 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.7 t -100.09 114.35 38.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.437 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -109.1 140.51 42.56 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.071 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -133.12 -172.09 2.85 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.703 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -98.4 -172.52 2.35 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -87.5 -47.21 8.92 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.054 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -48.94 -34.13 12.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.798 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.16 170.07 11.81 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.602 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -134.18 173.66 11.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.554 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.7 m95 -85.46 -54.77 4.37 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.451 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -51.53 -20.79 2.07 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 m -87.39 -45.48 10.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.909 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -76.54 -37.21 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.333 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.455 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.3 mm? -48.18 -61.95 2.66 Favored Pre-proline 0 N--CA 1.466 0.356 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.349 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -42.96 -32.73 2.82 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 C-N-CA 122.853 2.369 . . . . 0.0 112.587 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -83.29 -49.57 9.27 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.568 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 17.6 t -57.15 -48.55 81.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.158 -179.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -53.14 -40.73 64.46 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.038 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.417 ' O ' ' CD2' ' A' ' 84' ' ' LEU . . . -51.38 -34.64 35.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 t -53.23 -60.19 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.08 -179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.84 49.65 1.76 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.378 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.414 ' C ' ' H ' ' A' ' 85' ' ' GLU . 33.1 mt-10 -157.6 -76.78 0.08 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.08 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.417 ' CD2' ' O ' ' A' ' 80' ' ' ALA . 3.6 mm? 57.53 7.75 0.56 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.94 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.414 ' H ' ' C ' ' A' ' 83' ' ' GLU . 28.3 mt-10 -70.92 121.49 18.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.995 0.426 . . . . 0.0 110.785 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -111.46 150.92 29.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.845 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 51.21 62.68 2.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.228 0.537 . . . . 0.0 110.303 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.505 ' O ' ' ND1' ' A' ' 88' ' ' HIS . 10.2 p80 -74.19 93.36 2.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.737 -179.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -89.88 55.36 3.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.246 0.546 . . . . 0.0 110.427 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -71.44 134.96 46.97 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.286 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.7 p-80 . . . . . 0 C--O 1.219 -0.522 0 CA-C-O 117.849 -1.072 . . . . 0.0 111.331 -179.756 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.695 0.283 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 52.6 mt 55.1 101.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.326 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 mm -105.44 -30.06 2.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.486 -179.059 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 89.0 p . . . . . 0 N--CA 1.463 0.205 0 CA-C-O 121.035 0.445 . . . . 0.0 111.608 -179.874 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.658 0.266 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.401 HG23 ' O ' ' A' ' 14' ' ' THR . 12.5 t -150.14 129.64 13.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.967 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -116.55 154.48 30.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.265 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.05 134.61 37.55 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.937 0.399 . . . . 0.0 110.721 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.4 mt -98.34 123.24 50.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.318 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 86.1 m -85.53 131.47 34.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.002 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.4 mt -101.16 162.17 13.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.363 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 62.2 p -67.5 -5.55 15.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.293 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.714 -179.737 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 21.7 mtp . . . . . 0 CA--C 1.53 0.188 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.4 p -75.47 164.1 26.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.735 0.302 . . . . 0.0 110.537 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.1 p -158.2 101.26 1.73 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.505 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.443 ' H ' ' HB3' ' A' ' 56' ' ' HIS . 3.8 m-20 -162.82 160.24 24.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.752 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 m -102.58 135.23 44.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.286 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -119.16 106.57 12.5 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.168 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.88 -3.05 8.19 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.725 -179.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.0 pttt -154.09 34.76 0.43 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.545 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.765 HG12 ' H ' ' A' ' 35' ' ' ASP . 17.8 t 51.57 177.93 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.555 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.765 ' H ' HG12 ' A' ' 34' ' ' VAL . 12.7 t70 62.52 109.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.846 0.355 . . . . 0.0 110.859 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 175.24 21.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.74 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 p 74.69 18.23 2.79 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.055 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.21 172.07 9.87 Favored Pre-proline 0 C--N 1.332 -0.166 0 N-CA-C 109.929 -0.396 . . . . 0.0 109.929 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -73.11 130.13 14.99 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.519 2.146 . . . . 0.0 111.388 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.85 -37.2 8.39 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.024 0.44 . . . . 0.0 110.28 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.64 ' CB ' HG13 ' A' ' 81' ' ' VAL . 8.0 m-85 -54.21 -33.28 57.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.721 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 1.059 HD13 HD12 ' A' ' 45' ' ' ILE . 3.0 mm -77.47 -23.62 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.163 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.411 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -60.81 -35.76 77.3 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.783 ' O ' HG23 ' A' ' 48' ' ' VAL . 3.9 t70 -58.33 -51.66 68.87 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.526 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 1.059 HD12 HD13 ' A' ' 42' ' ' ILE . 61.4 mt -50.31 -50.14 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.805 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -62.92 -37.33 86.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.525 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -83.6 -10.07 58.49 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.06 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.783 HG23 ' O ' ' A' ' 44' ' ' ASP . 27.5 t -76.3 116.86 20.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 49' ' ' GLU . 8.9 mt-10 -51.73 134.39 30.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.681 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 113.49 -30.21 7.4 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 43.0 t -79.47 145.0 10.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.738 0.304 . . . . 0.0 110.202 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -103.11 -52.34 3.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.224 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 p -169.98 178.45 3.95 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.637 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 82.7 mt -138.59 151.4 24.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.184 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.41 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 17.9 t80 -138.23 107.59 6.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.005 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.443 ' HB3' ' H ' ' A' ' 29' ' ' ASP . 5.1 t-80 -94.57 131.64 40.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.248 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.448 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 1.5 p -165.59 156.9 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.444 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 7.7 ttm 44.0 -138.99 0.31 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.45 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -103.68 38.99 1.69 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.695 0.283 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.448 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 37.2 p90 -158.26 170.82 21.4 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.987 0.422 . . . . 0.0 111.009 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 58.0 mt -138.06 133.21 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.656 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 m -101.04 111.41 23.61 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.155 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.3 t -103.53 117.38 48.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.06 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 64' ' ' ASP . 0.2 OUTLIER -106.19 141.88 36.8 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.46 -179.632 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -121.78 -171.57 2.26 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.957 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -97.19 131.73 43.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -50.57 -26.68 5.57 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.84 0.353 . . . . 0.0 110.608 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -71.46 -33.22 69.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.66 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.87 -172.93 4.22 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.835 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -134.17 -175.36 3.83 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.277 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -99.06 -46.81 5.46 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.185 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.597 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 2.1 mp0 -53.26 -21.89 6.1 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.233 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.479 HG23 ' N ' ' A' ' 74' ' ' VAL . 6.2 t -86.29 -43.78 12.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.163 0.506 . . . . 0.0 110.222 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.479 ' N ' HG23 ' A' ' 73' ' ' THR . 1.0 OUTLIER -78.68 -37.77 21.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.838 -178.961 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.533 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.8 mp -47.65 -57.47 9.83 Favored Pre-proline 0 N--CA 1.467 0.396 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.0 Cg_exo -44.32 -32.25 5.08 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 122.497 2.131 . . . . 0.0 112.217 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -81.84 -41.21 21.37 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.249 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 85.9 t -60.67 -45.1 98.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.842 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -53.76 -40.98 66.67 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.575 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.27 -32.89 62.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.367 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.64 HG13 ' CB ' ' A' ' 41' ' ' PHE . 16.7 t -56.74 -66.63 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.887 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -83.26 27.23 0.59 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.754 0.311 . . . . 0.0 110.999 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.073 179.649 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.756 0.312 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 mt -80.81 122.96 36.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.159 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.5 mm -107.24 -19.11 6.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.609 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.4 t . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.98 0.419 . . . . 0.0 111.183 -179.808 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.5 m120 . . . . . 0 N--CA 1.467 0.395 0 N-CA-C 111.458 0.17 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 14' ' ' THR . 9.9 t -148.05 128.01 13.58 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.76 0.314 . . . . 0.0 110.449 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.441 ' HG3' ' CZ2' ' A' ' 71' ' ' TRP . 52.2 mtm -107.91 143.73 36.13 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.674 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 131.66 44.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.836 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.6 mt -95.92 115.36 34.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.641 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.1 m -84.48 127.78 34.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.388 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' A' ' 21' ' ' GLU . 36.7 mt -99.57 -173.48 2.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.273 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 96.8 p -63.35 -1.79 1.24 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.706 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.405 ' H ' ' C ' ' A' ' 19' ' ' LEU . 62.7 mt-10 . . . . . 0 N--CA 1.464 0.23 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.72 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 6.2 mmt . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.665 0.269 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 75.3 p -76.73 -124.18 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.291 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 81.1 p -156.19 143.11 18.87 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.248 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -154.01 164.7 38.02 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.816 0.341 . . . . 0.0 110.822 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 57.5 m -144.84 115.19 7.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.886 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.486 ' CE1' ' NE2' ' A' ' 38' ' ' GLN . 4.0 m-85 -104.28 132.39 50.58 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.341 0.591 . . . . 0.0 111.45 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.419 ' O ' ' CB ' ' A' ' 33' ' ' LYS . 11.9 p -120.6 57.42 0.96 Allowed 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.519 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER 89.52 106.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.792 -177.818 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.444 ' C ' ' O ' ' A' ' 33' ' ' LYS . 0.3 OUTLIER 15.57 108.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 114.47 -1.241 . . . . 0.0 113.378 -178.592 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.469 ' O ' ' NE2' ' A' ' 38' ' ' GLN . 8.7 p30 -158.4 -175.02 5.09 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.126 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 50.69 -100.2 0.08 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.436 0.16 . . . . 0.0 110.994 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.3 t -174.43 61.02 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.097 0.475 . . . . 0.0 110.867 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.486 ' NE2' ' CE1' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -82.53 153.68 68.25 Favored Pre-proline 0 N--CA 1.463 0.203 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.52 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -55.0 137.6 76.64 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 121.716 1.611 . . . . 0.0 110.902 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.23 -38.98 9.14 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.424 0.63 . . . . 0.0 109.41 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.538 ' CB ' HG13 ' A' ' 81' ' ' VAL . 3.6 m-85 -55.2 -34.82 64.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.429 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.92 HD13 HD12 ' A' ' 45' ' ' ILE . 2.4 mm -76.55 -22.7 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.3 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -62.15 -36.34 81.54 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.617 ' O ' HG23 ' A' ' 48' ' ' VAL . 6.2 m-20 -55.93 -53.6 54.84 Favored 'General case' 0 CA--C 1.523 -0.095 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.593 178.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.92 HD12 HD13 ' A' ' 42' ' ' ILE . 53.0 mt -47.71 -52.46 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.485 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -65.32 -37.42 87.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.901 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.8 mttm -82.22 -10.9 58.98 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.741 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 44' ' ' ASP . 4.4 t -77.06 121.09 28.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.255 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -52.62 145.48 11.8 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.795 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.92 -29.95 10.24 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 86.7 t -78.29 150.66 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 120.813 0.339 . . . . 0.0 110.724 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.444 ' HZ3' ' HB2' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -109.07 -58.8 1.98 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.317 -179.454 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 91.6 p -166.38 -176.94 3.83 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.521 -178.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.604 HD11 HG21 ' A' ' 45' ' ' ILE . 63.9 mt -137.74 152.21 26.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.985 0.421 . . . . 0.0 111.212 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -139.09 109.71 6.63 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.283 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -97.81 136.63 37.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.366 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.615 HG22 ' N ' ' A' ' 58' ' ' MET . 11.6 p -166.55 169.51 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.049 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.615 ' N ' HG22 ' A' ' 57' ' ' VAL . 3.1 ttm 41.03 -107.53 0.08 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.937 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -139.69 44.77 1.94 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.149 0.5 . . . . 0.0 109.949 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -161.96 168.76 22.31 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.604 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 75.2 mt -129.31 126.15 63.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.422 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.0 t -97.08 116.22 28.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.288 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 39.7 t -105.81 118.54 53.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.348 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -105.26 142.04 35.72 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.99 0.424 . . . . 0.0 110.54 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.481 ' HZ2' ' C ' ' A' ' 70' ' ' ASN . 45.1 pttt -128.92 -171.1 2.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.666 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -98.39 137.86 36.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.507 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.485 ' N ' ' OD1' ' A' ' 67' ' ' ASN . 6.1 p-10 -54.18 -27.9 36.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.676 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.64 -33.02 74.92 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.98 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.95 177.51 6.94 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.899 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.481 ' C ' ' HZ2' ' A' ' 65' ' ' LYS . 29.5 m120 -131.68 163.19 28.69 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.75 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.441 ' CZ2' ' HG3' ' A' ' 15' ' ' MET . 54.7 m95 -77.88 -55.28 5.44 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.275 -179.319 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -46.87 -21.07 0.17 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.768 0.318 . . . . 0.0 111.06 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.3 m -88.23 -45.74 9.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.283 0.563 . . . . 0.0 110.467 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -84.22 -38.36 13.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.062 -178.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.577 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 0.9 OUTLIER -47.59 -55.1 18.11 Favored Pre-proline 0 N--CA 1.464 0.239 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 -178.851 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.577 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.4 Cg_exo -41.99 -33.06 2.03 Favored 'Trans proline' 0 N--CA 1.49 1.319 0 C-N-CA 122.545 2.163 . . . . 0.0 112.246 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.517 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 0.1 OUTLIER -82.72 -51.46 7.68 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.329 179.397 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 45.1 t -43.87 -53.9 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.593 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -54.25 -40.83 68.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.638 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -49.18 -32.48 10.37 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.327 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.538 HG13 ' CB ' ' A' ' 41' ' ' PHE . 17.0 t -61.38 -59.64 3.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.56 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -85.7 44.55 1.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.016 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.533 179.638 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.4 mtmm . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.723 0.296 . . . . 0.0 110.337 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.486 ' C ' HD12 ' A' ' 4' ' ' ILE . 55.3 mt -81.94 127.09 39.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.337 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.502 ' N ' HD12 ' A' ' 4' ' ' ILE . 1.8 mp -109.19 -55.93 4.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.473 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.8 p . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.664 -179.898 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.5 m120 . . . . . 0 N--CA 1.465 0.3 0 CA-C-O 120.281 0.086 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.513 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 8.8 t -145.72 129.24 16.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 0.0 111.164 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.9 mtm -109.77 158.71 17.85 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.369 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -97.6 124.23 41.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.376 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 54.5 mt -98.1 122.31 49.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.751 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 96.7 m -86.39 132.11 34.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.441 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.8 mt -102.02 174.13 6.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.334 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 88.8 p -65.18 -5.24 6.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.098 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 . . . . . 0 N--CA 1.465 0.313 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.566 -179.775 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.866 0.365 . . . . 0.0 110.172 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.0 t 38.79 -151.87 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.629 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.2 p -157.01 141.85 16.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.444 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -156.77 136.06 12.08 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.762 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.1 m -99.36 128.92 45.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.032 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.541 ' CZ ' ' HB3' ' A' ' 38' ' ' GLN . 54.0 m-85 -113.49 118.55 34.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.726 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.3 p -125.22 -12.01 6.91 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.356 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.485 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 19.7 pttm -155.38 31.87 0.38 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.612 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.608 HG12 ' N ' ' A' ' 35' ' ' ASP . 59.6 t 73.71 166.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.468 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.608 ' N ' HG12 ' A' ' 34' ' ' VAL . 33.3 t70 -155.6 -110.32 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.425 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -167.94 -39.45 0.02 OUTLIER 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.733 0.301 . . . . 0.0 110.435 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.0 t -57.92 -31.49 66.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.282 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 31' ' ' TYR . 2.5 pt20 -80.16 153.79 74.6 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.472 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -59.25 138.85 87.21 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.057 1.838 . . . . 0.0 111.386 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.414 ' HA ' ' ND2' ' A' ' 43' ' ' ASN . . . -46.61 -39.96 12.12 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.109 0.48 . . . . 0.0 109.885 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.696 ' CB ' HG13 ' A' ' 81' ' ' VAL . 15.6 m-85 -54.28 -47.52 72.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.772 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.992 HD13 HD12 ' A' ' 45' ' ' ILE . 1.6 mm -55.91 -27.65 22.99 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.386 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.414 ' ND2' ' HA ' ' A' ' 40' ' ' ALA . 21.1 m-20 -62.21 -43.92 97.75 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.413 ' OD2' HG22 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -55.75 -37.62 68.73 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.157 179.28 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.992 HD12 HD13 ' A' ' 42' ' ' ILE . 22.1 mt -62.5 -48.81 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.158 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.618 ' O ' HG21 ' A' ' 51' ' ' VAL . 51.1 mt -55.49 -32.9 63.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.838 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -78.81 -4.51 49.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.28 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.937 ' O ' HG22 ' A' ' 51' ' ' VAL . 58.0 t -77.91 103.57 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -46.92 110.87 0.33 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.661 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 125.26 6.25 6.34 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.937 HG22 ' O ' ' A' ' 48' ' ' VAL . 0.0 OUTLIER -78.8 -21.65 12.9 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.204 0 CA-C-O 118.759 -0.639 . . . . 0.0 112.51 -179.51 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.9 ttmm 51.83 -64.19 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.231 0.469 . . . . 0.0 111.074 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.757 ' N ' ' O ' ' A' ' 51' ' ' VAL . 1.3 p -172.62 165.76 5.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.163 0.506 . . . . 0.0 111.654 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 83.4 mt -140.78 149.64 21.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.24 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -136.8 115.83 12.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.771 0.32 . . . . 0.0 111.006 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -100.2 132.94 45.28 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.977 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.49 HG13 ' CZ ' ' A' ' 60' ' ' PHE . 6.2 p -164.37 153.27 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.825 0.345 . . . . 0.0 110.902 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 13.0 ttt 46.04 -106.83 0.13 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.185 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -133.15 16.5 4.14 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.647 0.261 . . . . 0.0 110.931 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.49 ' CZ ' HG13 ' A' ' 57' ' ' VAL . 50.7 p90 -131.1 164.3 25.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.116 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.8 mt -133.9 130.08 55.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.146 -179.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.09 109.56 21.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.7 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.403 ' O ' ' HA ' ' A' ' 14' ' ' THR . 59.6 t -101.17 119.74 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.682 ' O ' ' O ' ' A' ' 51' ' ' VAL . 0.9 OUTLIER -97.86 154.33 17.71 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.251 179.799 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.587 ' HD2' ' HB3' ' A' ' 69' ' ' ALA . 12.0 pttt -132.42 165.35 24.49 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.237 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.705 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 51.5 mm-40 -52.4 168.84 0.09 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.204 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -34.97 -42.92 0.17 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.066 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -133.55 -54.2 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.139 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.705 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . . . 48.84 -159.21 0.05 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.0 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -145.26 114.51 7.06 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.744 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -71.6 -38.4 70.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.169 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.11 -26.18 48.81 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.951 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.6 m -89.39 -45.84 9.17 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.108 0.48 . . . . 0.0 110.54 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.2 t -66.97 -39.43 83.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.715 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.446 ' CB ' ' CD ' ' A' ' 76' ' ' PRO . 1.4 mm? -49.26 -62.1 2.76 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.83 -0.168 . . . . 0.0 111.385 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' A' ' 75' ' ' LEU . 2.9 Cg_endo -50.29 -31.75 30.68 Favored 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.495 2.13 . . . . 0.0 112.556 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -78.32 -47.12 18.43 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.329 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.72 -39.38 70.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.475 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -55.78 -43.45 76.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.368 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.58 -34.02 48.75 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.378 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.858 HG21 HD11 ' A' ' 45' ' ' ILE . 12.9 t -60.4 -61.68 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.756 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -84.39 10.81 9.74 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.918 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 . . . . . 0 C--N 1.331 -0.219 0 CA-C-O 121.138 0.494 . . . . 0.0 110.179 179.815 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 32.1 pttt . . . . . 0 N--CA 1.461 0.082 0 CA-C-O 120.928 0.394 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.644 ' C ' HD12 ' A' ' 4' ' ' ILE . 96.7 mt -84.62 122.63 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.759 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.721 ' N ' HD12 ' A' ' 4' ' ' ILE . 1.8 mp -109.68 -31.73 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-O 121.203 0.525 . . . . 0.0 109.752 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--N 1.326 -0.417 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.159 -179.591 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.8 m120 . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.8 t -136.73 126.66 25.86 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.87 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.417 ' HG2' ' CH2' ' A' ' 71' ' ' TRP . 13.1 ptp -107.78 154.79 21.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.12 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.4 tttt -102.03 128.12 48.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.464 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.7 mt -99.14 114.12 36.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.91 0.386 . . . . 0.0 111.086 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 84.4 m -88.5 128.04 35.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.497 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.579 HD11 HD11 ' A' ' 61' ' ' ILE . 69.1 mt -102.06 161.48 13.65 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.531 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.42 -1.49 6.6 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.47 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 . . . . . 0 N--CA 1.457 -0.107 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.255 -179.27 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 11.8 mtt . . . . . 0 C--O 1.233 0.189 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.643 HG22 ' H ' ' A' ' 28' ' ' SER . 1.8 m -162.98 -143.67 0.08 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.885 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.643 ' H ' HG22 ' A' ' 27' ' ' THR . 11.7 p -156.08 130.3 8.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.245 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -162.28 138.54 7.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.283 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 52.0 m -98.76 148.12 24.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.27 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.401 ' CD1' ' OE1' ' A' ' 38' ' ' GLN . 22.7 m-85 -135.58 120.07 18.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.479 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.3 p -125.06 -7.49 7.16 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.531 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 34' ' ' VAL . 33.4 pttt -158.45 58.38 0.45 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.234 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.423 ' C ' ' O ' ' A' ' 33' ' ' LYS . 19.2 t 26.56 101.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 O-C-N 123.649 0.593 . . . . 0.0 112.521 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -159.49 -156.74 0.53 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.285 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 56.55 -100.24 0.11 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.841 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.5 t -168.2 63.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.401 ' OE1' ' CD1' ' A' ' 31' ' ' TYR . 9.6 mt-30 -92.9 144.9 29.21 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.16 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.462 ' O ' ' N ' ' A' ' 42' ' ' ILE . 3.1 Cg_exo -55.59 134.22 62.66 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 121.596 1.531 . . . . 0.0 110.201 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.408 ' C ' ' O ' ' A' ' 39' ' ' PRO . . . -41.29 -41.44 1.9 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.401 0.619 . . . . 0.0 109.852 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.665 ' CB ' HG13 ' A' ' 81' ' ' VAL . 7.7 m-85 -52.69 -37.98 59.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.202 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.933 HD13 HD12 ' A' ' 45' ' ' ILE . 2.0 mm -70.01 -26.3 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.816 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -61.17 -38.47 86.6 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 48' ' ' VAL . 33.6 t70 -55.53 -53.79 52.07 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.829 179.018 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.933 HD12 HD13 ' A' ' 42' ' ' ILE . 84.4 mt -45.76 -53.76 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.241 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.5 mt -67.18 -36.88 82.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.871 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -81.18 -8.46 59.76 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.078 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.56 ' N ' ' O ' ' A' ' 44' ' ' ASP . 3.9 t -79.52 115.05 21.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -51.19 113.23 0.88 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.637 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 139.68 -39.94 1.47 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.5 t -78.62 147.75 6.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -108.95 -35.58 6.31 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.375 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.469 ' OG ' ' N ' ' A' ' 54' ' ' ILE . 3.1 t -172.96 176.54 3.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.123 0.487 . . . . 0.0 111.189 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.469 ' N ' ' OG ' ' A' ' 53' ' ' SER . 83.2 mt -137.11 154.5 31.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.655 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -138.3 109.14 6.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.262 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -95.48 129.39 42.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.988 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.422 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 5.0 p -163.33 162.91 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.214 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.422 ' N ' HG22 ' A' ' 57' ' ' VAL . 3.1 ttt 37.29 -137.02 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.023 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -102.87 39.87 1.47 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.737 0.303 . . . . 0.0 110.663 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.422 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 38.6 p90 -161.88 169.58 21.0 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.965 0.412 . . . . 0.0 111.373 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.579 HD11 HD11 ' A' ' 19' ' ' LEU . 4.0 mp -138.19 135.4 44.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.431 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.07 154.83 17.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.167 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.2 t -142.74 112.49 2.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.581 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.7 p-10 -99.04 143.46 29.3 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.011 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.485 ' NZ ' ' NE1' ' A' ' 71' ' ' TRP . 16.6 pttm -124.41 -176.23 3.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.524 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -90.59 129.83 36.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.082 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.34 -34.69 7.15 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -34.42 76.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.562 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.32 166.08 14.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.691 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -108.11 177.48 4.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.584 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.485 ' NE1' ' NZ ' ' A' ' 65' ' ' LYS . 12.2 m95 -98.05 -44.78 6.5 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.591 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.415 ' O ' ' CD ' ' A' ' 76' ' ' PRO . 2.7 pp20? -56.05 -21.27 20.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.673 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.522 HG23 ' N ' ' A' ' 74' ' ' VAL . 15.4 t -86.22 -44.65 11.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.313 0.577 . . . . 0.0 109.71 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.522 ' N ' HG23 ' A' ' 73' ' ' THR . 0.9 OUTLIER -75.39 -37.51 38.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.961 -179.813 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.455 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 2.5 mt -48.56 -61.34 3.31 Favored Pre-proline 0 N--CA 1.466 0.365 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.3 Cg_exo -42.51 -31.65 1.99 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 C-N-CA 122.415 2.076 . . . . 0.0 112.126 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.496 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 0.8 OUTLIER -80.44 -41.97 23.52 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.07 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 81' ' ' VAL . 38.4 t -52.36 -56.15 7.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.216 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -53.09 -33.95 54.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.022 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -54.4 -32.85 58.07 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.219 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.665 HG13 ' CB ' ' A' ' 41' ' ' PHE . 22.0 t -56.95 -64.37 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.018 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.452 ' CD1' ' N ' ' A' ' 82' ' ' PHE . 0.7 OUTLIER -85.22 29.88 0.63 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.101 -179.541 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 . . . . . 0 C--N 1.332 -0.178 0 CA-C-O 120.756 0.312 . . . . 0.0 110.821 179.752 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.902 0.382 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 66.8 mt -81.7 126.34 39.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.799 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.3 mm -110.06 -17.71 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.205 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.463 0.197 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.796 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.4 m120 . . . . . 0 N--CA 1.461 0.117 0 CA-C-O 120.62 0.248 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.44 ' O ' HG23 ' A' ' 14' ' ' THR . 8.6 t -149.25 126.48 11.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.425 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.652 ' SD ' ' CE2' ' A' ' 71' ' ' TRP . 6.7 mtp -108.21 132.21 53.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.39 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.7 ttmm -94.27 121.65 36.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.57 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 58.2 mt -93.6 126.3 46.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.844 0.354 . . . . 0.0 110.684 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.3 m -88.13 137.03 32.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.656 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.3 mt -114.98 155.02 27.71 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.398 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.7 p -68.64 2.99 2.07 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.916 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.529 0.151 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.292 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 8.0 mmm . . . . . 0 C--O 1.234 0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.344 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.0 m -73.59 -131.53 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.243 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.3 p -156.98 133.77 10.17 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.615 0.245 . . . . 0.0 110.419 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -156.43 130.12 8.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.499 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.69 150.5 21.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.403 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -130.76 117.53 19.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.975 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.7 p -118.69 -10.22 10.05 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.187 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.11 48.89 0.33 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.816 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.617 HG12 ' N ' ' A' ' 35' ' ' ASP . 53.8 t 53.68 167.69 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.488 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.617 ' N ' HG12 ' A' ' 34' ' ' VAL . 13.2 m-20 -160.07 -101.93 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.496 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.42 ' C ' ' N ' ' A' ' 38' ' ' GLN . 24.2 t0 -172.48 -50.23 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.455 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.8 m -49.49 -15.35 0.15 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.852 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.42 ' N ' ' C ' ' A' ' 36' ' ' ASP . 1.4 pt20 -93.48 147.52 33.82 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.14 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -55.77 137.59 78.93 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 C-N-CA 121.805 1.67 . . . . 0.0 110.584 179.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.97 -39.09 8.44 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.321 0.582 . . . . 0.0 109.463 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.599 ' CB ' HG13 ' A' ' 81' ' ' VAL . 5.8 m-85 -55.75 -31.03 62.2 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.264 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.982 HD13 HD12 ' A' ' 45' ' ' ILE . 1.7 mm -77.02 -24.53 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 N-CA-C 110.156 -0.312 . . . . 0.0 110.156 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -62.53 -39.65 94.26 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.585 ' O ' ' N ' ' A' ' 48' ' ' VAL . 25.4 t70 -57.7 -52.14 66.66 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.789 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.982 HD12 HD13 ' A' ' 42' ' ' ILE . 56.4 mt -45.41 -52.95 2.06 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.472 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 26.5 mt -61.62 -38.07 86.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.053 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.6 mtpt -84.61 -6.88 59.39 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.172 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.585 ' N ' ' O ' ' A' ' 44' ' ' ASP . 3.7 t -79.86 119.4 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.038 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -52.99 126.24 19.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.82 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 127.22 -39.34 1.96 Allowed Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.5 t -79.75 147.96 6.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.76 0.314 . . . . 0.0 110.735 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -108.97 -34.55 6.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.709 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.1 t -174.09 179.12 1.97 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.067 0.461 . . . . 0.0 110.968 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.0 mt -145.9 138.98 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.075 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -126.6 112.79 15.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.086 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.2 t-160 -93.53 131.24 38.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.418 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.505 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 2.0 p -164.02 156.58 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.837 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.6 ttt 41.27 -141.43 0.08 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.494 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -100.31 27.67 5.53 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 121.173 -0.211 . . . . 0.0 111.069 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.505 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 14.1 p90 -144.62 169.69 17.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.995 0.426 . . . . 0.0 111.056 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.2 mt -136.45 136.86 48.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.307 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.11 110.14 22.12 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.481 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.6 t -98.7 112.5 30.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.683 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 -104.29 134.01 48.23 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.469 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.3 pttt -122.09 -172.91 2.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.404 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -96.32 127.13 42.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.462 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -45.86 -24.75 0.43 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.969 0.414 . . . . 0.0 110.461 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -68.61 -35.22 77.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.004 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.09 163.05 17.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.755 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -111.59 174.03 6.06 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.487 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.652 ' CE2' ' SD ' ' A' ' 15' ' ' MET . 41.0 m95 -92.52 -48.07 6.81 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.019 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -50.59 -22.31 1.95 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.782 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.473 ' CG2' ' N ' ' A' ' 74' ' ' VAL . 4.7 t -88.88 -44.26 10.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.284 0.564 . . . . 0.0 110.166 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.473 ' N ' ' CG2' ' A' ' 73' ' ' THR . 0.9 OUTLIER -77.47 -37.65 25.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.321 -179.16 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.0 OUTLIER -48.42 -60.25 4.77 Favored Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.479 -179.109 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.7 Cg_exo -42.91 -31.31 2.16 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.507 2.138 . . . . 0.0 111.893 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 25.5 mttm -81.4 -41.1 22.42 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.08 -53.76 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.035 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -51.39 -40.97 60.32 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.635 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -52.41 -33.09 42.14 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.97 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.599 HG13 ' CB ' ' A' ' 41' ' ' PHE . 31.1 t -58.85 -63.12 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.753 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -83.65 23.36 0.97 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.887 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 . . . . . 0 C--O 1.233 0.211 0 CA-C-O 121.053 0.454 . . . . 0.0 110.16 179.72 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 36.7 pttt . . . . . 0 CA--C 1.529 0.155 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.593 ' C ' HD12 ' A' ' 4' ' ' ILE . 82.0 mt -80.21 131.7 33.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.766 0.317 . . . . 0.0 110.842 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.593 HD12 ' C ' ' A' ' 3' ' ' ILE . 1.7 mp -108.56 -47.61 7.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.007 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.5 p . . . . . 0 CA--C 1.53 0.175 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.896 -179.89 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.4 m120 . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 120.642 0.258 . . . . 0.0 111.492 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.2 t -147.84 157.13 43.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.886 0.374 . . . . 0.0 110.971 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.75 161.3 35.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.44 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.42 ' HG2' ' H ' ' A' ' 17' ' ' ILE . 6.7 ttmm -92.03 162.44 14.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.805 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.42 ' H ' ' HG2' ' A' ' 16' ' ' LYS . 71.3 mt -138.68 113.96 8.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.14 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.8 m -84.9 119.2 25.08 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.255 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.548 ' C ' ' H ' ' A' ' 21' ' ' GLU . 64.4 mt -104.5 166.96 10.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.379 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.8 m -69.6 34.3 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.321 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.548 ' H ' ' C ' ' A' ' 19' ' ' LEU . 10.0 mm-40 . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.299 -179.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 14.8 mtt . . . . . 0 N--CA 1.463 0.205 0 CA-C-O 120.786 0.327 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.493 HG23 ' N ' ' A' ' 28' ' ' SER . 9.8 t -75.91 -135.88 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.214 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.493 ' N ' HG23 ' A' ' 27' ' ' THR . 18.2 p -155.73 135.25 12.47 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.673 0.273 . . . . 0.0 110.553 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -158.7 142.13 14.99 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.24 148.56 26.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.324 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -129.73 111.99 13.19 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.201 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.2 p -123.62 -0.83 8.57 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.088 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 35.6 mtmt -151.77 25.44 0.66 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.738 0.304 . . . . 0.0 110.84 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.643 HG12 ' N ' ' A' ' 35' ' ' ASP . 60.0 t 54.85 170.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.052 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.643 ' N ' HG12 ' A' ' 34' ' ' VAL . 12.6 t0 70.54 99.1 0.06 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.546 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -172.73 21.08 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.091 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.1 p 76.93 13.49 2.16 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.169 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.46 174.2 6.5 Favored Pre-proline 0 N--CA 1.465 0.279 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -71.68 129.04 15.02 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.32 2.013 . . . . 0.0 111.192 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.68 -36.88 7.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.958 0.409 . . . . 0.0 110.342 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.622 ' HB3' HG13 ' A' ' 81' ' ' VAL . 31.6 m-85 -54.49 -32.94 58.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.841 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.95 HD13 HD12 ' A' ' 45' ' ' ILE . 4.0 mm -76.52 -20.81 14.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.285 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -62.65 -40.18 96.2 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.602 ' O ' HG23 ' A' ' 48' ' ' VAL . 21.5 m-20 -57.11 -52.5 65.06 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.726 178.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.95 HD12 HD13 ' A' ' 42' ' ' ILE . 73.8 mt -49.04 -49.76 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.599 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.9 mt -63.34 -36.8 84.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.687 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -83.16 -10.9 58.38 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.22 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 44' ' ' ASP . 19.7 t -76.3 124.9 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.911 0.386 . . . . 0.0 110.165 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.486 ' H ' ' CD ' ' A' ' 49' ' ' GLU . 1.8 pm0 -51.14 138.54 19.95 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.142 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 106.35 -35.59 4.95 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.762 -0.935 . . . . 0.0 110.762 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 31.3 t -78.71 138.61 19.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.867 0.365 . . . . 0.0 110.63 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -103.04 -55.13 2.48 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.129 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 64.7 m -161.19 -179.49 7.5 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.465 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.401 HG22 ' N ' ' A' ' 55' ' ' PHE . 93.7 mt -138.02 153.02 26.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.12 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.407 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 20.2 t80 -139.1 110.58 7.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.462 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -98.42 133.09 43.29 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.437 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.43 HG22 ' N ' ' A' ' 58' ' ' MET . 9.3 p -164.5 158.74 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.715 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.43 ' N ' HG22 ' A' ' 57' ' ' VAL . 0.2 OUTLIER 46.22 -137.98 0.61 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.383 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -105.06 44.04 1.06 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.001 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -165.75 172.27 11.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.777 0.322 . . . . 0.0 110.653 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 68.7 mt -135.13 143.55 36.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.385 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.3 t -114.46 114.32 25.65 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.713 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.2 t -99.53 111.93 30.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.886 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.28 146.85 27.43 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.955 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.516 ' HZ1' ' C ' ' A' ' 70' ' ' ASN . 11.5 ptpt -124.52 -164.01 1.22 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.138 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -66.11 -153.6 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.684 0.278 . . . . 0.0 110.506 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.04 -48.2 73.74 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.746 0.308 . . . . 0.0 110.367 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -154.06 -42.98 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.453 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 46.79 -137.45 0.72 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.738 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.516 ' C ' ' HZ1' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -141.88 135.42 29.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.036 179.724 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -91.53 -45.17 8.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.942 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -54.63 -21.93 12.02 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.85 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.465 HG23 ' N ' ' A' ' 74' ' ' VAL . 6.0 t -86.02 -44.11 12.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.115 0.483 . . . . 0.0 110.16 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.465 ' N ' HG23 ' A' ' 73' ' ' THR . 1.1 t -74.26 -38.75 48.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.485 -179.095 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.502 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.1 mp -48.58 -58.97 6.94 Favored Pre-proline 0 N--CA 1.465 0.299 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 2.9 Cg_endo -46.39 -32.45 11.0 Favored 'Trans proline' 0 N--CA 1.491 1.334 0 C-N-CA 122.471 2.114 . . . . 0.0 111.931 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.68 -42.07 22.65 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.962 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 74.3 t -58.62 -43.84 88.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.095 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -53.7 -44.86 70.13 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.031 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.38 -32.71 40.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.396 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.622 HG13 ' HB3' ' A' ' 41' ' ' PHE . 15.2 t -57.84 -62.75 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.469 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -87.9 -33.84 18.36 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 120.828 0.347 . . . . 0.0 111.351 -179.25 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.9 pttt . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.798 0.332 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 39.6 mt 57.43 101.83 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.605 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.6 mm -102.72 -17.72 6.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.798 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.0 t . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.481 -179.926 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.0 m120 . . . . . 0 N--CA 1.461 0.081 0 CA-C-O 120.822 0.344 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.503 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 4.3 t -150.63 131.91 14.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.579 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 63.0 mtm -100.04 156.87 16.93 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.401 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.81 120.7 37.63 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.29 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.8 mt -97.56 110.32 25.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.485 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.2 m -85.2 139.91 31.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.473 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.7 mt -113.69 151.28 32.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.496 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.9 t -67.27 -2.25 5.7 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.194 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.279 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.636 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 10.8 tpp . . . . . 0 C--O 1.233 0.206 0 CA-C-O 120.819 0.342 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.2 p 48.9 -162.86 0.03 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.693 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.2 p -156.76 135.23 11.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.332 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -157.38 143.86 17.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 27.6 m -102.05 121.55 42.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.79 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.434 ' HB3' HD11 ' A' ' 46' ' ' LEU . 25.7 m-85 -107.14 114.51 28.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.845 0.355 . . . . 0.0 110.595 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.1 p -132.96 1.72 3.59 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.889 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -157.74 25.84 0.28 Allowed 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.935 -0.306 . . . . 0.0 111.437 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.766 HG12 ' H ' ' A' ' 35' ' ' ASP . 13.9 t 50.2 177.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.264 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.766 ' H ' HG12 ' A' ' 34' ' ' VAL . 9.8 m-20 58.08 94.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -168.14 -43.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.919 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.5 t 164.65 -22.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.68 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.423 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 0.9 OUTLIER -49.39 147.8 5.26 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.985 -179.662 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -56.8 141.23 92.6 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.229 1.953 . . . . 0.0 111.33 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -47.82 -42.69 26.82 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.627 ' CB ' HG13 ' A' ' 81' ' ' VAL . 22.7 m-85 -54.13 -37.08 63.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.676 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.994 HD13 HD12 ' A' ' 45' ' ' ILE . 2.0 mm -71.67 -24.96 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.383 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.9 m-20 -60.41 -40.84 92.39 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.507 ' O ' HG23 ' A' ' 48' ' ' VAL . 10.9 t70 -55.48 -44.46 76.52 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.922 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.994 HD12 HD13 ' A' ' 42' ' ' ILE . 19.3 mt -58.08 -62.7 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.192 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.368 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.469 ' HA ' HG11 ' A' ' 51' ' ' VAL . 49.0 mt -43.15 -35.52 1.39 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.799 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -81.74 -13.83 57.28 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 44' ' ' ASP . 40.8 t -77.29 119.46 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.827 0.346 . . . . 0.0 110.616 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -54.49 143.75 23.25 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.827 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 90.31 -0.55 78.27 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.666 ' O ' ' N ' ' A' ' 53' ' ' SER . 4.1 t -80.41 -19.28 12.0 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt 52.34 -68.1 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 123.412 0.685 . . . . 0.0 111.233 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.666 ' N ' ' O ' ' A' ' 51' ' ' VAL . 18.5 p -174.62 174.45 2.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.107 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 86.1 mt -135.55 147.07 28.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.642 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -135.04 108.75 8.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.253 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -93.8 129.39 40.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.281 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 8.4 p -162.92 148.18 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.126 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 7.2 tpp 50.28 -146.3 0.42 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.394 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 40.4 p-10 -95.83 43.33 1.08 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.619 0.247 . . . . 0.0 111.482 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -163.62 173.7 12.65 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.8 0.333 . . . . 0.0 110.84 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 14.3 mt -137.95 132.9 44.11 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.608 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 t -100.58 109.09 21.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.13 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.3 t -99.95 110.18 26.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.538 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.633 ' O ' ' O ' ' A' ' 51' ' ' VAL . 1.4 m-20 -89.43 146.46 24.63 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.291 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.0 pttp -120.15 171.6 8.36 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.313 0.383 . . . . 0.0 110.392 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.434 ' O ' ' C ' ' A' ' 67' ' ' ASN . 0.3 OUTLIER -58.49 -176.64 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.97 -179.583 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.434 ' C ' ' O ' ' A' ' 66' ' ' GLU . 2.6 m120 -32.06 -60.25 0.27 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.058 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -138.25 -52.19 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.899 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 47.92 -150.25 0.14 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.06 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -142.44 125.08 15.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.467 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 39.6 m95 -73.5 -45.53 53.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.209 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -56.35 -21.34 23.97 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.077 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 m -86.29 -45.08 11.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.197 0.523 . . . . 0.0 110.128 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.97 -38.96 44.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.435 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.496 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.5 mt -49.26 -58.05 9.97 Favored Pre-proline 0 N--CA 1.464 0.232 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -46.17 -32.33 10.14 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 122.171 1.914 . . . . 0.0 111.474 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -80.9 -41.31 23.22 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 48.4 t -66.5 -41.77 89.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.537 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -54.02 -42.62 69.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.735 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.98 -32.75 15.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.154 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.821 HG21 HD11 ' A' ' 45' ' ' ILE . 11.3 t -59.67 -63.33 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.443 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -86.71 -29.96 22.03 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 121.004 -0.279 . . . . 0.0 111.514 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.056 0.455 . . . . 0.0 110.676 -179.496 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.985 0.421 . . . . 0.0 110.545 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.7 mt -80.71 110.38 16.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.636 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.5 mm -104.94 -24.34 4.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.448 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.465 0.317 0 CA-C-O 120.872 0.368 . . . . 0.0 111.198 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.548 ' N ' ' HZ1' ' A' ' 65' ' ' LYS . 24.5 t-20 . . . . . 0 N--CA 1.462 0.147 0 CA-C-O 120.499 0.19 . . . . 0.0 110.996 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.4 ' O ' HG23 ' A' ' 14' ' ' THR . 3.8 t -146.73 128.18 14.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.835 0.35 . . . . 0.0 110.613 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 33.3 mtm -109.01 154.12 22.65 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.555 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.5 mtpt -106.75 118.72 37.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.294 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 56.7 mt -96.28 121.99 47.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.709 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.1 m -86.79 124.5 33.11 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.5 mt -96.01 -154.09 0.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.322 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.8 m -63.91 -3.06 2.19 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.636 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 . . . . . 0 C--O 1.233 0.205 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.846 179.973 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.0 tpp . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 120.547 0.213 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 28' ' ' SER . 0.6 OUTLIER 69.55 -161.51 0.17 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -178.867 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.673 ' H ' HG22 ' A' ' 27' ' ' THR . 97.8 p -159.06 144.73 16.33 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.306 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -161.14 156.68 24.72 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.787 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -132.18 128.1 37.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.454 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -107.03 128.83 54.71 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.478 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.8 p -117.76 4.51 12.26 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.683 ' O ' HG23 ' A' ' 34' ' ' VAL . 8.9 ttmm -155.55 -100.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.291 -1.322 . . . . 0.0 109.185 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 33' ' ' LYS . 59.5 t -166.27 97.72 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 114.686 -1.143 . . . . 0.0 109.823 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -161.87 -147.88 0.14 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.304 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 62.66 3.75 1.22 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.968 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 p 65.8 17.65 10.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.342 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.427 ' HB2' ' CD ' ' A' ' 39' ' ' PRO . 3.2 pt20 -55.52 175.81 0.19 Allowed Pre-proline 0 CA--C 1.528 0.105 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.77 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.427 ' CD ' ' HB2' ' A' ' 38' ' ' GLN . 3.7 Cg_exo -71.11 125.57 11.57 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 121.911 1.741 . . . . 0.0 111.4 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.52 -37.72 5.64 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.155 0.502 . . . . 0.0 109.978 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.507 ' HB3' HG13 ' A' ' 81' ' ' VAL . 17.9 m-85 -53.79 -33.42 55.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.398 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.886 HD13 HD12 ' A' ' 45' ' ' ILE . 4.2 mm -78.58 -19.77 13.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.317 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -62.3 -37.69 86.53 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.584 ' O ' ' N ' ' A' ' 48' ' ' VAL . 22.6 t0 -57.78 -50.7 72.37 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.825 178.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.886 HD12 HD13 ' A' ' 42' ' ' ILE . 13.6 mt -48.66 -51.94 10.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.584 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.3 mt -65.14 -38.1 89.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.983 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 37.9 mttm -83.95 -9.82 58.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.722 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.584 ' N ' ' O ' ' A' ' 44' ' ' ASP . 2.6 t -78.21 123.66 35.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 -49.96 133.74 22.2 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.722 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.6 -44.68 1.39 Allowed Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 94.8 t -79.72 138.56 19.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.799 0.333 . . . . 0.0 110.413 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.457 ' NZ ' ' O ' ' A' ' 65' ' ' LYS . 5.6 ttpm? -105.49 -33.08 8.24 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.111 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -176.43 179.53 1.18 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.511 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 76.8 mt -141.06 153.36 20.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.775 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -140.11 107.56 5.56 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.55 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -96.11 142.22 28.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.906 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.542 HG22 ' N ' ' A' ' 58' ' ' MET . 13.1 p -162.47 164.9 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.828 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.542 ' N ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER 27.96 -90.1 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.894 -179.602 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.525 ' H ' ' CG ' ' A' ' 58' ' ' MET . 8.5 p-10 -144.7 42.85 1.36 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.954 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.479 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 8.5 p90 -163.96 151.0 11.9 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.569 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 77.6 mt -113.99 134.49 56.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.518 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.5 t -106.58 111.62 24.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.556 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 16.0 t -99.17 106.03 18.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -96.13 138.85 33.15 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.883 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.548 ' HZ1' ' N ' ' A' ' 13' ' ' ASN . 2.1 pttm -116.54 -171.59 2.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.212 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.429 ' O ' ' ND2' ' A' ' 13' ' ' ASN . 19.4 mt-10 -61.64 -151.89 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.41 0.444 . . . . 0.0 110.834 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.421 ' OD1' ' N ' ' A' ' 68' ' ' ASP . 5.5 p30 -64.95 -44.5 89.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.315 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.421 ' N ' ' OD1' ' A' ' 67' ' ' ASN . 1.9 t0 -143.4 -53.91 0.37 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.821 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.18 -151.78 0.22 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.486 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -140.56 129.93 23.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.299 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.547 ' HE1' ' HZ2' ' A' ' 65' ' ' LYS . 30.1 m95 -85.15 -44.28 13.09 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.519 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.545 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 16.6 mp0 -55.23 -22.42 17.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.158 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.7 m -90.9 -45.43 8.77 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.102 0.477 . . . . 0.0 110.641 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.25 -38.62 18.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.441 -178.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.534 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 4.4 tt -48.54 -58.08 9.2 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.306 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 2.8 Cg_endo -44.31 -31.24 4.21 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 122.587 2.192 . . . . 0.0 112.072 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.422 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 24.0 mttt -81.22 -49.45 10.77 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.181 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.3 t -50.39 -53.52 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.596 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -55.06 -40.61 70.49 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.824 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -51.87 -33.01 34.61 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.844 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.531 HG21 HD11 ' A' ' 45' ' ' ILE . 17.7 t -58.89 -54.39 34.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -84.98 39.76 0.78 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.42 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.055 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 59.1 pttt . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.681 0.277 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.6 mt -80.45 123.86 37.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.42 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.1 mm -109.59 -44.65 6.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.6 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.529 -179.795 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.476 ' O ' ' N ' ' A' ' 65' ' ' LYS . 2.6 m-20 . . . . . 0 N--CA 1.462 0.165 0 CA-C-O 120.305 0.098 . . . . 0.0 110.854 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.416 ' CB ' ' HA ' ' A' ' 64' ' ' ASP . 11.1 t -148.35 135.46 20.23 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.656 0.265 . . . . 0.0 110.347 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.438 ' HG2' ' CZ2' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -114.75 164.61 13.82 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.992 -179.698 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -99.7 127.7 45.82 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.254 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.1 mt -99.03 121.95 50.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.344 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.0 m -87.76 134.03 33.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.593 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 15.8 mt -105.04 165.14 11.29 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.88 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t -70.18 -8.22 48.11 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 . . . . . 0 CA--C 1.531 0.214 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.526 -179.421 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 8.3 mtt . . . . . 0 CA--C 1.529 0.15 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.481 HG22 ' H ' ' A' ' 28' ' ' SER . 1.1 m -163.13 -141.53 0.06 Allowed 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.481 ' H ' HG22 ' A' ' 27' ' ' THR . 96.9 p -158.69 135.92 9.94 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.22 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -156.09 135.39 12.22 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.527 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.3 m -104.02 121.42 43.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.187 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -114.11 114.46 26.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.959 0.409 . . . . 0.0 110.949 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.7 p -124.38 -7.08 7.57 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.481 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.523 ' O ' ' CG ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -158.41 50.96 0.4 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.955 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.626 HG12 ' N ' ' A' ' 35' ' ' ASP . 47.4 t 52.68 168.96 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.121 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.626 ' N ' HG12 ' A' ' 34' ' ' VAL . 46.2 t0 -162.62 -106.38 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.558 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -169.09 -52.08 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.522 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.9 p -48.39 -21.9 0.61 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.716 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.47 ' OE1' ' N ' ' A' ' 35' ' ' ASP . 2.3 pt20 -86.99 147.06 41.99 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.499 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -54.67 136.32 70.5 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 121.64 1.56 . . . . 0.0 110.716 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.402 ' HA ' ' ND2' ' A' ' 43' ' ' ASN . . . -47.31 -37.08 10.24 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.468 ' CB ' HG13 ' A' ' 81' ' ' VAL . 17.6 m-85 -55.16 -34.82 64.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.441 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.879 HD13 HD12 ' A' ' 45' ' ' ILE . 1.9 mm -72.9 -22.02 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.581 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.402 ' ND2' ' HA ' ' A' ' 40' ' ' ALA . 36.7 m-20 -62.1 -40.46 95.94 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 178.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -55.5 -51.9 65.46 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.173 179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.879 HD12 HD13 ' A' ' 42' ' ' ILE . 9.0 mt -49.34 -60.65 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.684 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 68.1 mt -46.61 -35.14 5.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.224 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -14.39 58.14 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.513 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.13 109.85 12.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 120.845 0.355 . . . . 0.0 110.224 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -52.45 136.2 32.19 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.432 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 103.79 -5.13 46.77 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.632 ' O ' ' N ' ' A' ' 53' ' ' SER . 6.0 t -82.34 -21.23 9.76 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 CA-C-N 115.107 -0.547 . . . . 0.0 111.448 -179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 17.1 ttmt 54.92 -65.25 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.677 0.791 . . . . 0.0 111.163 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.632 ' N ' ' O ' ' A' ' 51' ' ' VAL . 1.1 t -172.97 172.06 4.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.587 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.415 ' N ' ' OG ' ' A' ' 53' ' ' SER . 95.4 mt -140.06 149.36 22.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.872 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -140.75 117.26 10.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.221 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -95.59 139.78 31.36 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.975 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.529 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 12.6 p -165.78 144.0 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.032 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.401 ' HG3' ' N ' ' A' ' 59' ' ' ASP . 16.6 ptp 37.3 -130.32 0.15 Allowed 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.288 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 58' ' ' MET . 4.2 p-10 -99.72 43.98 1.04 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.529 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 1.9 p90 -167.33 160.9 13.87 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.534 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 20.1 mt -128.86 136.03 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.346 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -103.32 107.68 18.6 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 39.4 t -101.87 120.31 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.175 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.617 ' O ' ' O ' ' A' ' 51' ' ' VAL . 0.8 OUTLIER -100.71 120.59 40.31 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.028 -179.501 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 13' ' ' ASN . 8.7 pttp -102.41 165.4 11.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.027 0.442 . . . . 0.0 111.137 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -82.6 130.35 35.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.109 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 -51.91 -33.43 37.0 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.875 0.369 . . . . 0.0 110.689 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -67.85 -35.52 78.71 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.817 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.42 162.53 16.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.517 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -111.19 158.65 18.68 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.824 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.438 ' CZ2' ' HG2' ' A' ' 15' ' ' MET . 32.1 m95 -71.5 -49.13 44.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.266 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -50.74 -20.52 1.28 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.535 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.5 m -88.38 -44.88 10.44 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.113 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -80.88 -38.91 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.927 -178.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.552 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -49.15 -57.76 10.66 Favored Pre-proline 0 N--CA 1.466 0.356 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.13 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -43.0 -36.27 5.29 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.648 2.232 . . . . 0.0 112.296 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -81.42 -40.15 23.84 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.84 0.353 . . . . 0.0 110.384 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.443 ' O ' HG23 ' A' ' 81' ' ' VAL . 68.1 t -59.55 -53.41 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.579 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -52.02 -35.32 46.59 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.448 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -50.5 -32.6 18.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.998 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.874 HG21 HD11 ' A' ' 45' ' ' ILE . 18.9 t -60.55 -58.44 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.331 -179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' A' ' 82' ' ' PHE . 1.1 m-85 -81.52 8.13 10.33 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.255 -179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.529 0.169 0 CA-C-O 120.913 0.387 . . . . 0.0 110.472 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? . . . . . 0 N--CA 1.461 0.101 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 62.3 mt -79.32 108.14 12.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.241 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.8 mm -111.75 -76.96 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-N 115.912 -0.586 . . . . 0.0 109.557 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.471 ' H ' ' HB ' ' A' ' 18' ' ' THR . 5.8 m . . . . . 0 C--O 1.235 0.335 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.127 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 30.4 m120 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.385 0.136 . . . . 0.0 110.968 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.409 ' O ' HG23 ' A' ' 14' ' ' THR . 3.0 t -148.54 127.07 12.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.188 0.518 . . . . 0.0 111.644 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.2 ptp -112.1 167.67 10.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.968 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.4 mttp -99.37 166.59 11.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.434 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.4 mt -145.05 105.12 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.978 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.471 ' HB ' ' H ' ' A' ' 5' ' ' SER . 4.5 m -88.58 147.69 24.46 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.508 ' O ' ' CB ' ' A' ' 20' ' ' SER . 11.0 mt -102.85 -10.53 18.99 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.508 ' CB ' ' O ' ' A' ' 19' ' ' LEU . 4.0 p 91.65 -1.07 0.17 Allowed 'General case' 0 N--CA 1.472 0.629 0 O-C-N 123.447 0.467 . . . . 0.0 110.889 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 . . . . . 0 C--N 1.331 -0.2 0 CA-C-O 120.857 0.361 . . . . 0.0 110.964 -179.487 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.414 ' O ' ' CB ' ' A' ' 27' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.181 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.414 ' CB ' ' O ' ' A' ' 26' ' ' MET . 0.2 OUTLIER 80.82 159.76 0.16 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.218 -179.554 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 p -153.2 134.58 14.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.454 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -163.65 144.36 8.85 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.687 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.67 117.87 35.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.588 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.471 ' CG ' ' OE1' ' A' ' 38' ' ' GLN . 73.7 m-85 -109.24 111.66 23.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.438 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 81.9 p -118.32 -13.26 9.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.361 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.444 ' O ' ' C ' ' A' ' 34' ' ' VAL . 17.6 pttt -155.87 61.45 0.59 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.179 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.444 ' C ' ' O ' ' A' ' 33' ' ' LYS . 18.7 t 29.62 90.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.296 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -80.3 -102.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.442 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -175.01 90.28 0.05 Allowed 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.2 p 169.17 -40.58 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.584 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.529 HE22 ' CD1' ' A' ' 46' ' ' LEU . 19.3 pt20 -69.33 147.88 97.22 Favored Pre-proline 0 C--N 1.329 -0.305 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -53.77 137.77 67.75 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 121.883 1.722 . . . . 0.0 111.588 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.39 -38.06 5.59 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.379 0.609 . . . . 0.0 109.455 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.625 ' HB3' HG13 ' A' ' 81' ' ' VAL . 24.4 m-85 -55.33 -31.91 62.07 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.682 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.985 HD13 HD12 ' A' ' 45' ' ' ILE . 2.9 mm -77.55 -22.02 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.553 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -64.77 -36.09 83.17 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.54 ' O ' HG23 ' A' ' 48' ' ' VAL . 1.4 m-20 -58.84 -51.78 68.53 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.203 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.985 HD12 HD13 ' A' ' 42' ' ' ILE . 39.5 mt -48.9 -50.81 13.57 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.873 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.529 ' CD1' HE22 ' A' ' 38' ' ' GLN . 12.0 mt -64.43 -36.18 83.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.054 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -82.54 -6.89 59.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.616 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 44' ' ' ASP . 8.7 t -75.39 111.54 11.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -51.62 100.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.726 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 156.53 -44.52 0.52 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 39.9 t -77.66 149.11 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -105.02 -33.35 8.35 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.496 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.456 ' OG ' ' N ' ' A' ' 54' ' ' ILE . 1.4 t -178.71 175.31 1.08 Allowed 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.129 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.456 ' N ' ' OG ' ' A' ' 53' ' ' SER . 46.8 mt -142.48 152.26 17.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.788 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.412 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 19.8 t80 -137.83 108.52 6.62 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.139 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -95.45 132.54 40.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.199 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.744 HG22 ' H ' ' A' ' 58' ' ' MET . 9.8 p -162.29 175.72 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.327 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.744 ' H ' HG22 ' A' ' 57' ' ' VAL . 14.8 ttt 34.54 -100.34 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.357 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -140.58 11.36 2.29 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.83 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -128.35 172.31 11.2 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.142 0.496 . . . . 0.0 111.23 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.1 mt -135.01 133.79 53.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.884 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.5 t -104.78 110.18 22.42 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.507 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.7 t -100.09 114.35 38.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.437 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -109.1 140.51 42.56 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.071 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -133.12 -172.09 2.85 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.703 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -98.4 -172.52 2.35 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -87.5 -47.21 8.92 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.054 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -48.94 -34.13 12.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.798 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.16 170.07 11.81 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.602 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -134.18 173.66 11.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.554 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.7 m95 -85.46 -54.77 4.37 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.451 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -51.53 -20.79 2.07 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 m -87.39 -45.48 10.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.909 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -76.54 -37.21 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.333 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.463 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.3 mm? -48.18 -61.95 2.66 Favored Pre-proline 0 N--CA 1.466 0.356 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.349 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -42.96 -32.73 2.82 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 C-N-CA 122.853 2.369 . . . . 0.0 112.587 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -83.29 -49.57 9.27 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.568 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.484 ' O ' HG23 ' A' ' 81' ' ' VAL . 17.6 t -57.15 -48.55 81.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.158 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -53.14 -40.73 64.46 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.038 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -51.38 -34.64 35.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.7 HG21 HD11 ' A' ' 45' ' ' ILE . 18.5 t -53.23 -60.19 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.08 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.84 49.65 1.76 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.378 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 . . . . . 0 C--O 1.234 0.258 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.08 179.391 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.2 mtm . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -166.84 62.8 0.09 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.624 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 52.6 mt 55.1 101.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.326 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 mm -105.44 -30.06 2.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.486 -179.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 89.0 p -172.59 139.99 0.99 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.035 0.445 . . . . 0.0 111.608 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.676 HG22 ' H ' ' A' ' 7' ' ' SER . 19.3 mm -94.51 175.89 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.68 178.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.676 ' H ' HG22 ' A' ' 6' ' ' ILE . 3.4 t -140.85 139.19 34.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.918 0.39 . . . . 0.0 110.641 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -76.56 147.93 37.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.307 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 11' ' ' ASN . 0.0 OUTLIER -149.46 151.36 33.28 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.851 -179.591 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -46.99 -41.51 25.99 Favored 'Trans proline' 0 C--N 1.307 -1.635 0 C-N-CA 122.407 2.071 . . . . 0.0 112.05 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.454 ' O ' HG23 ' A' ' 9' ' ' THR . 13.7 t-20 -95.74 178.59 5.4 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.229 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -140.76 20.13 2.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.379 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -88.37 -24.15 23.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.377 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.401 HG23 ' O ' ' A' ' 14' ' ' THR . 12.5 t -150.14 129.64 13.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.967 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -116.55 154.48 30.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.265 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.05 134.61 37.55 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.937 0.399 . . . . 0.0 110.721 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.4 mt -98.34 123.24 50.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.318 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 86.1 m -85.53 131.47 34.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.002 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.4 mt -101.16 162.17 13.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.363 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 62.2 p -67.5 -5.55 15.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.293 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -92.07 165.64 13.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.714 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 92.5 p -150.65 171.51 17.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.474 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 24' ' ' GLU . 27.1 mmt180 44.1 -158.56 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.794 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.401 ' C ' ' O ' ' A' ' 23' ' ' ARG . 50.3 mt-10 32.56 -96.95 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.623 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 134.62 139.02 4.02 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 21.7 mtp -90.49 -123.61 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.4 p -75.47 164.1 26.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.735 0.302 . . . . 0.0 110.537 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.1 p -158.2 101.26 1.73 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.505 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.443 ' H ' ' HB3' ' A' ' 56' ' ' HIS . 3.8 m-20 -162.82 160.24 24.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.752 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 m -102.58 135.23 44.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.286 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -119.16 106.57 12.5 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.168 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.88 -3.05 8.19 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.725 -179.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.0 pttt -154.09 34.76 0.43 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.545 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.765 HG12 ' H ' ' A' ' 35' ' ' ASP . 17.8 t 51.57 177.93 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.555 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.765 ' H ' HG12 ' A' ' 34' ' ' VAL . 12.7 t70 62.52 109.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.846 0.355 . . . . 0.0 110.859 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 175.24 21.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.74 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 p 74.69 18.23 2.79 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.055 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.21 172.07 9.87 Favored Pre-proline 0 C--N 1.332 -0.166 0 N-CA-C 109.929 -0.396 . . . . 0.0 109.929 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -73.11 130.13 14.99 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.519 2.146 . . . . 0.0 111.388 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.85 -37.2 8.39 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.024 0.44 . . . . 0.0 110.28 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.64 ' CB ' HG13 ' A' ' 81' ' ' VAL . 8.0 m-85 -54.21 -33.28 57.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.721 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 1.059 HD13 HD12 ' A' ' 45' ' ' ILE . 3.0 mm -77.47 -23.62 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.163 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.411 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -60.81 -35.76 77.3 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.783 ' O ' HG23 ' A' ' 48' ' ' VAL . 3.9 t70 -58.33 -51.66 68.87 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.526 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 1.059 HD12 HD13 ' A' ' 42' ' ' ILE . 61.4 mt -50.31 -50.14 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.805 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -62.92 -37.33 86.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.525 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -83.6 -10.07 58.49 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.06 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.783 HG23 ' O ' ' A' ' 44' ' ' ASP . 27.5 t -76.3 116.86 20.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 49' ' ' GLU . 8.9 mt-10 -51.73 134.39 30.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.681 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 113.49 -30.21 7.4 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 43.0 t -79.47 145.0 10.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.738 0.304 . . . . 0.0 110.202 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -103.11 -52.34 3.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.224 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 p -169.98 178.45 3.95 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.637 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 82.7 mt -138.59 151.4 24.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.184 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.41 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 17.9 t80 -138.23 107.59 6.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.005 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.443 ' HB3' ' H ' ' A' ' 29' ' ' ASP . 5.1 t-80 -94.57 131.64 40.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.248 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.448 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 1.5 p -165.59 156.9 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.444 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 7.7 ttm 44.0 -138.99 0.31 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.45 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -103.68 38.99 1.69 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.695 0.283 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.448 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 37.2 p90 -158.26 170.82 21.4 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.987 0.422 . . . . 0.0 111.009 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 58.0 mt -138.06 133.21 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.656 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 m -101.04 111.41 23.61 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.155 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.3 t -103.53 117.38 48.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.06 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 64' ' ' ASP . 0.2 OUTLIER -106.19 141.88 36.8 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.46 -179.632 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -121.78 -171.57 2.26 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.957 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -97.19 131.73 43.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -50.57 -26.68 5.57 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.84 0.353 . . . . 0.0 110.608 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -71.46 -33.22 69.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.66 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.87 -172.93 4.22 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.835 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -134.17 -175.36 3.83 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.277 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -99.06 -46.81 5.46 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.185 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.597 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 2.1 mp0 -53.26 -21.89 6.1 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.233 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.479 HG23 ' N ' ' A' ' 74' ' ' VAL . 6.2 t -86.29 -43.78 12.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.163 0.506 . . . . 0.0 110.222 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.479 ' N ' HG23 ' A' ' 73' ' ' THR . 1.0 OUTLIER -78.68 -37.77 21.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.838 -178.961 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.533 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.8 mp -47.65 -57.47 9.83 Favored Pre-proline 0 N--CA 1.467 0.396 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.0 Cg_exo -44.32 -32.25 5.08 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 122.497 2.131 . . . . 0.0 112.217 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -81.84 -41.21 21.37 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.249 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 85.9 t -60.67 -45.1 98.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.842 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -53.76 -40.98 66.67 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.575 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.27 -32.89 62.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.367 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.64 HG13 ' CB ' ' A' ' 41' ' ' PHE . 16.7 t -56.74 -66.63 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.887 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -83.26 27.23 0.59 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.754 0.311 . . . . 0.0 110.999 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -160.26 88.11 0.8 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.073 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.454 ' O ' ' CB ' ' A' ' 85' ' ' GLU . 0.4 OUTLIER -164.17 21.63 0.07 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.799 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.454 ' CB ' ' O ' ' A' ' 84' ' ' LEU . 4.2 tp10 83.32 123.71 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.29 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -109.14 115.2 29.58 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.658 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -152.05 -178.83 7.01 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.31 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -121.6 71.24 0.96 Allowed 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.076 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -45.47 120.23 2.45 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.6 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 78.4 t60 -155.99 -36.36 0.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.714 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 117.815 -1.088 . . . . 0.0 110.48 -179.781 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.46 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.489 1.499 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -150.77 158.53 44.26 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.918 -179.279 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 mt -80.81 122.96 36.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.159 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.5 mm -107.24 -19.11 6.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.609 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.4 t -167.62 126.8 1.32 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.98 0.419 . . . . 0.0 111.183 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.787 HG22 ' H ' ' A' ' 7' ' ' SER . 29.5 mt -98.87 178.6 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.271 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.787 ' H ' HG22 ' A' ' 6' ' ' ILE . 51.6 p -140.16 145.37 37.42 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -161.2 -12.39 0.04 OUTLIER 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.751 0.786 . . . . 0.0 110.131 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.642 ' H ' ' CD ' ' A' ' 10' ' ' PRO . 1.7 m -111.65 -38.8 0.11 Allowed Pre-proline 0 C--N 1.309 -1.156 0 CA-C-N 114.08 -1.418 . . . . 0.0 111.721 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.642 ' CD ' ' H ' ' A' ' 9' ' ' THR . 3.0 Cg_exo -71.6 -13.76 30.09 Favored 'Trans proline' 0 N--CA 1.491 1.364 0 C-N-CA 121.862 1.708 . . . . 0.0 111.941 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -145.19 -152.45 0.42 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.684 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.463 ' C ' ' H ' ' A' ' 14' ' ' THR . 13.9 t-160 -175.97 149.33 0.9 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.444 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 5.5 m120 69.36 -16.93 0.23 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.458 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.463 ' H ' ' C ' ' A' ' 12' ' ' HIS . 9.9 t -148.05 128.01 13.58 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.76 0.314 . . . . 0.0 110.449 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.49 ' SD ' ' O ' ' A' ' 7' ' ' SER . 52.2 mtm -107.91 143.73 36.13 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.674 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 131.66 44.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.836 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.6 mt -95.92 115.36 34.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.641 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.1 m -84.48 127.78 34.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.388 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' A' ' 21' ' ' GLU . 36.7 mt -99.57 -173.48 2.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.273 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 96.8 p -63.35 -1.79 1.24 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.706 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.405 ' H ' ' C ' ' A' ' 19' ' ' LEU . 62.7 mt-10 56.92 83.15 0.1 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.72 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.3 t -91.9 138.29 31.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.342 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 45.2 mtp85 -70.75 121.11 17.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.689 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 38.94 68.37 0.35 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.932 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -143.25 -38.89 0.07 OUTLIER Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 6.2 mmt -94.41 110.08 21.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.665 0.269 . . . . 0.0 110.516 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 75.3 p -76.73 -124.18 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.291 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 81.1 p -156.19 143.11 18.87 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.248 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -154.01 164.7 38.02 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.816 0.341 . . . . 0.0 110.822 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 57.5 m -144.84 115.19 7.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.886 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.486 ' CE1' ' NE2' ' A' ' 38' ' ' GLN . 4.0 m-85 -104.28 132.39 50.58 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.341 0.591 . . . . 0.0 111.45 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.419 ' O ' ' CB ' ' A' ' 33' ' ' LYS . 11.9 p -120.6 57.42 0.96 Allowed 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.519 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER 89.52 106.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.792 -177.818 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.444 ' C ' ' O ' ' A' ' 33' ' ' LYS . 0.3 OUTLIER 15.57 108.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 114.47 -1.241 . . . . 0.0 113.378 -178.592 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.469 ' O ' ' NE2' ' A' ' 38' ' ' GLN . 8.7 p30 -158.4 -175.02 5.09 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.126 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 50.69 -100.2 0.08 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.436 0.16 . . . . 0.0 110.994 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.3 t -174.43 61.02 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.097 0.475 . . . . 0.0 110.867 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.486 ' NE2' ' CE1' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -82.53 153.68 68.25 Favored Pre-proline 0 N--CA 1.463 0.203 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.52 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -55.0 137.6 76.64 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 121.716 1.611 . . . . 0.0 110.902 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.23 -38.98 9.14 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.424 0.63 . . . . 0.0 109.41 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.538 ' CB ' HG13 ' A' ' 81' ' ' VAL . 3.6 m-85 -55.2 -34.82 64.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.429 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.92 HD13 HD12 ' A' ' 45' ' ' ILE . 2.4 mm -76.55 -22.7 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.3 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -62.15 -36.34 81.54 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.617 ' O ' HG23 ' A' ' 48' ' ' VAL . 6.2 m-20 -55.93 -53.6 54.84 Favored 'General case' 0 CA--C 1.523 -0.095 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.593 178.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.92 HD12 HD13 ' A' ' 42' ' ' ILE . 53.0 mt -47.71 -52.46 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.485 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -65.32 -37.42 87.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.901 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.8 mttm -82.22 -10.9 58.98 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.741 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 44' ' ' ASP . 4.4 t -77.06 121.09 28.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.255 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -52.62 145.48 11.8 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.795 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.92 -29.95 10.24 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 86.7 t -78.29 150.66 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 120.813 0.339 . . . . 0.0 110.724 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.444 ' HZ3' ' HB2' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -109.07 -58.8 1.98 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.317 -179.454 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 91.6 p -166.38 -176.94 3.83 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.521 -178.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.604 HD11 HG21 ' A' ' 45' ' ' ILE . 63.9 mt -137.74 152.21 26.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.985 0.421 . . . . 0.0 111.212 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -139.09 109.71 6.63 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.283 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -97.81 136.63 37.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.366 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.615 HG22 ' N ' ' A' ' 58' ' ' MET . 11.6 p -166.55 169.51 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.049 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.615 ' N ' HG22 ' A' ' 57' ' ' VAL . 3.1 ttm 41.03 -107.53 0.08 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.937 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -139.69 44.77 1.94 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.149 0.5 . . . . 0.0 109.949 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -161.96 168.76 22.31 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.604 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 75.2 mt -129.31 126.15 63.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.422 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.0 t -97.08 116.22 28.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.288 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 39.7 t -105.81 118.54 53.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.348 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -105.26 142.04 35.72 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.99 0.424 . . . . 0.0 110.54 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.481 ' HZ2' ' C ' ' A' ' 70' ' ' ASN . 45.1 pttt -128.92 -171.1 2.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.666 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -98.39 137.86 36.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.507 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.485 ' N ' ' OD1' ' A' ' 67' ' ' ASN . 6.1 p-10 -54.18 -27.9 36.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.676 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.64 -33.02 74.92 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.98 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.95 177.51 6.94 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.899 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.481 ' C ' ' HZ2' ' A' ' 65' ' ' LYS . 29.5 m120 -131.68 163.19 28.69 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.75 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.441 ' CZ2' ' HG3' ' A' ' 15' ' ' MET . 54.7 m95 -77.88 -55.28 5.44 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.275 -179.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -46.87 -21.07 0.17 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.768 0.318 . . . . 0.0 111.06 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.3 m -88.23 -45.74 9.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.283 0.563 . . . . 0.0 110.467 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -84.22 -38.36 13.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.062 -178.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.577 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 0.9 OUTLIER -47.59 -55.1 18.11 Favored Pre-proline 0 N--CA 1.464 0.239 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 -178.851 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.577 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.4 Cg_exo -41.99 -33.06 2.03 Favored 'Trans proline' 0 N--CA 1.49 1.319 0 C-N-CA 122.545 2.163 . . . . 0.0 112.246 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.517 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 0.1 OUTLIER -82.72 -51.46 7.68 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.329 179.397 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 45.1 t -43.87 -53.9 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.593 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -54.25 -40.83 68.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.638 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -49.18 -32.48 10.37 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.327 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.538 HG13 ' CB ' ' A' ' 41' ' ' PHE . 17.0 t -61.38 -59.64 3.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.56 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -85.7 44.55 1.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.016 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -160.59 -35.08 0.05 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.533 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.416 HD21 ' CD1' ' A' ' 41' ' ' PHE . 15.1 mt 39.72 56.16 2.39 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.892 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 42.22 -150.93 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.682 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -114.39 126.52 55.08 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 46.9 m-70 -151.55 -168.98 3.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.585 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 62.37 3.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.213 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.466 ' CG ' ' N ' ' A' ' 90' ' ' HIS . 16.1 t60 -60.6 -103.5 0.0 OUTLIER 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.197 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.466 ' N ' ' CG ' ' A' ' 89' ' ' HIS . 2.3 m-70 -130.96 -36.9 1.32 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.343 . . . . 0.0 110.124 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 14.2 t60 . . . . . 0 C--O 1.221 -0.408 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.459 179.782 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.2 mtm . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.4 mtmm -130.28 -169.93 2.23 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.337 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.486 ' C ' HD12 ' A' ' 4' ' ' ILE . 55.3 mt -81.94 127.09 39.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.337 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.502 ' N ' HD12 ' A' ' 4' ' ' ILE . 1.8 mp -109.19 -55.93 4.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.473 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.8 p -171.13 147.42 2.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.664 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mt -91.32 152.25 3.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.014 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 54.1 p -93.63 -157.82 0.57 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.741 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -72.96 154.8 40.38 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.976 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.552 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 0.3 OUTLIER -149.95 59.85 4.01 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.137 -179.254 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.552 ' HD3' ' N ' ' A' ' 9' ' ' THR . 2.8 Cg_endo -76.73 20.43 0.61 Allowed 'Trans proline' 0 C--N 1.308 -1.579 0 C-N-CA 122.645 2.23 . . . . 0.0 112.181 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -142.75 -16.92 0.69 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.689 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.415 ' CG ' ' H ' ' A' ' 13' ' ' ASN . 3.8 t60 63.27 -157.18 0.33 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.754 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.415 ' H ' ' CG ' ' A' ' 12' ' ' HIS . 16.5 m120 71.55 -51.79 0.69 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.21 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.513 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 8.8 t -145.72 129.24 16.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 0.0 111.164 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.9 mtm -109.77 158.71 17.85 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.369 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -97.6 124.23 41.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.376 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 54.5 mt -98.1 122.31 49.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.751 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 96.7 m -86.39 132.11 34.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.441 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.8 mt -102.02 174.13 6.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.334 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 88.8 p -65.18 -5.24 6.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.098 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 66.07 131.29 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.566 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.6 t -149.23 117.06 6.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.021 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 39.28 90.28 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.676 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 51.31 -91.31 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.855 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -156.13 -162.62 11.54 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -146.11 80.79 1.58 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.866 0.365 . . . . 0.0 110.172 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.0 t 38.79 -151.87 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.629 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.2 p -157.01 141.85 16.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.444 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -156.77 136.06 12.08 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.762 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.1 m -99.36 128.92 45.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.032 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.541 ' CZ ' ' HB3' ' A' ' 38' ' ' GLN . 54.0 m-85 -113.49 118.55 34.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.726 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.3 p -125.22 -12.01 6.91 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.356 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.485 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 19.7 pttm -155.38 31.87 0.38 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.612 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.608 HG12 ' N ' ' A' ' 35' ' ' ASP . 59.6 t 73.71 166.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.468 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.608 ' N ' HG12 ' A' ' 34' ' ' VAL . 33.3 t70 -155.6 -110.32 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.425 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -167.94 -39.45 0.02 OUTLIER 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.733 0.301 . . . . 0.0 110.435 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.0 t -57.92 -31.49 66.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.282 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 31' ' ' TYR . 2.5 pt20 -80.16 153.79 74.6 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.472 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -59.25 138.85 87.21 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.057 1.838 . . . . 0.0 111.386 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.414 ' HA ' ' ND2' ' A' ' 43' ' ' ASN . . . -46.61 -39.96 12.12 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.109 0.48 . . . . 0.0 109.885 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.696 ' CB ' HG13 ' A' ' 81' ' ' VAL . 15.6 m-85 -54.28 -47.52 72.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.772 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.992 HD13 HD12 ' A' ' 45' ' ' ILE . 1.6 mm -55.91 -27.65 22.99 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.386 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.414 ' ND2' ' HA ' ' A' ' 40' ' ' ALA . 21.1 m-20 -62.21 -43.92 97.75 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.413 ' OD2' HG22 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -55.75 -37.62 68.73 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.157 179.28 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.992 HD12 HD13 ' A' ' 42' ' ' ILE . 22.1 mt -62.5 -48.81 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.158 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.618 ' O ' HG21 ' A' ' 51' ' ' VAL . 51.1 mt -55.49 -32.9 63.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.838 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -78.81 -4.51 49.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.28 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.937 ' O ' HG22 ' A' ' 51' ' ' VAL . 58.0 t -77.91 103.57 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -46.92 110.87 0.33 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.661 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 125.26 6.25 6.34 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.937 HG22 ' O ' ' A' ' 48' ' ' VAL . 0.0 OUTLIER -78.8 -21.65 12.9 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.204 0 CA-C-O 118.759 -0.639 . . . . 0.0 112.51 -179.51 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.9 ttmm 51.83 -64.19 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.231 0.469 . . . . 0.0 111.074 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.757 ' N ' ' O ' ' A' ' 51' ' ' VAL . 1.3 p -172.62 165.76 5.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.163 0.506 . . . . 0.0 111.654 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 83.4 mt -140.78 149.64 21.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.24 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -136.8 115.83 12.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.771 0.32 . . . . 0.0 111.006 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -100.2 132.94 45.28 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.977 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.49 HG13 ' CZ ' ' A' ' 60' ' ' PHE . 6.2 p -164.37 153.27 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.825 0.345 . . . . 0.0 110.902 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 13.0 ttt 46.04 -106.83 0.13 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.185 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -133.15 16.5 4.14 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.647 0.261 . . . . 0.0 110.931 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.49 ' CZ ' HG13 ' A' ' 57' ' ' VAL . 50.7 p90 -131.1 164.3 25.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.116 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.8 mt -133.9 130.08 55.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.146 -179.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.09 109.56 21.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.7 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.403 ' O ' ' HA ' ' A' ' 14' ' ' THR . 59.6 t -101.17 119.74 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.682 ' O ' ' O ' ' A' ' 51' ' ' VAL . 0.9 OUTLIER -97.86 154.33 17.71 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.251 179.799 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.587 ' HD2' ' HB3' ' A' ' 69' ' ' ALA . 12.0 pttt -132.42 165.35 24.49 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.237 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.705 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 51.5 mm-40 -52.4 168.84 0.09 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.204 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -34.97 -42.92 0.17 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.066 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -133.55 -54.2 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.139 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.705 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . . . 48.84 -159.21 0.05 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.0 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -145.26 114.51 7.06 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.744 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -71.6 -38.4 70.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.169 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.11 -26.18 48.81 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.951 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.6 m -89.39 -45.84 9.17 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.108 0.48 . . . . 0.0 110.54 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.2 t -66.97 -39.43 83.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.715 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.446 ' CB ' ' CD ' ' A' ' 76' ' ' PRO . 1.4 mm? -49.26 -62.1 2.76 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.83 -0.168 . . . . 0.0 111.385 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' A' ' 75' ' ' LEU . 2.9 Cg_endo -50.29 -31.75 30.68 Favored 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.495 2.13 . . . . 0.0 112.556 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -78.32 -47.12 18.43 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.329 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.72 -39.38 70.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.475 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -55.78 -43.45 76.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.368 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.58 -34.02 48.75 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.378 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.858 HG21 HD11 ' A' ' 45' ' ' ILE . 12.9 t -60.4 -61.68 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.756 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -84.39 10.81 9.74 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.918 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -157.48 76.59 0.83 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.138 0.494 . . . . 0.0 110.179 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.669 ' H ' HD12 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -73.99 -78.93 0.09 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.885 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.99 147.27 38.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.154 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -63.8 127.96 33.7 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.221 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -84.08 86.99 7.13 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.63 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -163.64 89.94 0.61 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.645 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -98.11 -129.39 0.18 Allowed 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -76.96 168.21 20.5 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.471 0.177 . . . . 0.0 110.565 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.3 t60 . . . . . 0 C--O 1.218 -0.553 0 CA-C-O 117.824 -1.084 . . . . 0.0 110.65 179.873 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 ttt . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 32.1 pttt -169.72 -164.14 0.42 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.928 0.394 . . . . 0.0 111.111 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.644 ' C ' HD12 ' A' ' 4' ' ' ILE . 96.7 mt -84.62 122.63 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.759 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.721 ' N ' HD12 ' A' ' 4' ' ' ILE . 1.8 mp -109.68 -31.73 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-O 121.203 0.525 . . . . 0.0 109.752 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.0 t -167.88 158.03 10.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.159 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.8 mt -148.14 111.56 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.063 0.459 . . . . 0.0 111.165 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 26.1 p 43.83 -145.3 0.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.828 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.422 ' H ' ' H ' ' A' ' 9' ' ' THR . 1.0 OUTLIER -151.77 -8.32 0.22 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.066 0.936 . . . . 0.0 109.247 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.819 HG23 ' O ' ' A' ' 9' ' ' THR . 15.3 t -129.71 93.86 33.56 Favored Pre-proline 0 C--N 1.312 -1.052 0 CA-C-N 113.427 -1.715 . . . . 0.0 109.825 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -70.73 26.18 0.2 Allowed 'Trans proline' 0 C--N 1.302 -1.894 0 C-N-CA 122.358 2.039 . . . . 0.0 112.229 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.505 ' H ' ' C ' ' A' ' 9' ' ' THR . 58.3 t30 -141.95 89.67 2.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.124 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -155.32 -114.45 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.997 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -149.18 -35.27 0.18 Allowed 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.8 t -136.73 126.66 25.86 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.87 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.417 ' HG2' ' CH2' ' A' ' 71' ' ' TRP . 13.1 ptp -107.78 154.79 21.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.12 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.4 tttt -102.03 128.12 48.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.464 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.7 mt -99.14 114.12 36.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.91 0.386 . . . . 0.0 111.086 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 84.4 m -88.5 128.04 35.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.497 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.579 HD11 HD11 ' A' ' 61' ' ' ILE . 69.1 mt -102.06 161.48 13.65 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.531 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.42 -1.49 6.6 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.47 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -94.19 114.58 26.72 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.255 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 36.7 m -151.74 76.92 1.21 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.908 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.405 ' H ' ' H ' ' A' ' 24' ' ' GLU . 34.7 ttp85 -168.08 -5.45 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.644 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.405 ' H ' ' H ' ' A' ' 23' ' ' ARG . 5.6 tm-20 -166.47 -46.62 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.157 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.03 166.27 38.42 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 11.8 mtt -94.92 -82.77 0.36 Allowed 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.01 -0.276 . . . . 0.0 110.307 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.643 HG22 ' H ' ' A' ' 28' ' ' SER . 1.8 m -162.98 -143.67 0.08 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.885 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.643 ' H ' HG22 ' A' ' 27' ' ' THR . 11.7 p -156.08 130.3 8.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.245 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -162.28 138.54 7.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.283 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 52.0 m -98.76 148.12 24.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.27 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.401 ' CD1' ' OE1' ' A' ' 38' ' ' GLN . 22.7 m-85 -135.58 120.07 18.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.479 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.3 p -125.06 -7.49 7.16 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.531 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 34' ' ' VAL . 33.4 pttt -158.45 58.38 0.45 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.234 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.423 ' C ' ' O ' ' A' ' 33' ' ' LYS . 19.2 t 26.56 101.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 O-C-N 123.649 0.593 . . . . 0.0 112.521 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -159.49 -156.74 0.53 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.285 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 56.55 -100.24 0.11 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.841 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.5 t -168.2 63.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.401 ' OE1' ' CD1' ' A' ' 31' ' ' TYR . 9.6 mt-30 -92.9 144.9 29.21 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.16 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.462 ' O ' ' N ' ' A' ' 42' ' ' ILE . 3.1 Cg_exo -55.59 134.22 62.66 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 121.596 1.531 . . . . 0.0 110.201 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.408 ' C ' ' O ' ' A' ' 39' ' ' PRO . . . -41.29 -41.44 1.9 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.401 0.619 . . . . 0.0 109.852 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.665 ' CB ' HG13 ' A' ' 81' ' ' VAL . 7.7 m-85 -52.69 -37.98 59.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.202 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.933 HD13 HD12 ' A' ' 45' ' ' ILE . 2.0 mm -70.01 -26.3 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.816 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -61.17 -38.47 86.6 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 48' ' ' VAL . 33.6 t70 -55.53 -53.79 52.07 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.829 179.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.933 HD12 HD13 ' A' ' 42' ' ' ILE . 84.4 mt -45.76 -53.76 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.241 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.5 mt -67.18 -36.88 82.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.871 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -81.18 -8.46 59.76 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.078 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.56 ' N ' ' O ' ' A' ' 44' ' ' ASP . 3.9 t -79.52 115.05 21.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -51.19 113.23 0.88 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.637 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 139.68 -39.94 1.47 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.5 t -78.62 147.75 6.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -108.95 -35.58 6.31 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.375 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.469 ' OG ' ' N ' ' A' ' 54' ' ' ILE . 3.1 t -172.96 176.54 3.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.123 0.487 . . . . 0.0 111.189 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.469 ' N ' ' OG ' ' A' ' 53' ' ' SER . 83.2 mt -137.11 154.5 31.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.655 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -138.3 109.14 6.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.262 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -95.48 129.39 42.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.988 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.422 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 5.0 p -163.33 162.91 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.214 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.422 ' N ' HG22 ' A' ' 57' ' ' VAL . 3.1 ttt 37.29 -137.02 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.023 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -102.87 39.87 1.47 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.737 0.303 . . . . 0.0 110.663 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.422 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 38.6 p90 -161.88 169.58 21.0 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.965 0.412 . . . . 0.0 111.373 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.579 HD11 HD11 ' A' ' 19' ' ' LEU . 4.0 mp -138.19 135.4 44.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.431 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.07 154.83 17.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.167 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.2 t -142.74 112.49 2.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.581 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.7 p-10 -99.04 143.46 29.3 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.011 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.485 ' NZ ' ' NE1' ' A' ' 71' ' ' TRP . 16.6 pttm -124.41 -176.23 3.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.524 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -90.59 129.83 36.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.082 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.34 -34.69 7.15 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -34.42 76.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.562 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.32 166.08 14.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.691 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -108.11 177.48 4.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.584 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.485 ' NE1' ' NZ ' ' A' ' 65' ' ' LYS . 12.2 m95 -98.05 -44.78 6.5 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.591 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.415 ' O ' ' CD ' ' A' ' 76' ' ' PRO . 2.7 pp20? -56.05 -21.27 20.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.673 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.522 HG23 ' N ' ' A' ' 74' ' ' VAL . 15.4 t -86.22 -44.65 11.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.313 0.577 . . . . 0.0 109.71 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.522 ' N ' HG23 ' A' ' 73' ' ' THR . 0.9 OUTLIER -75.39 -37.51 38.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.961 -179.813 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.455 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 2.5 mt -48.56 -61.34 3.31 Favored Pre-proline 0 N--CA 1.466 0.365 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.3 Cg_exo -42.51 -31.65 1.99 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 C-N-CA 122.415 2.076 . . . . 0.0 112.126 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.496 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 0.8 OUTLIER -80.44 -41.97 23.52 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.07 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 81' ' ' VAL . 38.4 t -52.36 -56.15 7.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.216 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -53.09 -33.95 54.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.022 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -54.4 -32.85 58.07 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.219 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.665 HG13 ' CB ' ' A' ' 41' ' ' PHE . 22.0 t -56.95 -64.37 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.018 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.452 ' CD1' ' N ' ' A' ' 82' ' ' PHE . 0.7 OUTLIER -85.22 29.88 0.63 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.101 -179.541 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -162.77 90.13 0.69 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.756 0.312 . . . . 0.0 110.821 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.442 ' O ' ' C ' ' A' ' 85' ' ' GLU . 0.5 OUTLIER -164.25 12.77 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.815 -179.718 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 84' ' ' LEU . 71.9 mm-40 30.61 67.63 0.12 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.702 0.287 . . . . 0.0 111.458 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 19.9 t-160 -61.84 -78.54 0.04 OUTLIER 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.879 0.371 . . . . 0.0 110.185 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -89.67 -170.32 2.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.63 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 34.0 p-80 -141.81 -4.32 1.08 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.6 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -54.23 133.18 44.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.386 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -64.45 114.62 4.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.822 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.178 179.724 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mtt . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -125.22 170.43 11.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.778 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 66.8 mt -81.7 126.34 39.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.799 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.3 mm -110.06 -17.71 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.205 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -169.99 137.54 1.62 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.796 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.712 ' N ' HD12 ' A' ' 6' ' ' ILE . 2.1 mp -94.39 94.46 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.407 -179.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.485 ' CB ' ' H ' ' A' ' 16' ' ' LYS . 19.4 p 44.14 -149.21 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.356 178.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -115.38 -137.83 0.37 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.416 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.742 ' H ' ' CD ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -124.88 -40.37 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.878 -179.459 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.742 ' CD ' ' H ' ' A' ' 9' ' ' THR . 3.7 Cg_exo -71.11 9.9 0.77 Allowed 'Trans proline' 0 C--N 1.314 -1.28 0 C-N-CA 121.969 1.779 . . . . 0.0 112.121 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -93.99 169.15 10.49 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.238 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -172.24 -41.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.034 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -89.3 -19.4 25.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.01 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.44 HG23 ' O ' ' A' ' 14' ' ' THR . 8.6 t -149.25 126.48 11.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.425 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.652 ' SD ' ' CE2' ' A' ' 71' ' ' TRP . 6.7 mtp -108.21 132.21 53.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.39 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.485 ' H ' ' CB ' ' A' ' 7' ' ' SER . 10.7 ttmm -94.27 121.65 36.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.57 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 58.2 mt -93.6 126.3 46.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.844 0.354 . . . . 0.0 110.684 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.3 m -88.13 137.03 32.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.656 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.3 mt -114.98 155.02 27.71 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.398 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.7 p -68.64 2.99 2.07 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.916 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -89.48 173.74 8.18 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.292 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.6 t -151.87 85.23 1.29 Allowed 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.65 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.415 ' O ' ' N ' ' A' ' 25' ' ' GLY . 25.3 ptt-85 36.45 -153.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 O-C-N 123.339 0.399 . . . . 0.0 110.635 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 36.36 32.48 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.778 0.323 . . . . 0.0 111.353 179.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 23' ' ' ARG . . . -171.68 -47.27 0.04 OUTLIER Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 8.0 mmm -91.44 114.1 26.55 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.344 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.0 m -73.59 -131.53 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.243 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.3 p -156.98 133.77 10.17 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.615 0.245 . . . . 0.0 110.419 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -156.43 130.12 8.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.499 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.69 150.5 21.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.403 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -130.76 117.53 19.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.975 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.7 p -118.69 -10.22 10.05 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.187 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.11 48.89 0.33 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.816 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.617 HG12 ' N ' ' A' ' 35' ' ' ASP . 53.8 t 53.68 167.69 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.488 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.617 ' N ' HG12 ' A' ' 34' ' ' VAL . 13.2 m-20 -160.07 -101.93 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.496 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.42 ' C ' ' N ' ' A' ' 38' ' ' GLN . 24.2 t0 -172.48 -50.23 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.455 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.8 m -49.49 -15.35 0.15 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.852 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.42 ' N ' ' C ' ' A' ' 36' ' ' ASP . 1.4 pt20 -93.48 147.52 33.82 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.14 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -55.77 137.59 78.93 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 C-N-CA 121.805 1.67 . . . . 0.0 110.584 179.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.97 -39.09 8.44 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.321 0.582 . . . . 0.0 109.463 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.599 ' CB ' HG13 ' A' ' 81' ' ' VAL . 5.8 m-85 -55.75 -31.03 62.2 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.264 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.982 HD13 HD12 ' A' ' 45' ' ' ILE . 1.7 mm -77.02 -24.53 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 N-CA-C 110.156 -0.312 . . . . 0.0 110.156 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -62.53 -39.65 94.26 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.585 ' O ' ' N ' ' A' ' 48' ' ' VAL . 25.4 t70 -57.7 -52.14 66.66 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.789 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.982 HD12 HD13 ' A' ' 42' ' ' ILE . 56.4 mt -45.41 -52.95 2.06 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.472 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 26.5 mt -61.62 -38.07 86.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.053 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.6 mtpt -84.61 -6.88 59.39 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.172 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.585 ' N ' ' O ' ' A' ' 44' ' ' ASP . 3.7 t -79.86 119.4 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.038 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -52.99 126.24 19.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.82 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 127.22 -39.34 1.96 Allowed Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.5 t -79.75 147.96 6.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.76 0.314 . . . . 0.0 110.735 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -108.97 -34.55 6.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.709 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.1 t -174.09 179.12 1.97 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.067 0.461 . . . . 0.0 110.968 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.0 mt -145.9 138.98 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.075 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -126.6 112.79 15.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.086 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.2 t-160 -93.53 131.24 38.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.418 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.505 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 2.0 p -164.02 156.58 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.837 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.6 ttt 41.27 -141.43 0.08 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.494 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -100.31 27.67 5.53 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 121.173 -0.211 . . . . 0.0 111.069 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.505 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 14.1 p90 -144.62 169.69 17.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.995 0.426 . . . . 0.0 111.056 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.2 mt -136.45 136.86 48.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.307 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.11 110.14 22.12 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.481 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.6 t -98.7 112.5 30.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.683 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 -104.29 134.01 48.23 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.469 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.3 pttt -122.09 -172.91 2.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.404 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -96.32 127.13 42.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.462 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -45.86 -24.75 0.43 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.969 0.414 . . . . 0.0 110.461 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -68.61 -35.22 77.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.004 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.09 163.05 17.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.755 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -111.59 174.03 6.06 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.487 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.652 ' CE2' ' SD ' ' A' ' 15' ' ' MET . 41.0 m95 -92.52 -48.07 6.81 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.019 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -50.59 -22.31 1.95 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.782 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.473 ' CG2' ' N ' ' A' ' 74' ' ' VAL . 4.7 t -88.88 -44.26 10.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.284 0.564 . . . . 0.0 110.166 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.473 ' N ' ' CG2' ' A' ' 73' ' ' THR . 0.9 OUTLIER -77.47 -37.65 25.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.321 -179.16 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.0 OUTLIER -48.42 -60.25 4.77 Favored Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.479 -179.109 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.7 Cg_exo -42.91 -31.31 2.16 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.507 2.138 . . . . 0.0 111.893 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 25.5 mttm -81.4 -41.1 22.42 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.08 -53.76 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.035 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -51.39 -40.97 60.32 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.635 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -52.41 -33.09 42.14 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.97 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.599 HG13 ' CB ' ' A' ' 41' ' ' PHE . 31.1 t -58.85 -63.12 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.753 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -83.65 23.36 0.97 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.887 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -155.99 95.25 1.61 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.053 0.454 . . . . 0.0 110.16 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.536 HD13 ' H ' ' A' ' 85' ' ' GLU . 0.3 OUTLIER -159.69 -107.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.307 179.635 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.536 ' H ' HD13 ' A' ' 84' ' ' LEU . 11.5 mm-40 44.3 -162.54 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.718 0.294 . . . . 0.0 110.607 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 9.8 m80 -78.98 149.21 32.32 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.4 ' ND1' ' C ' ' A' ' 87' ' ' HIS . 13.6 t-80 -82.19 -53.76 5.81 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 65.3 112.17 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.233 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -73.83 107.68 6.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.666 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.409 ' H ' ' H ' ' A' ' 91' ' ' HIS . 1.5 t60 -171.76 3.66 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.132 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.409 ' H ' ' H ' ' A' ' 90' ' ' HIS . 17.2 t-80 . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 118.195 -0.907 . . . . 0.0 111.078 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 36.7 pttt -150.81 -163.99 1.91 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.398 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.593 ' C ' HD12 ' A' ' 4' ' ' ILE . 82.0 mt -80.21 131.7 33.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.766 0.317 . . . . 0.0 110.842 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.593 HD12 ' C ' ' A' ' 3' ' ' ILE . 1.7 mp -108.56 -47.61 7.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.007 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.5 p -172.1 148.67 2.24 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.896 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.798 HG22 ' H ' ' A' ' 7' ' ' SER . 34.9 mt -92.52 178.98 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.028 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.798 ' H ' HG22 ' A' ' 6' ' ' ILE . 12.3 t -92.56 -163.82 1.1 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.507 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -90.16 -6.27 55.52 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.84 0.828 . . . . 0.0 110.462 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 9' ' ' THR . 11.6 t -123.09 55.15 7.31 Favored Pre-proline 0 C--N 1.311 -1.087 0 CA-C-N 113.931 -1.486 . . . . 0.0 110.22 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.418 ' CD ' ' N ' ' A' ' 9' ' ' THR . 2.3 Cg_endo -52.52 -3.67 0.11 Allowed 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 122.924 2.416 . . . . 0.0 113.169 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.456 ' N ' ' OD1' ' A' ' 11' ' ' ASN . 0.5 OUTLIER -137.47 -159.48 0.96 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.572 0.225 . . . . 0.0 110.563 -179.242 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.449 ' CD2' ' N ' ' A' ' 12' ' ' HIS . 3.7 m170 79.49 77.26 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.104 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.4 m120 67.04 -54.96 0.45 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.492 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.2 t -147.84 157.13 43.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.886 0.374 . . . . 0.0 110.971 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.75 161.3 35.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.44 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.42 ' HG2' ' H ' ' A' ' 17' ' ' ILE . 6.7 ttmm -92.03 162.44 14.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.805 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.42 ' H ' ' HG2' ' A' ' 16' ' ' LYS . 71.3 mt -138.68 113.96 8.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.14 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.8 m -84.9 119.2 25.08 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.255 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.548 ' C ' ' H ' ' A' ' 21' ' ' GLU . 64.4 mt -104.5 166.96 10.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.379 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.8 m -69.6 34.3 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.321 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.548 ' H ' ' C ' ' A' ' 19' ' ' LEU . 10.0 mm-40 -87.08 -170.31 3.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.299 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.566 ' O ' ' CB ' ' A' ' 23' ' ' ARG . 34.3 t -149.06 -29.9 0.26 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.23 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.566 ' CB ' ' O ' ' A' ' 22' ' ' SER . 40.2 ttt180 102.29 155.81 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 113.588 -1.642 . . . . 0.0 109.612 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.468 ' CB ' ' O ' ' A' ' 23' ' ' ARG . 6.6 tt0 83.53 27.29 0.1 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.669 -178.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -151.2 -43.34 0.02 OUTLIER Glycine 0 CA--C 1.527 0.827 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 14.8 mtt -91.24 125.28 35.96 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.786 0.327 . . . . 0.0 110.865 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.493 HG23 ' N ' ' A' ' 28' ' ' SER . 9.8 t -75.91 -135.88 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.214 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.493 ' N ' HG23 ' A' ' 27' ' ' THR . 18.2 p -155.73 135.25 12.47 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.673 0.273 . . . . 0.0 110.553 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -158.7 142.13 14.99 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.24 148.56 26.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.324 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -129.73 111.99 13.19 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.201 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.2 p -123.62 -0.83 8.57 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.088 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 35.6 mtmt -151.77 25.44 0.66 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.738 0.304 . . . . 0.0 110.84 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.643 HG12 ' N ' ' A' ' 35' ' ' ASP . 60.0 t 54.85 170.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.052 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.643 ' N ' HG12 ' A' ' 34' ' ' VAL . 12.6 t0 70.54 99.1 0.06 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.546 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -172.73 21.08 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.091 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.1 p 76.93 13.49 2.16 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.169 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.46 174.2 6.5 Favored Pre-proline 0 N--CA 1.465 0.279 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -71.68 129.04 15.02 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.32 2.013 . . . . 0.0 111.192 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.68 -36.88 7.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.958 0.409 . . . . 0.0 110.342 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.622 ' HB3' HG13 ' A' ' 81' ' ' VAL . 31.6 m-85 -54.49 -32.94 58.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.841 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.95 HD13 HD12 ' A' ' 45' ' ' ILE . 4.0 mm -76.52 -20.81 14.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.285 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -62.65 -40.18 96.2 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.602 ' O ' HG23 ' A' ' 48' ' ' VAL . 21.5 m-20 -57.11 -52.5 65.06 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.726 178.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.95 HD12 HD13 ' A' ' 42' ' ' ILE . 73.8 mt -49.04 -49.76 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.599 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.9 mt -63.34 -36.8 84.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.687 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -83.16 -10.9 58.38 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.22 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 44' ' ' ASP . 19.7 t -76.3 124.9 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.911 0.386 . . . . 0.0 110.165 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.486 ' H ' ' CD ' ' A' ' 49' ' ' GLU . 1.8 pm0 -51.14 138.54 19.95 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.142 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 106.35 -35.59 4.95 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.762 -0.935 . . . . 0.0 110.762 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 31.3 t -78.71 138.61 19.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.867 0.365 . . . . 0.0 110.63 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -103.04 -55.13 2.48 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.129 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 64.7 m -161.19 -179.49 7.5 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.465 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.401 HG22 ' N ' ' A' ' 55' ' ' PHE . 93.7 mt -138.02 153.02 26.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.12 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.407 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 20.2 t80 -139.1 110.58 7.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.462 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -98.42 133.09 43.29 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.437 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.43 HG22 ' N ' ' A' ' 58' ' ' MET . 9.3 p -164.5 158.74 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.715 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.43 ' N ' HG22 ' A' ' 57' ' ' VAL . 0.2 OUTLIER 46.22 -137.98 0.61 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.383 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -105.06 44.04 1.06 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.001 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -165.75 172.27 11.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.777 0.322 . . . . 0.0 110.653 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 68.7 mt -135.13 143.55 36.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.385 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.3 t -114.46 114.32 25.65 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.713 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.2 t -99.53 111.93 30.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.886 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.28 146.85 27.43 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.955 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.516 ' HZ1' ' C ' ' A' ' 70' ' ' ASN . 11.5 ptpt -124.52 -164.01 1.22 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.138 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -66.11 -153.6 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.684 0.278 . . . . 0.0 110.506 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.04 -48.2 73.74 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.746 0.308 . . . . 0.0 110.367 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -154.06 -42.98 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.453 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 46.79 -137.45 0.72 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.738 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.516 ' C ' ' HZ1' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -141.88 135.42 29.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.036 179.724 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -91.53 -45.17 8.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.942 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -54.63 -21.93 12.02 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.85 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.465 HG23 ' N ' ' A' ' 74' ' ' VAL . 6.0 t -86.02 -44.11 12.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.115 0.483 . . . . 0.0 110.16 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.465 ' N ' HG23 ' A' ' 73' ' ' THR . 1.1 t -74.26 -38.75 48.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.485 -179.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.502 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.1 mp -48.58 -58.97 6.94 Favored Pre-proline 0 N--CA 1.465 0.299 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 2.9 Cg_endo -46.39 -32.45 11.0 Favored 'Trans proline' 0 N--CA 1.491 1.334 0 C-N-CA 122.471 2.114 . . . . 0.0 111.931 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.68 -42.07 22.65 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.962 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 74.3 t -58.62 -43.84 88.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.095 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -53.7 -44.86 70.13 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.031 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.38 -32.71 40.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.396 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.622 HG13 ' HB3' ' A' ' 41' ' ' PHE . 15.2 t -57.84 -62.75 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.469 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -87.9 -33.84 18.36 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -79.56 50.34 1.12 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.828 0.347 . . . . 0.0 111.351 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.3 mt -77.46 52.45 0.96 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.107 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -72.02 117.32 13.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.986 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -95.06 -83.15 0.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.038 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.3 t-160 -154.9 -42.91 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.782 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -67.45 134.58 51.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.121 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -56.22 156.21 5.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.564 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -142.55 82.23 1.77 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.058 0.456 . . . . 0.0 110.702 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.219 -0.51 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.158 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.507 ' N ' ' H ' ' A' ' 20' ' ' SER . 23.1 mtt . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.9 pttt -149.68 56.88 0.98 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.691 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 39.6 mt 57.43 101.83 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.605 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.6 mm -102.72 -17.72 6.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.798 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.0 t -168.07 118.2 0.79 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.481 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.453 ' CG2' ' N ' ' A' ' 7' ' ' SER . 5.4 mm -93.98 154.32 3.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.852 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.453 ' N ' ' CG2' ' A' ' 6' ' ' ILE . 15.1 t 62.22 140.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.276 -0.875 . . . . 0.0 112.399 178.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.401 ' H ' ' H ' ' A' ' 9' ' ' THR . 1.2 tm-20 -173.7 -7.63 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.572 -1.195 . . . . 0.0 109.91 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.481 ' C ' ' H ' ' A' ' 11' ' ' ASN . 23.6 m -105.6 131.52 21.68 Favored Pre-proline 0 C--N 1.311 -1.078 0 CA-C-N 113.907 -1.497 . . . . 0.0 109.186 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -58.64 3.52 0.15 Allowed 'Trans proline' 0 C--N 1.307 -1.614 0 C-N-CA 121.944 1.763 . . . . 0.0 112.745 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.481 ' H ' ' C ' ' A' ' 9' ' ' THR . 35.8 t30 -91.28 179.04 5.81 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -140.36 -3.48 1.35 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.261 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -85.05 -16.78 39.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.822 0.344 . . . . 0.0 110.352 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.503 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 4.3 t -150.63 131.91 14.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.579 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 63.0 mtm -100.04 156.87 16.93 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.401 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.81 120.7 37.63 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.29 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.8 mt -97.56 110.32 25.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.485 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.2 m -85.2 139.91 31.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.473 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.7 mt -113.69 151.28 32.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.496 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.507 ' H ' ' N ' ' A' ' 1' ' ' MET . 41.9 t -67.27 -2.25 5.7 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.194 179.382 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.83 158.41 16.83 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.636 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.9 m -147.48 -161.98 1.45 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.927 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.459 ' O ' ' N ' ' A' ' 25' ' ' GLY . 11.3 mtt85 41.53 -142.88 0.07 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.497 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 36.84 -92.49 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.394 0.434 . . . . 0.0 111.126 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 23' ' ' ARG . . . 147.5 -13.98 1.4 Allowed Glycine 0 CA--C 1.523 0.569 0 N-CA-C 110.864 -0.894 . . . . 0.0 110.864 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 10.8 tpp 52.81 23.19 2.65 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.819 0.342 . . . . 0.0 110.111 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.2 p 48.9 -162.86 0.03 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.693 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.2 p -156.76 135.23 11.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.332 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -157.38 143.86 17.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 27.6 m -102.05 121.55 42.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.79 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.434 ' HB3' HD11 ' A' ' 46' ' ' LEU . 25.7 m-85 -107.14 114.51 28.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.845 0.355 . . . . 0.0 110.595 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.1 p -132.96 1.72 3.59 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.889 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -157.74 25.84 0.28 Allowed 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.935 -0.306 . . . . 0.0 111.437 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.766 HG12 ' H ' ' A' ' 35' ' ' ASP . 13.9 t 50.2 177.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.264 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.766 ' H ' HG12 ' A' ' 34' ' ' VAL . 9.8 m-20 58.08 94.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -168.14 -43.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.919 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.5 t 164.65 -22.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.68 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.423 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 0.9 OUTLIER -49.39 147.8 5.26 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.985 -179.662 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -56.8 141.23 92.6 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.229 1.953 . . . . 0.0 111.33 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -47.82 -42.69 26.82 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.627 ' CB ' HG13 ' A' ' 81' ' ' VAL . 22.7 m-85 -54.13 -37.08 63.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.676 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.994 HD13 HD12 ' A' ' 45' ' ' ILE . 2.0 mm -71.67 -24.96 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.383 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.9 m-20 -60.41 -40.84 92.39 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.507 ' O ' HG23 ' A' ' 48' ' ' VAL . 10.9 t70 -55.48 -44.46 76.52 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.922 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.994 HD12 HD13 ' A' ' 42' ' ' ILE . 19.3 mt -58.08 -62.7 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.192 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.368 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.469 ' HA ' HG11 ' A' ' 51' ' ' VAL . 49.0 mt -43.15 -35.52 1.39 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.799 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -81.74 -13.83 57.28 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 44' ' ' ASP . 40.8 t -77.29 119.46 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.827 0.346 . . . . 0.0 110.616 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -54.49 143.75 23.25 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.827 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 90.31 -0.55 78.27 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.666 ' O ' ' N ' ' A' ' 53' ' ' SER . 4.1 t -80.41 -19.28 12.0 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt 52.34 -68.1 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 123.412 0.685 . . . . 0.0 111.233 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.666 ' N ' ' O ' ' A' ' 51' ' ' VAL . 18.5 p -174.62 174.45 2.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.107 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 86.1 mt -135.55 147.07 28.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.642 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -135.04 108.75 8.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.253 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -93.8 129.39 40.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.281 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 8.4 p -162.92 148.18 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.126 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 7.2 tpp 50.28 -146.3 0.42 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.394 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 40.4 p-10 -95.83 43.33 1.08 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.619 0.247 . . . . 0.0 111.482 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -163.62 173.7 12.65 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.8 0.333 . . . . 0.0 110.84 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 14.3 mt -137.95 132.9 44.11 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.608 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 t -100.58 109.09 21.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.13 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.3 t -99.95 110.18 26.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.538 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.633 ' O ' ' O ' ' A' ' 51' ' ' VAL . 1.4 m-20 -89.43 146.46 24.63 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.291 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.0 pttp -120.15 171.6 8.36 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.313 0.383 . . . . 0.0 110.392 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.434 ' O ' ' C ' ' A' ' 67' ' ' ASN . 0.3 OUTLIER -58.49 -176.64 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.97 -179.583 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.434 ' C ' ' O ' ' A' ' 66' ' ' GLU . 2.6 m120 -32.06 -60.25 0.27 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.058 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -138.25 -52.19 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.899 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 47.92 -150.25 0.14 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.06 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -142.44 125.08 15.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.467 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 39.6 m95 -73.5 -45.53 53.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.209 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -56.35 -21.34 23.97 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.077 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 m -86.29 -45.08 11.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.197 0.523 . . . . 0.0 110.128 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.97 -38.96 44.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.435 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.496 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.5 mt -49.26 -58.05 9.97 Favored Pre-proline 0 N--CA 1.464 0.232 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -46.17 -32.33 10.14 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 122.171 1.914 . . . . 0.0 111.474 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -80.9 -41.31 23.22 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 48.4 t -66.5 -41.77 89.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.537 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -54.02 -42.62 69.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.735 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.98 -32.75 15.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.154 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.821 HG21 HD11 ' A' ' 45' ' ' ILE . 11.3 t -59.67 -63.33 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.443 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -86.71 -29.96 22.03 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 121.004 -0.279 . . . . 0.0 111.514 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.445 ' C ' ' H ' ' A' ' 85' ' ' GLU . 8.7 tt0 -79.04 57.36 2.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.056 0.455 . . . . 0.0 110.676 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.9 mt -76.58 36.83 0.16 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.35 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.445 ' H ' ' C ' ' A' ' 83' ' ' GLU . 2.3 pt-20 33.2 80.27 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.531 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -58.99 127.47 32.38 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.436 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 32.6 t-80 -152.91 -59.75 0.14 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.382 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -55.29 151.7 9.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.374 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.2 m80 -56.4 174.29 0.14 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.862 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -44.05 147.33 0.52 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.06 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.066 -0.968 . . . . 0.0 110.767 -179.954 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpp? . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -135.03 161.78 34.33 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.545 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.7 mt -80.71 110.38 16.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.636 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.5 mm -104.94 -24.34 4.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.448 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -165.94 125.55 1.67 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.872 0.368 . . . . 0.0 111.198 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.783 HG22 ' H ' ' A' ' 7' ' ' SER . 26.5 mt -95.64 178.72 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.783 ' H ' HG22 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -142.12 113.7 7.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.997 0.427 . . . . 0.0 110.327 179.696 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.48 140.96 29.59 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.85 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.05 171.88 6.24 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.781 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -71.68 -12.35 28.9 Favored 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.287 1.991 . . . . 0.0 111.399 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -102.3 112.81 25.65 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.217 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.534 ' O ' ' CG ' ' A' ' 12' ' ' HIS . 24.1 p-80 -98.28 83.47 3.07 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.086 0.469 . . . . 0.0 110.669 -179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.56 ' CA ' ' HZ3' ' A' ' 65' ' ' LYS . 24.5 t-20 -153.08 -31.86 0.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.996 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.4 ' O ' HG23 ' A' ' 14' ' ' THR . 3.8 t -146.73 128.18 14.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.835 0.35 . . . . 0.0 110.613 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 33.3 mtm -109.01 154.12 22.65 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.555 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.5 mtpt -106.75 118.72 37.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.294 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 56.7 mt -96.28 121.99 47.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.709 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.1 m -86.79 124.5 33.11 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.5 mt -96.01 -154.09 0.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.322 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.8 m -63.91 -3.06 2.19 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.636 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 57.81 91.85 0.04 OUTLIER 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.846 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 6.3 m -89.51 -170.15 2.74 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.509 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.42 ' O ' ' C ' ' A' ' 24' ' ' GLU . 0.2 OUTLIER -72.92 63.67 0.66 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.194 -179.445 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.42 ' C ' ' O ' ' A' ' 23' ' ' ARG . 27.0 mt-10 34.44 53.99 0.61 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.047 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.481 ' C ' ' H ' ' A' ' 27' ' ' THR . . . -146.06 -91.45 0.11 Allowed Glycine 0 CA--C 1.523 0.588 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.0 tpp 49.63 9.06 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.547 0.213 . . . . 0.0 111.068 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 28' ' ' SER . 0.6 OUTLIER 69.55 -161.51 0.17 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -178.867 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.673 ' H ' HG22 ' A' ' 27' ' ' THR . 97.8 p -159.06 144.73 16.33 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.306 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -161.14 156.68 24.72 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.787 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -132.18 128.1 37.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.454 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -107.03 128.83 54.71 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.478 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.8 p -117.76 4.51 12.26 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.683 ' O ' HG23 ' A' ' 34' ' ' VAL . 8.9 ttmm -155.55 -100.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.291 -1.322 . . . . 0.0 109.185 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 33' ' ' LYS . 59.5 t -166.27 97.72 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 114.686 -1.143 . . . . 0.0 109.823 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -161.87 -147.88 0.14 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.304 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 62.66 3.75 1.22 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.968 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 p 65.8 17.65 10.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.342 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.427 ' HB2' ' CD ' ' A' ' 39' ' ' PRO . 3.2 pt20 -55.52 175.81 0.19 Allowed Pre-proline 0 CA--C 1.528 0.105 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.77 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.427 ' CD ' ' HB2' ' A' ' 38' ' ' GLN . 3.7 Cg_exo -71.11 125.57 11.57 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 121.911 1.741 . . . . 0.0 111.4 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.52 -37.72 5.64 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.155 0.502 . . . . 0.0 109.978 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.507 ' HB3' HG13 ' A' ' 81' ' ' VAL . 17.9 m-85 -53.79 -33.42 55.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.398 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.886 HD13 HD12 ' A' ' 45' ' ' ILE . 4.2 mm -78.58 -19.77 13.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.317 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -62.3 -37.69 86.53 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.584 ' O ' ' N ' ' A' ' 48' ' ' VAL . 22.6 t0 -57.78 -50.7 72.37 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.825 178.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.886 HD12 HD13 ' A' ' 42' ' ' ILE . 13.6 mt -48.66 -51.94 10.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.584 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.3 mt -65.14 -38.1 89.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.983 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 37.9 mttm -83.95 -9.82 58.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.722 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.584 ' N ' ' O ' ' A' ' 44' ' ' ASP . 2.6 t -78.21 123.66 35.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 -49.96 133.74 22.2 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.722 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.6 -44.68 1.39 Allowed Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 94.8 t -79.72 138.56 19.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.799 0.333 . . . . 0.0 110.413 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.457 ' NZ ' ' O ' ' A' ' 65' ' ' LYS . 5.6 ttpm? -105.49 -33.08 8.24 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.111 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -176.43 179.53 1.18 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.511 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 76.8 mt -141.06 153.36 20.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.775 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -140.11 107.56 5.56 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.55 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -96.11 142.22 28.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.906 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.542 HG22 ' N ' ' A' ' 58' ' ' MET . 13.1 p -162.47 164.9 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.828 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.542 ' N ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER 27.96 -90.1 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.894 -179.602 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.525 ' H ' ' CG ' ' A' ' 58' ' ' MET . 8.5 p-10 -144.7 42.85 1.36 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.954 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.479 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 8.5 p90 -163.96 151.0 11.9 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.569 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 77.6 mt -113.99 134.49 56.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.518 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.5 t -106.58 111.62 24.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.556 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 16.0 t -99.17 106.03 18.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -96.13 138.85 33.15 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.883 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.56 ' HZ3' ' CA ' ' A' ' 13' ' ' ASN . 2.1 pttm -116.54 -171.59 2.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.212 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.429 ' O ' ' ND2' ' A' ' 13' ' ' ASN . 19.4 mt-10 -61.64 -151.89 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.41 0.444 . . . . 0.0 110.834 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.421 ' OD1' ' N ' ' A' ' 68' ' ' ASP . 5.5 p30 -64.95 -44.5 89.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.315 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.421 ' N ' ' OD1' ' A' ' 67' ' ' ASN . 1.9 t0 -143.4 -53.91 0.37 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.821 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.18 -151.78 0.22 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.486 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -140.56 129.93 23.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.299 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.507 ' HE1' ' NZ ' ' A' ' 65' ' ' LYS . 30.1 m95 -85.15 -44.28 13.09 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.519 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.545 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 16.6 mp0 -55.23 -22.42 17.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.158 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.7 m -90.9 -45.43 8.77 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.102 0.477 . . . . 0.0 110.641 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.25 -38.62 18.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.441 -178.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.534 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 4.4 tt -48.54 -58.08 9.2 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.306 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 2.8 Cg_endo -44.31 -31.24 4.21 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 122.587 2.192 . . . . 0.0 112.072 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.422 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 24.0 mttt -81.22 -49.45 10.77 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.181 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.3 t -50.39 -53.52 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.596 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -55.06 -40.61 70.49 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.824 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -51.87 -33.01 34.61 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.844 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.531 HG21 HD11 ' A' ' 45' ' ' ILE . 17.7 t -58.89 -54.39 34.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -84.98 39.76 0.78 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.42 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.516 ' C ' ' H ' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -159.91 -78.36 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.055 179.747 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 14.4 mt 70.31 -35.26 0.32 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.894 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.516 ' H ' ' C ' ' A' ' 83' ' ' GLU . 1.3 tm-20 -70.42 132.7 46.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.254 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.409 ' C ' ' ND1' ' A' ' 86' ' ' HIS . 1.7 p80 -50.54 162.36 0.25 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.936 0.398 . . . . 0.0 111.31 -179.143 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.443 ' CG ' ' O ' ' A' ' 87' ' ' HIS . 21.9 p-80 -157.01 91.38 1.19 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.25 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.6 m170 -73.9 -132.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.134 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 38.8 t60 -158.65 -51.22 0.06 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.43 . . . . 0.0 109.997 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.403 ' CD2' ' H ' ' A' ' 90' ' ' HIS . 3.9 p80 -59.6 145.54 44.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.455 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.404 ' CG ' ' O ' ' A' ' 91' ' ' HIS . 12.2 t-80 . . . . . 0 C--O 1.221 -0.4 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.794 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.8 mtt . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -141.83 -163.21 1.53 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.564 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.6 mt -80.45 123.86 37.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.42 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.1 mm -109.59 -44.65 6.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.6 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 t -171.08 153.58 3.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.529 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.497 HG22 ' H ' ' A' ' 7' ' ' SER . 1.1 mm -97.41 -161.63 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.291 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.497 ' H ' HG22 ' A' ' 6' ' ' ILE . 42.0 m -147.88 73.52 1.27 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.776 0.322 . . . . 0.0 110.404 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.549 ' H ' ' CD ' ' A' ' 8' ' ' GLU . 0.8 OUTLIER -41.27 130.64 2.86 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.258 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 t -148.27 148.38 28.92 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.292 -179.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -49.44 -13.55 0.45 Allowed 'Trans proline' 0 C--N 1.311 -1.441 0 C-N-CA 122.429 2.086 . . . . 0.0 111.895 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -98.41 163.55 12.65 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.406 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 56.1 m80 -140.03 -144.86 0.17 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.041 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.476 ' O ' ' N ' ' A' ' 65' ' ' LYS . 2.6 m-20 70.05 -41.68 0.49 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.854 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.416 ' CB ' ' HA ' ' A' ' 64' ' ' ASP . 11.1 t -148.35 135.46 20.23 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.656 0.265 . . . . 0.0 110.347 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.438 ' HG2' ' CZ2' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -114.75 164.61 13.82 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.992 -179.698 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -99.7 127.7 45.82 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.254 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.1 mt -99.03 121.95 50.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.344 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.0 m -87.76 134.03 33.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.593 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 15.8 mt -105.04 165.14 11.29 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.88 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t -70.18 -8.22 48.11 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -98.17 99.45 10.7 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.526 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.425 ' O ' ' C ' ' A' ' 23' ' ' ARG . 7.3 t -90.85 179.92 5.66 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.797 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 24' ' ' GLU . 37.7 mmm-85 33.04 -122.96 0.08 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.81 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.435 ' C ' ' O ' ' A' ' 23' ' ' ARG . 2.4 mp0 34.01 -106.93 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 O-C-N 123.319 0.387 . . . . 0.0 110.595 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 134.52 127.93 2.77 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 8.3 mtt -92.64 -92.91 0.16 Allowed 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.481 HG22 ' H ' ' A' ' 28' ' ' SER . 1.1 m -163.13 -141.53 0.06 Allowed 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.481 ' H ' HG22 ' A' ' 27' ' ' THR . 96.9 p -158.69 135.92 9.94 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.22 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -156.09 135.39 12.22 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.527 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.3 m -104.02 121.42 43.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.187 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -114.11 114.46 26.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.959 0.409 . . . . 0.0 110.949 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.7 p -124.38 -7.08 7.57 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.481 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.523 ' O ' ' CG ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -158.41 50.96 0.4 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.955 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.626 HG12 ' N ' ' A' ' 35' ' ' ASP . 47.4 t 52.68 168.96 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.121 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.626 ' N ' HG12 ' A' ' 34' ' ' VAL . 46.2 t0 -162.62 -106.38 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.558 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -169.09 -52.08 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.522 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.9 p -48.39 -21.9 0.61 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.716 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.47 ' OE1' ' N ' ' A' ' 35' ' ' ASP . 2.3 pt20 -86.99 147.06 41.99 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.499 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -54.67 136.32 70.5 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 121.64 1.56 . . . . 0.0 110.716 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.402 ' HA ' ' ND2' ' A' ' 43' ' ' ASN . . . -47.31 -37.08 10.24 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.468 ' CB ' HG13 ' A' ' 81' ' ' VAL . 17.6 m-85 -55.16 -34.82 64.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.441 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.879 HD13 HD12 ' A' ' 45' ' ' ILE . 1.9 mm -72.9 -22.02 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.581 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.402 ' ND2' ' HA ' ' A' ' 40' ' ' ALA . 36.7 m-20 -62.1 -40.46 95.94 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 178.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -55.5 -51.9 65.46 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.173 179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.879 HD12 HD13 ' A' ' 42' ' ' ILE . 9.0 mt -49.34 -60.65 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.684 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 68.1 mt -46.61 -35.14 5.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.224 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -14.39 58.14 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.513 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.13 109.85 12.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 120.845 0.355 . . . . 0.0 110.224 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -52.45 136.2 32.19 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.432 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 103.79 -5.13 46.77 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.632 ' O ' ' N ' ' A' ' 53' ' ' SER . 6.0 t -82.34 -21.23 9.76 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 CA-C-N 115.107 -0.547 . . . . 0.0 111.448 -179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 17.1 ttmt 54.92 -65.25 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.677 0.791 . . . . 0.0 111.163 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.632 ' N ' ' O ' ' A' ' 51' ' ' VAL . 1.1 t -172.97 172.06 4.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.587 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.415 ' N ' ' OG ' ' A' ' 53' ' ' SER . 95.4 mt -140.06 149.36 22.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.872 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -140.75 117.26 10.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.221 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -95.59 139.78 31.36 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.975 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.529 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 12.6 p -165.78 144.0 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.032 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.401 ' HG3' ' N ' ' A' ' 59' ' ' ASP . 16.6 ptp 37.3 -130.32 0.15 Allowed 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.288 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 58' ' ' MET . 4.2 p-10 -99.72 43.98 1.04 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.529 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 1.9 p90 -167.33 160.9 13.87 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.534 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 20.1 mt -128.86 136.03 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.346 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -103.32 107.68 18.6 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 39.4 t -101.87 120.31 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.175 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.617 ' O ' ' O ' ' A' ' 51' ' ' VAL . 0.8 OUTLIER -100.71 120.59 40.31 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.028 -179.501 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 13' ' ' ASN . 8.7 pttp -102.41 165.4 11.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.027 0.442 . . . . 0.0 111.137 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -82.6 130.35 35.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.109 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 -51.91 -33.43 37.0 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.875 0.369 . . . . 0.0 110.689 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -67.85 -35.52 78.71 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.817 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.42 162.53 16.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.517 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -111.19 158.65 18.68 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.824 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.438 ' CZ2' ' HG2' ' A' ' 15' ' ' MET . 32.1 m95 -71.5 -49.13 44.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.266 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -50.74 -20.52 1.28 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.535 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.5 m -88.38 -44.88 10.44 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.113 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -80.88 -38.91 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.927 -178.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.552 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -49.15 -57.76 10.66 Favored Pre-proline 0 N--CA 1.466 0.356 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.13 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -43.0 -36.27 5.29 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.648 2.232 . . . . 0.0 112.296 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -81.42 -40.15 23.84 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.84 0.353 . . . . 0.0 110.384 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.443 ' O ' HG23 ' A' ' 81' ' ' VAL . 68.1 t -59.55 -53.41 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.579 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -52.02 -35.32 46.59 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.448 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -50.5 -32.6 18.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.998 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.874 HG21 HD11 ' A' ' 45' ' ' ILE . 18.9 t -60.55 -58.44 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.331 -179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' A' ' 82' ' ' PHE . 1.1 m-85 -81.52 8.13 10.33 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.255 -179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -159.81 82.7 0.73 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 120.913 0.387 . . . . 0.0 110.472 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.9 mt -76.43 52.18 0.76 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.191 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 53.28 -177.24 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -72.01 -34.29 68.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.7 -179.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 22.7 t-80 -86.72 103.71 15.43 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.58 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.457 ' ND1' ' N ' ' A' ' 89' ' ' HIS . 59.4 t-80 -61.82 160.24 12.34 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.513 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.457 ' N ' ' ND1' ' A' ' 88' ' ' HIS . 20.8 t-80 -74.12 -82.78 0.06 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.909 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.439 ' CD2' ' N ' ' A' ' 91' ' ' HIS . 40.4 p-80 42.02 -155.1 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.119 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.476 ' ND1' ' N ' ' A' ' 91' ' ' HIS . 2.5 p-80 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.522 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 mtt . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -151.68 179.22 8.59 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.263 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 62.3 mt -79.32 108.14 12.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.241 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.8 mm -111.75 -76.96 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-N 115.912 -0.586 . . . . 0.0 109.557 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.471 ' H ' ' HB ' ' A' ' 18' ' ' THR . 5.8 m -74.78 122.96 24.11 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.127 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.43 HG23 ' SD ' ' A' ' 15' ' ' MET . 7.5 mt -98.05 -67.6 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 CA-C-O 121.816 0.817 . . . . 0.0 110.547 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.4 t 64.97 128.66 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 113.998 -1.456 . . . . 0.0 110.05 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.423 ' CD ' ' N ' ' A' ' 8' ' ' GLU . 1.7 pm0 -127.49 -165.0 1.42 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.34 166.93 15.8 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.805 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -69.39 -14.37 37.14 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.197 1.932 . . . . 0.0 112.387 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.462 ' ND2' ' OD1' ' A' ' 13' ' ' ASN . 1.6 p-10 -106.73 -10.85 15.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.476 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.417 ' O ' ' ND2' ' A' ' 13' ' ' ASN . 81.0 m80 48.61 94.04 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.378 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.462 ' OD1' ' ND2' ' A' ' 11' ' ' ASN . 30.4 m120 -149.96 -38.98 0.14 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.968 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.409 ' O ' HG23 ' A' ' 14' ' ' THR . 3.0 t -148.54 127.07 12.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.188 0.518 . . . . 0.0 111.644 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.43 ' SD ' HG23 ' A' ' 6' ' ' ILE . 2.2 ptp -112.1 167.67 10.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.968 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.427 ' N ' ' O ' ' A' ' 6' ' ' ILE . 32.4 mttp -99.37 166.59 11.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.434 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.4 mt -145.05 105.12 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.978 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.471 ' HB ' ' H ' ' A' ' 5' ' ' SER . 4.5 m -88.58 147.69 24.46 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.508 ' O ' ' CB ' ' A' ' 20' ' ' SER . 11.0 mt -102.85 -10.53 18.99 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.508 ' CB ' ' O ' ' A' ' 19' ' ' LEU . 4.0 p 91.65 -1.07 0.17 Allowed 'General case' 0 N--CA 1.472 0.629 0 O-C-N 123.447 0.467 . . . . 0.0 110.889 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -143.87 155.55 44.14 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.857 0.361 . . . . 0.0 110.964 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.0 m -150.77 177.46 10.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.085 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.403 ' O ' ' C ' ' A' ' 24' ' ' GLU . 11.0 ttm180 -168.6 36.48 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.787 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.403 ' C ' ' O ' ' A' ' 23' ' ' ARG . 9.6 mp0 38.22 36.12 0.11 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.177 0.513 . . . . 0.0 110.458 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 161.76 60.3 0.02 OUTLIER Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.817 -0.913 . . . . 0.0 110.817 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.414 ' O ' ' CB ' ' A' ' 27' ' ' THR . 0.4 OUTLIER -91.45 21.36 4.6 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.414 ' CB ' ' O ' ' A' ' 26' ' ' MET . 0.2 OUTLIER 80.82 159.76 0.16 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.218 -179.554 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 p -153.2 134.58 14.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.454 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -163.65 144.36 8.85 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.687 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.67 117.87 35.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.588 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.471 ' CG ' ' OE1' ' A' ' 38' ' ' GLN . 73.7 m-85 -109.24 111.66 23.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.438 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 81.9 p -118.32 -13.26 9.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.361 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.444 ' O ' ' C ' ' A' ' 34' ' ' VAL . 17.6 pttt -155.87 61.45 0.59 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.179 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.444 ' C ' ' O ' ' A' ' 33' ' ' LYS . 18.7 t 29.62 90.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.296 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -80.3 -102.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.442 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -175.01 90.28 0.05 Allowed 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.2 p 169.17 -40.58 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.584 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.529 HE22 ' CD1' ' A' ' 46' ' ' LEU . 19.3 pt20 -69.33 147.88 97.22 Favored Pre-proline 0 C--N 1.329 -0.305 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -53.77 137.77 67.75 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 121.883 1.722 . . . . 0.0 111.588 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.39 -38.06 5.59 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.379 0.609 . . . . 0.0 109.455 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.625 ' HB3' HG13 ' A' ' 81' ' ' VAL . 24.4 m-85 -55.33 -31.91 62.07 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.682 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.985 HD13 HD12 ' A' ' 45' ' ' ILE . 2.9 mm -77.55 -22.02 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.553 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -64.77 -36.09 83.17 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.54 ' O ' HG23 ' A' ' 48' ' ' VAL . 1.4 m-20 -58.84 -51.78 68.53 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.203 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.985 HD12 HD13 ' A' ' 42' ' ' ILE . 39.5 mt -48.9 -50.81 13.57 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.873 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.529 ' CD1' HE22 ' A' ' 38' ' ' GLN . 12.0 mt -64.43 -36.18 83.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.054 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -82.54 -6.89 59.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.616 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 44' ' ' ASP . 8.7 t -75.39 111.54 11.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -51.62 100.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.726 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 156.53 -44.52 0.52 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 39.9 t -77.66 149.11 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -105.02 -33.35 8.35 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.496 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.456 ' OG ' ' N ' ' A' ' 54' ' ' ILE . 1.4 t -178.71 175.31 1.08 Allowed 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.129 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.456 ' N ' ' OG ' ' A' ' 53' ' ' SER . 46.8 mt -142.48 152.26 17.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.788 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.412 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 19.8 t80 -137.83 108.52 6.62 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.139 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -95.45 132.54 40.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.199 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.744 HG22 ' H ' ' A' ' 58' ' ' MET . 9.8 p -162.29 175.72 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.327 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.744 ' H ' HG22 ' A' ' 57' ' ' VAL . 14.8 ttt 34.54 -100.34 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.357 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -140.58 11.36 2.29 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.83 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -128.35 172.31 11.2 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.142 0.496 . . . . 0.0 111.23 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.1 mt -135.01 133.79 53.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.884 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.5 t -104.78 110.18 22.42 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.507 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.7 t -100.09 114.35 38.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.437 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -109.1 140.51 42.56 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.071 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -133.12 -172.09 2.85 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.703 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -98.4 -172.52 2.35 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -87.5 -47.21 8.92 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.054 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -48.94 -34.13 12.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.798 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.16 170.07 11.81 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.602 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -134.18 173.66 11.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.554 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.7 m95 -85.46 -54.77 4.37 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.451 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -51.53 -20.79 2.07 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 m -87.39 -45.48 10.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.909 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -76.54 -37.21 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.333 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.463 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.3 mm? -48.18 -61.95 2.66 Favored Pre-proline 0 N--CA 1.466 0.356 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.349 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -42.96 -32.73 2.82 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 C-N-CA 122.853 2.369 . . . . 0.0 112.587 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -83.29 -49.57 9.27 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.568 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.484 ' O ' HG23 ' A' ' 81' ' ' VAL . 17.6 t -57.15 -48.55 81.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.158 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -53.14 -40.73 64.46 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.038 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.488 ' O ' HD22 ' A' ' 84' ' ' LEU . . . -51.38 -34.64 35.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.7 HG21 HD11 ' A' ' 45' ' ' ILE . 18.5 t -53.23 -60.19 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.08 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.84 49.65 1.76 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.378 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -157.6 -76.78 0.08 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.08 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 80' ' ' ALA . 3.6 mm? 57.53 7.75 0.56 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.94 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -70.92 121.49 18.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.995 0.426 . . . . 0.0 110.785 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -111.46 150.92 29.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.845 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 51.21 62.68 2.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.228 0.537 . . . . 0.0 110.303 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.505 ' O ' ' ND1' ' A' ' 88' ' ' HIS . 10.2 p80 -74.19 93.36 2.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.737 -179.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -89.88 55.36 3.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.246 0.546 . . . . 0.0 110.427 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -71.44 134.96 46.97 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.286 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.7 p-80 . . . . . 0 C--O 1.219 -0.522 0 CA-C-O 117.849 -1.072 . . . . 0.0 111.331 -179.756 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.695 0.283 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 52.6 mt 55.1 101.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.326 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 mm -105.44 -30.06 2.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.486 -179.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 89.0 p . . . . . 0 N--CA 1.463 0.205 0 CA-C-O 121.035 0.445 . . . . 0.0 111.608 -179.874 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.658 0.266 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.401 HG23 ' O ' ' A' ' 14' ' ' THR . 12.5 t -150.14 129.64 13.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.967 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -116.55 154.48 30.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.265 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.05 134.61 37.55 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.937 0.399 . . . . 0.0 110.721 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.4 mt -98.34 123.24 50.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.318 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 86.1 m -85.53 131.47 34.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.002 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.4 mt -101.16 162.17 13.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.363 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 62.2 p -67.5 -5.55 15.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.293 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.714 -179.737 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 21.7 mtp . . . . . 0 CA--C 1.53 0.188 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.4 p -75.47 164.1 26.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.735 0.302 . . . . 0.0 110.537 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.1 p -158.2 101.26 1.73 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.505 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.443 ' H ' ' HB3' ' A' ' 56' ' ' HIS . 3.8 m-20 -162.82 160.24 24.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.752 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 m -102.58 135.23 44.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.286 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -119.16 106.57 12.5 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.168 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.88 -3.05 8.19 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.725 -179.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.0 pttt -154.09 34.76 0.43 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.545 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.765 HG12 ' H ' ' A' ' 35' ' ' ASP . 17.8 t 51.57 177.93 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.555 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.765 ' H ' HG12 ' A' ' 34' ' ' VAL . 12.7 t70 62.52 109.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.846 0.355 . . . . 0.0 110.859 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 175.24 21.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.74 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 p 74.69 18.23 2.79 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.055 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.21 172.07 9.87 Favored Pre-proline 0 C--N 1.332 -0.166 0 N-CA-C 109.929 -0.396 . . . . 0.0 109.929 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -73.11 130.13 14.99 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.519 2.146 . . . . 0.0 111.388 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.85 -37.2 8.39 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.024 0.44 . . . . 0.0 110.28 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.64 ' CB ' HG13 ' A' ' 81' ' ' VAL . 8.0 m-85 -54.21 -33.28 57.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.721 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 1.059 HD13 HD12 ' A' ' 45' ' ' ILE . 3.0 mm -77.47 -23.62 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.163 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.411 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.578 HD22 ' N ' ' A' ' 43' ' ' ASN . 0.9 OUTLIER -60.81 -35.76 77.3 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.715 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.783 ' O ' HG23 ' A' ' 48' ' ' VAL . 3.9 t70 -58.33 -51.66 68.87 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.526 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 1.059 HD12 HD13 ' A' ' 42' ' ' ILE . 61.4 mt -50.31 -50.14 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.805 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -62.92 -37.33 86.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.525 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -83.6 -10.07 58.49 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.06 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.783 HG23 ' O ' ' A' ' 44' ' ' ASP . 27.5 t -76.3 116.86 20.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 49' ' ' GLU . 8.9 mt-10 -51.73 134.39 30.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.681 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 113.49 -30.21 7.4 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 43.0 t -79.47 145.0 10.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.738 0.304 . . . . 0.0 110.202 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -103.11 -52.34 3.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.224 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 p -169.98 178.45 3.95 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.637 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 82.7 mt -138.59 151.4 24.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.184 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.41 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 17.9 t80 -138.23 107.59 6.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.005 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.569 ' CE1' HD11 ' A' ' 61' ' ' ILE . 2.2 t-160 -94.57 131.64 40.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.248 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.448 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 1.5 p -165.59 156.9 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.444 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 7.7 ttm 44.0 -138.99 0.31 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.45 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -103.68 38.99 1.69 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.695 0.283 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.448 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 37.2 p90 -158.26 170.82 21.4 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.987 0.422 . . . . 0.0 111.009 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.569 HD11 ' CE1' ' A' ' 56' ' ' HIS . 58.0 mt -138.06 133.21 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.656 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 m -101.04 111.41 23.61 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.155 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.3 t -103.53 117.38 48.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.06 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 64' ' ' ASP . 0.2 OUTLIER -106.19 141.88 36.8 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.46 -179.632 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -121.78 -171.57 2.26 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.957 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -97.19 131.73 43.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -50.57 -26.68 5.57 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.84 0.353 . . . . 0.0 110.608 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -71.46 -33.22 69.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.66 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.87 -172.93 4.22 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.835 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -134.17 -175.36 3.83 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.277 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -99.06 -46.81 5.46 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.185 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.597 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 2.1 mp0 -53.26 -21.89 6.1 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.233 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.479 HG23 ' N ' ' A' ' 74' ' ' VAL . 6.2 t -86.29 -43.78 12.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.163 0.506 . . . . 0.0 110.222 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.479 ' N ' HG23 ' A' ' 73' ' ' THR . 1.0 OUTLIER -78.68 -37.77 21.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.838 -178.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.533 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.8 mp -47.65 -57.47 9.83 Favored Pre-proline 0 N--CA 1.467 0.396 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.0 Cg_exo -44.32 -32.25 5.08 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 122.497 2.131 . . . . 0.0 112.217 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -81.84 -41.21 21.37 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.249 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 85.9 t -60.67 -45.1 98.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.842 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -53.76 -40.98 66.67 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.575 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.27 -32.89 62.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.367 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.64 HG13 ' CB ' ' A' ' 41' ' ' PHE . 16.7 t -56.74 -66.63 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.887 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -83.26 27.23 0.59 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.754 0.311 . . . . 0.0 110.999 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.073 179.649 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.756 0.312 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 mt -80.81 122.96 36.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.159 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.5 mm -107.24 -19.11 6.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.609 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.4 t . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.98 0.419 . . . . 0.0 111.183 -179.808 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.5 m120 . . . . . 0 N--CA 1.467 0.395 0 N-CA-C 111.458 0.17 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 14' ' ' THR . 9.9 t -148.05 128.01 13.58 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.76 0.314 . . . . 0.0 110.449 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.441 ' HG3' ' CZ2' ' A' ' 71' ' ' TRP . 52.2 mtm -107.91 143.73 36.13 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.674 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 131.66 44.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.836 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.6 mt -95.92 115.36 34.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.641 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.1 m -84.48 127.78 34.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.388 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' A' ' 21' ' ' GLU . 36.7 mt -99.57 -173.48 2.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.273 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 96.8 p -63.35 -1.79 1.24 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.706 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.405 ' H ' ' C ' ' A' ' 19' ' ' LEU . 62.7 mt-10 . . . . . 0 N--CA 1.464 0.23 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.72 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 6.2 mmt . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.665 0.269 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 75.3 p -76.73 -124.18 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.291 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 81.1 p -156.19 143.11 18.87 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.248 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -154.01 164.7 38.02 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.816 0.341 . . . . 0.0 110.822 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 57.5 m -144.84 115.19 7.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.886 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -104.28 132.39 50.58 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.341 0.591 . . . . 0.0 111.45 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.419 ' O ' ' CB ' ' A' ' 33' ' ' LYS . 11.9 p -120.6 57.42 0.96 Allowed 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER 89.52 106.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.792 -177.818 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.444 ' C ' ' O ' ' A' ' 33' ' ' LYS . 0.3 OUTLIER 15.57 108.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 114.47 -1.241 . . . . 0.0 113.378 -178.592 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.665 ' H ' ' NE2' ' A' ' 38' ' ' GLN . 8.7 p30 -158.4 -175.02 5.09 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.126 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 50.69 -100.2 0.08 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.436 0.16 . . . . 0.0 110.994 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.3 t -174.43 61.02 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.097 0.475 . . . . 0.0 110.867 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.665 ' NE2' ' H ' ' A' ' 35' ' ' ASP . 1.8 pm0 -82.53 153.68 68.25 Favored Pre-proline 0 N--CA 1.463 0.203 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -55.0 137.6 76.64 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 121.716 1.611 . . . . 0.0 110.902 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.23 -38.98 9.14 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.424 0.63 . . . . 0.0 109.41 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.538 ' CB ' HG13 ' A' ' 81' ' ' VAL . 3.6 m-85 -55.2 -34.82 64.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.429 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.92 HD13 HD12 ' A' ' 45' ' ' ILE . 2.4 mm -76.55 -22.7 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.3 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.433 HD22 ' N ' ' A' ' 43' ' ' ASN . 2.4 m120 -62.15 -36.34 81.54 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.617 ' O ' HG23 ' A' ' 48' ' ' VAL . 6.2 m-20 -55.93 -53.6 54.84 Favored 'General case' 0 CA--C 1.523 -0.095 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.593 178.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.92 HD12 HD13 ' A' ' 42' ' ' ILE . 53.0 mt -47.71 -52.46 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.485 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -65.32 -37.42 87.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.901 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.8 mttm -82.22 -10.9 58.98 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.741 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 44' ' ' ASP . 4.4 t -77.06 121.09 28.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.255 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -52.62 145.48 11.8 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.795 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.92 -29.95 10.24 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 86.7 t -78.29 150.66 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 120.813 0.339 . . . . 0.0 110.724 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.444 ' HZ3' ' HB2' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -109.07 -58.8 1.98 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.317 -179.454 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 91.6 p -166.38 -176.94 3.83 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.521 -178.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.604 HD11 HG21 ' A' ' 45' ' ' ILE . 63.9 mt -137.74 152.21 26.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.985 0.421 . . . . 0.0 111.212 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -139.09 109.71 6.63 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.283 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -97.81 136.63 37.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.366 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.615 HG22 ' N ' ' A' ' 58' ' ' MET . 11.6 p -166.55 169.51 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.049 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.615 ' N ' HG22 ' A' ' 57' ' ' VAL . 3.1 ttm 41.03 -107.53 0.08 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.937 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -139.69 44.77 1.94 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.149 0.5 . . . . 0.0 109.949 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -161.96 168.76 22.31 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.604 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 75.2 mt -129.31 126.15 63.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.422 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.0 t -97.08 116.22 28.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.288 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 39.7 t -105.81 118.54 53.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.348 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -105.26 142.04 35.72 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.99 0.424 . . . . 0.0 110.54 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.481 ' HZ2' ' C ' ' A' ' 70' ' ' ASN . 45.1 pttt -128.92 -171.1 2.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.666 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -98.39 137.86 36.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.507 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.485 ' N ' ' OD1' ' A' ' 67' ' ' ASN . 6.1 p-10 -54.18 -27.9 36.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.676 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.64 -33.02 74.92 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.98 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.95 177.51 6.94 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.899 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.481 ' C ' ' HZ2' ' A' ' 65' ' ' LYS . 29.5 m120 -131.68 163.19 28.69 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.75 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.441 ' CZ2' ' HG3' ' A' ' 15' ' ' MET . 54.7 m95 -77.88 -55.28 5.44 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.275 -179.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -46.87 -21.07 0.17 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.768 0.318 . . . . 0.0 111.06 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.3 m -88.23 -45.74 9.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.283 0.563 . . . . 0.0 110.467 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -84.22 -38.36 13.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.062 -178.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.577 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 0.9 OUTLIER -47.59 -55.1 18.11 Favored Pre-proline 0 N--CA 1.464 0.239 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 -178.851 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.577 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.4 Cg_exo -41.99 -33.06 2.03 Favored 'Trans proline' 0 N--CA 1.49 1.319 0 C-N-CA 122.545 2.163 . . . . 0.0 112.246 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.517 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 0.1 OUTLIER -82.72 -51.46 7.68 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.329 179.397 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 45.1 t -43.87 -53.9 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.593 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -54.25 -40.83 68.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.638 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -49.18 -32.48 10.37 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.327 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.538 HG13 ' CB ' ' A' ' 41' ' ' PHE . 17.0 t -61.38 -59.64 3.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.56 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -85.7 44.55 1.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.016 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.533 179.638 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.4 mtmm . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.723 0.296 . . . . 0.0 110.337 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.486 ' C ' HD12 ' A' ' 4' ' ' ILE . 55.3 mt -81.94 127.09 39.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.337 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.502 ' N ' HD12 ' A' ' 4' ' ' ILE . 1.8 mp -109.19 -55.93 4.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.473 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.8 p . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.664 -179.898 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.5 m120 . . . . . 0 N--CA 1.465 0.3 0 CA-C-O 120.281 0.086 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.513 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 8.8 t -145.72 129.24 16.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 0.0 111.164 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.9 mtm -109.77 158.71 17.85 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.369 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -97.6 124.23 41.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.376 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 54.5 mt -98.1 122.31 49.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.751 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 96.7 m -86.39 132.11 34.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.441 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.8 mt -102.02 174.13 6.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.334 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 88.8 p -65.18 -5.24 6.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.098 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 . . . . . 0 N--CA 1.465 0.313 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.566 -179.775 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.866 0.365 . . . . 0.0 110.172 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.0 t 38.79 -151.87 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.629 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.2 p -157.01 141.85 16.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.444 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -156.77 136.06 12.08 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.762 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.1 m -99.36 128.92 45.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.032 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.541 ' CZ ' ' HB3' ' A' ' 38' ' ' GLN . 54.0 m-85 -113.49 118.55 34.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.726 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.3 p -125.22 -12.01 6.91 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.356 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.485 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 19.7 pttm -155.38 31.87 0.38 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.612 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.608 HG12 ' N ' ' A' ' 35' ' ' ASP . 59.6 t 73.71 166.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.468 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.608 ' N ' HG12 ' A' ' 34' ' ' VAL . 33.3 t70 -155.6 -110.32 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.425 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -167.94 -39.45 0.02 OUTLIER 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.733 0.301 . . . . 0.0 110.435 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.0 t -57.92 -31.49 66.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.282 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 31' ' ' TYR . 2.5 pt20 -80.16 153.79 74.6 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.472 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -59.25 138.85 87.21 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.057 1.838 . . . . 0.0 111.386 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.61 -39.96 12.12 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.109 0.48 . . . . 0.0 109.885 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.696 ' CB ' HG13 ' A' ' 81' ' ' VAL . 15.6 m-85 -54.28 -47.52 72.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.772 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.992 HD13 HD12 ' A' ' 45' ' ' ILE . 1.6 mm -55.91 -27.65 22.99 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.386 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.21 -43.92 97.75 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.413 ' OD2' HG22 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -55.75 -37.62 68.73 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.157 179.28 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.992 HD12 HD13 ' A' ' 42' ' ' ILE . 22.1 mt -62.5 -48.81 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.158 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.618 ' O ' HG21 ' A' ' 51' ' ' VAL . 51.1 mt -55.49 -32.9 63.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.838 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -78.81 -4.51 49.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.28 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.937 ' O ' HG22 ' A' ' 51' ' ' VAL . 58.0 t -77.91 103.57 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -46.92 110.87 0.33 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.661 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 125.26 6.25 6.34 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.937 HG22 ' O ' ' A' ' 48' ' ' VAL . 0.0 OUTLIER -78.8 -21.65 12.9 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.204 0 CA-C-O 118.759 -0.639 . . . . 0.0 112.51 -179.51 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.9 ttmm 51.83 -64.19 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.231 0.469 . . . . 0.0 111.074 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.757 ' N ' ' O ' ' A' ' 51' ' ' VAL . 1.3 p -172.62 165.76 5.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.163 0.506 . . . . 0.0 111.654 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 83.4 mt -140.78 149.64 21.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.24 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -136.8 115.83 12.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.771 0.32 . . . . 0.0 111.006 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -100.2 132.94 45.28 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.977 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.49 HG13 ' CZ ' ' A' ' 60' ' ' PHE . 6.2 p -164.37 153.27 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.825 0.345 . . . . 0.0 110.902 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 13.0 ttt 46.04 -106.83 0.13 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.185 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -133.15 16.5 4.14 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.647 0.261 . . . . 0.0 110.931 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.49 ' CZ ' HG13 ' A' ' 57' ' ' VAL . 50.7 p90 -131.1 164.3 25.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.116 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.8 mt -133.9 130.08 55.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.146 -179.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.09 109.56 21.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.7 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.403 ' O ' ' HA ' ' A' ' 14' ' ' THR . 59.6 t -101.17 119.74 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.682 ' O ' ' O ' ' A' ' 51' ' ' VAL . 0.9 OUTLIER -97.86 154.33 17.71 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.251 179.799 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.587 ' HD2' ' HB3' ' A' ' 69' ' ' ALA . 12.0 pttt -132.42 165.35 24.49 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.237 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.705 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 51.5 mm-40 -52.4 168.84 0.09 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.204 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -34.97 -42.92 0.17 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.066 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -133.55 -54.2 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.139 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.705 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . . . 48.84 -159.21 0.05 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.0 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -145.26 114.51 7.06 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.744 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -71.6 -38.4 70.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.169 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.11 -26.18 48.81 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.951 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.6 m -89.39 -45.84 9.17 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.108 0.48 . . . . 0.0 110.54 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.2 t -66.97 -39.43 83.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.715 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.446 ' CB ' ' CD ' ' A' ' 76' ' ' PRO . 1.4 mm? -49.26 -62.1 2.76 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.83 -0.168 . . . . 0.0 111.385 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' A' ' 75' ' ' LEU . 2.9 Cg_endo -50.29 -31.75 30.68 Favored 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.495 2.13 . . . . 0.0 112.556 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -78.32 -47.12 18.43 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.329 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.72 -39.38 70.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.475 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -55.78 -43.45 76.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.368 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.58 -34.02 48.75 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.378 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.858 HG21 HD11 ' A' ' 45' ' ' ILE . 12.9 t -60.4 -61.68 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.756 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -84.39 10.81 9.74 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.918 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 . . . . . 0 C--N 1.331 -0.219 0 CA-C-O 121.138 0.494 . . . . 0.0 110.179 179.815 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 32.1 pttt . . . . . 0 N--CA 1.461 0.082 0 CA-C-O 120.928 0.394 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.644 ' C ' HD12 ' A' ' 4' ' ' ILE . 96.7 mt -84.62 122.63 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.759 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.721 ' N ' HD12 ' A' ' 4' ' ' ILE . 1.8 mp -109.68 -31.73 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-O 121.203 0.525 . . . . 0.0 109.752 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--N 1.326 -0.417 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.159 -179.591 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.8 m120 . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.8 t -136.73 126.66 25.86 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.87 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.417 ' HG2' ' CH2' ' A' ' 71' ' ' TRP . 13.1 ptp -107.78 154.79 21.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.12 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.4 tttt -102.03 128.12 48.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.464 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.7 mt -99.14 114.12 36.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.91 0.386 . . . . 0.0 111.086 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 84.4 m -88.5 128.04 35.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.497 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.579 HD11 HD11 ' A' ' 61' ' ' ILE . 69.1 mt -102.06 161.48 13.65 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.531 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.42 -1.49 6.6 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.47 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 . . . . . 0 N--CA 1.457 -0.107 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.255 -179.27 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 11.8 mtt . . . . . 0 C--O 1.233 0.189 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.643 HG22 ' H ' ' A' ' 28' ' ' SER . 1.8 m -162.98 -143.67 0.08 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.885 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.643 ' H ' HG22 ' A' ' 27' ' ' THR . 11.7 p -156.08 130.3 8.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.245 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -162.28 138.54 7.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.283 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 52.0 m -98.76 148.12 24.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.27 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.401 ' CD1' ' OE1' ' A' ' 38' ' ' GLN . 22.7 m-85 -135.58 120.07 18.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.479 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.3 p -125.06 -7.49 7.16 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.531 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 34' ' ' VAL . 33.4 pttt -158.45 58.38 0.45 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.234 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.423 ' C ' ' O ' ' A' ' 33' ' ' LYS . 19.2 t 26.56 101.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 O-C-N 123.649 0.593 . . . . 0.0 112.521 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -159.49 -156.74 0.53 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.285 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 56.55 -100.24 0.11 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.841 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.5 t -168.2 63.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.401 ' OE1' ' CD1' ' A' ' 31' ' ' TYR . 9.6 mt-30 -92.9 144.9 29.21 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.16 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.462 ' O ' ' N ' ' A' ' 42' ' ' ILE . 3.1 Cg_exo -55.59 134.22 62.66 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 121.596 1.531 . . . . 0.0 110.201 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.408 ' C ' ' O ' ' A' ' 39' ' ' PRO . . . -41.29 -41.44 1.9 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.401 0.619 . . . . 0.0 109.852 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.665 ' CB ' HG13 ' A' ' 81' ' ' VAL . 7.7 m-85 -52.69 -37.98 59.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.202 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.933 HD13 HD12 ' A' ' 45' ' ' ILE . 2.0 mm -70.01 -26.3 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.816 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.556 HD22 ' N ' ' A' ' 43' ' ' ASN . 1.0 OUTLIER -61.17 -38.47 86.6 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.673 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 48' ' ' VAL . 33.6 t70 -55.53 -53.79 52.07 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.829 179.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.933 HD12 HD13 ' A' ' 42' ' ' ILE . 84.4 mt -45.76 -53.76 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.241 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.5 mt -67.18 -36.88 82.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.871 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -81.18 -8.46 59.76 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.078 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.56 ' N ' ' O ' ' A' ' 44' ' ' ASP . 3.9 t -79.52 115.05 21.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -51.19 113.23 0.88 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.637 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 139.68 -39.94 1.47 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.5 t -78.62 147.75 6.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -108.95 -35.58 6.31 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.375 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.469 ' OG ' ' N ' ' A' ' 54' ' ' ILE . 3.1 t -172.96 176.54 3.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.123 0.487 . . . . 0.0 111.189 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.469 ' N ' ' OG ' ' A' ' 53' ' ' SER . 83.2 mt -137.11 154.5 31.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.655 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -138.3 109.14 6.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.262 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -95.48 129.39 42.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.988 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.422 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 5.0 p -163.33 162.91 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.214 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.422 ' N ' HG22 ' A' ' 57' ' ' VAL . 3.1 ttt 37.29 -137.02 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.023 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -102.87 39.87 1.47 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.737 0.303 . . . . 0.0 110.663 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.422 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 38.6 p90 -161.88 169.58 21.0 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.965 0.412 . . . . 0.0 111.373 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.579 HD11 HD11 ' A' ' 19' ' ' LEU . 4.0 mp -138.19 135.4 44.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.431 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.07 154.83 17.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.167 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.2 t -142.74 112.49 2.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.581 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.7 p-10 -99.04 143.46 29.3 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.011 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.485 ' NZ ' ' NE1' ' A' ' 71' ' ' TRP . 16.6 pttm -124.41 -176.23 3.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.524 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -90.59 129.83 36.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.082 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.34 -34.69 7.15 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -34.42 76.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.562 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.32 166.08 14.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.691 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -108.11 177.48 4.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.584 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.485 ' NE1' ' NZ ' ' A' ' 65' ' ' LYS . 12.2 m95 -98.05 -44.78 6.5 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.591 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.415 ' O ' ' CD ' ' A' ' 76' ' ' PRO . 2.7 pp20? -56.05 -21.27 20.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.673 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.522 HG23 ' N ' ' A' ' 74' ' ' VAL . 15.4 t -86.22 -44.65 11.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.313 0.577 . . . . 0.0 109.71 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.522 ' N ' HG23 ' A' ' 73' ' ' THR . 0.9 OUTLIER -75.39 -37.51 38.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.961 -179.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.455 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 2.5 mt -48.56 -61.34 3.31 Favored Pre-proline 0 N--CA 1.466 0.365 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.3 Cg_exo -42.51 -31.65 1.99 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 C-N-CA 122.415 2.076 . . . . 0.0 112.126 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.496 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 0.8 OUTLIER -80.44 -41.97 23.52 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.07 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 81' ' ' VAL . 38.4 t -52.36 -56.15 7.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.216 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -53.09 -33.95 54.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.022 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -54.4 -32.85 58.07 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.219 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.665 HG13 ' CB ' ' A' ' 41' ' ' PHE . 22.0 t -56.95 -64.37 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.018 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.452 ' CD1' ' N ' ' A' ' 82' ' ' PHE . 0.7 OUTLIER -85.22 29.88 0.63 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.101 -179.541 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 . . . . . 0 C--N 1.332 -0.178 0 CA-C-O 120.756 0.312 . . . . 0.0 110.821 179.752 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.902 0.382 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 66.8 mt -81.7 126.34 39.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.799 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.3 mm -110.06 -17.71 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.205 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.463 0.197 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.796 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.4 m120 . . . . . 0 N--CA 1.461 0.117 0 CA-C-O 120.62 0.248 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.44 ' O ' HG23 ' A' ' 14' ' ' THR . 8.6 t -149.25 126.48 11.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.425 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.652 ' SD ' ' CE2' ' A' ' 71' ' ' TRP . 6.7 mtp -108.21 132.21 53.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.39 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.7 ttmm -94.27 121.65 36.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.57 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 58.2 mt -93.6 126.3 46.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.844 0.354 . . . . 0.0 110.684 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.3 m -88.13 137.03 32.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.656 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.3 mt -114.98 155.02 27.71 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.398 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.7 p -68.64 2.99 2.07 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.916 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.529 0.151 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.292 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 8.0 mmm . . . . . 0 C--O 1.234 0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.344 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.0 m -73.59 -131.53 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.243 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.3 p -156.98 133.77 10.17 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.615 0.245 . . . . 0.0 110.419 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -156.43 130.12 8.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.499 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.69 150.5 21.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.403 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -130.76 117.53 19.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.975 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.7 p -118.69 -10.22 10.05 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.187 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.11 48.89 0.33 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.816 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.617 HG12 ' N ' ' A' ' 35' ' ' ASP . 53.8 t 53.68 167.69 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.488 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.617 ' N ' HG12 ' A' ' 34' ' ' VAL . 13.2 m-20 -160.07 -101.93 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.496 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.42 ' C ' ' N ' ' A' ' 38' ' ' GLN . 24.2 t0 -172.48 -50.23 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.455 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.8 m -49.49 -15.35 0.15 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.852 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.436 ' CG ' HD21 ' A' ' 43' ' ' ASN . 1.4 pt20 -93.48 147.52 33.82 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.14 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -55.77 137.59 78.93 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 C-N-CA 121.805 1.67 . . . . 0.0 110.584 179.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.97 -39.09 8.44 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.321 0.582 . . . . 0.0 109.463 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.599 ' CB ' HG13 ' A' ' 81' ' ' VAL . 5.8 m-85 -55.75 -31.03 62.2 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.264 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.982 HD13 HD12 ' A' ' 45' ' ' ILE . 1.7 mm -77.02 -24.53 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 N-CA-C 110.156 -0.312 . . . . 0.0 110.156 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.436 HD21 ' CG ' ' A' ' 38' ' ' GLN . 9.2 m120 -62.53 -39.65 94.26 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.585 ' O ' ' N ' ' A' ' 48' ' ' VAL . 25.4 t70 -57.7 -52.14 66.66 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.789 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.982 HD12 HD13 ' A' ' 42' ' ' ILE . 56.4 mt -45.41 -52.95 2.06 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.472 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 26.5 mt -61.62 -38.07 86.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.053 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.6 mtpt -84.61 -6.88 59.39 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.172 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.585 ' N ' ' O ' ' A' ' 44' ' ' ASP . 3.7 t -79.86 119.4 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.038 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -52.99 126.24 19.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.82 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 127.22 -39.34 1.96 Allowed Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.5 t -79.75 147.96 6.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.76 0.314 . . . . 0.0 110.735 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -108.97 -34.55 6.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.709 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.1 t -174.09 179.12 1.97 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.067 0.461 . . . . 0.0 110.968 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.0 mt -145.9 138.98 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.075 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -126.6 112.79 15.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.086 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.2 t-160 -93.53 131.24 38.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.418 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.505 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 2.0 p -164.02 156.58 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.837 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.6 ttt 41.27 -141.43 0.08 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.494 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -100.31 27.67 5.53 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 121.173 -0.211 . . . . 0.0 111.069 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.505 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 14.1 p90 -144.62 169.69 17.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.995 0.426 . . . . 0.0 111.056 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.2 mt -136.45 136.86 48.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.307 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.11 110.14 22.12 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.481 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.6 t -98.7 112.5 30.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.683 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 -104.29 134.01 48.23 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.469 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.3 pttt -122.09 -172.91 2.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.404 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -96.32 127.13 42.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.462 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -45.86 -24.75 0.43 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.969 0.414 . . . . 0.0 110.461 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -68.61 -35.22 77.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.004 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.09 163.05 17.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.755 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -111.59 174.03 6.06 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.487 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.652 ' CE2' ' SD ' ' A' ' 15' ' ' MET . 41.0 m95 -92.52 -48.07 6.81 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.019 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -50.59 -22.31 1.95 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.782 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.473 ' CG2' ' N ' ' A' ' 74' ' ' VAL . 4.7 t -88.88 -44.26 10.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.284 0.564 . . . . 0.0 110.166 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.473 ' N ' ' CG2' ' A' ' 73' ' ' THR . 0.9 OUTLIER -77.47 -37.65 25.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.321 -179.16 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.0 OUTLIER -48.42 -60.25 4.77 Favored Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.479 -179.109 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.7 Cg_exo -42.91 -31.31 2.16 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.507 2.138 . . . . 0.0 111.893 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 25.5 mttm -81.4 -41.1 22.42 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.08 -53.76 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.035 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -51.39 -40.97 60.32 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.635 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -52.41 -33.09 42.14 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.97 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.599 HG13 ' CB ' ' A' ' 41' ' ' PHE . 31.1 t -58.85 -63.12 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.753 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -83.65 23.36 0.97 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.887 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 . . . . . 0 C--O 1.233 0.211 0 CA-C-O 121.053 0.454 . . . . 0.0 110.16 179.72 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 36.7 pttt . . . . . 0 CA--C 1.529 0.155 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.593 ' C ' HD12 ' A' ' 4' ' ' ILE . 82.0 mt -80.21 131.7 33.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.766 0.317 . . . . 0.0 110.842 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.593 HD12 ' C ' ' A' ' 3' ' ' ILE . 1.7 mp -108.56 -47.61 7.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.007 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.5 p . . . . . 0 CA--C 1.53 0.175 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.896 -179.89 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.4 m120 . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 120.642 0.258 . . . . 0.0 111.492 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.2 t -147.84 157.13 43.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.886 0.374 . . . . 0.0 110.971 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.75 161.3 35.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.44 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.42 ' HG2' ' H ' ' A' ' 17' ' ' ILE . 6.7 ttmm -92.03 162.44 14.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.805 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.42 ' H ' ' HG2' ' A' ' 16' ' ' LYS . 71.3 mt -138.68 113.96 8.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.14 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.8 m -84.9 119.2 25.08 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.255 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.548 ' C ' ' H ' ' A' ' 21' ' ' GLU . 64.4 mt -104.5 166.96 10.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.379 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.8 m -69.6 34.3 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.321 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.548 ' H ' ' C ' ' A' ' 19' ' ' LEU . 10.0 mm-40 . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.299 -179.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 14.8 mtt . . . . . 0 N--CA 1.463 0.205 0 CA-C-O 120.786 0.327 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.493 HG23 ' N ' ' A' ' 28' ' ' SER . 9.8 t -75.91 -135.88 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.214 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.493 ' N ' HG23 ' A' ' 27' ' ' THR . 18.2 p -155.73 135.25 12.47 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.673 0.273 . . . . 0.0 110.553 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -158.7 142.13 14.99 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.24 148.56 26.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.324 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -129.73 111.99 13.19 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.201 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.2 p -123.62 -0.83 8.57 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.088 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 35.6 mtmt -151.77 25.44 0.66 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.738 0.304 . . . . 0.0 110.84 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.643 HG12 ' N ' ' A' ' 35' ' ' ASP . 60.0 t 54.85 170.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.052 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.643 ' N ' HG12 ' A' ' 34' ' ' VAL . 12.6 t0 70.54 99.1 0.06 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.546 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -172.73 21.08 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.091 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.1 p 76.93 13.49 2.16 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.169 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.46 174.2 6.5 Favored Pre-proline 0 N--CA 1.465 0.279 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -71.68 129.04 15.02 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.32 2.013 . . . . 0.0 111.192 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.68 -36.88 7.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.958 0.409 . . . . 0.0 110.342 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.622 ' HB3' HG13 ' A' ' 81' ' ' VAL . 31.6 m-85 -54.49 -32.94 58.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.841 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.95 HD13 HD12 ' A' ' 45' ' ' ILE . 4.0 mm -76.52 -20.81 14.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.285 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.525 HD22 ' N ' ' A' ' 43' ' ' ASN . 1.8 m120 -62.65 -40.18 96.2 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.602 ' O ' HG23 ' A' ' 48' ' ' VAL . 21.5 m-20 -57.11 -52.5 65.06 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.726 178.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.95 HD12 HD13 ' A' ' 42' ' ' ILE . 73.8 mt -49.04 -49.76 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.599 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.9 mt -63.34 -36.8 84.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.687 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -83.16 -10.9 58.38 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.22 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 44' ' ' ASP . 19.7 t -76.3 124.9 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.911 0.386 . . . . 0.0 110.165 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.486 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 1.8 pm0 -51.14 138.54 19.95 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.142 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 106.35 -35.59 4.95 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.762 -0.935 . . . . 0.0 110.762 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 31.3 t -78.71 138.61 19.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.867 0.365 . . . . 0.0 110.63 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -103.04 -55.13 2.48 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.129 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 64.7 m -161.19 -179.49 7.5 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.465 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.401 HG22 ' N ' ' A' ' 55' ' ' PHE . 93.7 mt -138.02 153.02 26.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.12 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.407 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 20.2 t80 -139.1 110.58 7.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.462 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -98.42 133.09 43.29 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.437 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.43 HG22 ' N ' ' A' ' 58' ' ' MET . 9.3 p -164.5 158.74 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.715 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.43 ' N ' HG22 ' A' ' 57' ' ' VAL . 0.2 OUTLIER 46.22 -137.98 0.61 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.383 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -105.06 44.04 1.06 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.001 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -165.75 172.27 11.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.777 0.322 . . . . 0.0 110.653 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 68.7 mt -135.13 143.55 36.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.385 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.3 t -114.46 114.32 25.65 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.713 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.2 t -99.53 111.93 30.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.886 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.28 146.85 27.43 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.955 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.516 ' HZ1' ' C ' ' A' ' 70' ' ' ASN . 11.5 ptpt -124.52 -164.01 1.22 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.138 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -66.11 -153.6 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.684 0.278 . . . . 0.0 110.506 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.441 ' ND2' ' H ' ' A' ' 67' ' ' ASN . 0.3 OUTLIER -55.04 -48.2 73.74 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.746 0.308 . . . . 0.0 110.367 179.752 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -154.06 -42.98 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.453 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 46.79 -137.45 0.72 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.738 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.516 ' C ' ' HZ1' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -141.88 135.42 29.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.036 179.724 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -91.53 -45.17 8.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.942 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -54.63 -21.93 12.02 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.85 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.465 HG23 ' N ' ' A' ' 74' ' ' VAL . 6.0 t -86.02 -44.11 12.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.115 0.483 . . . . 0.0 110.16 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.465 ' N ' HG23 ' A' ' 73' ' ' THR . 1.1 t -74.26 -38.75 48.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.485 -179.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.502 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.1 mp -48.58 -58.97 6.94 Favored Pre-proline 0 N--CA 1.465 0.299 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 2.9 Cg_endo -46.39 -32.45 11.0 Favored 'Trans proline' 0 N--CA 1.491 1.334 0 C-N-CA 122.471 2.114 . . . . 0.0 111.931 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.68 -42.07 22.65 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.962 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 74.3 t -58.62 -43.84 88.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.095 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -53.7 -44.86 70.13 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.031 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.38 -32.71 40.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.396 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.622 HG13 ' HB3' ' A' ' 41' ' ' PHE . 15.2 t -57.84 -62.75 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.469 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -87.9 -33.84 18.36 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 120.828 0.347 . . . . 0.0 111.351 -179.25 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.9 pttt . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.798 0.332 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 39.6 mt 57.43 101.83 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.605 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.6 mm -102.72 -17.72 6.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.798 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.0 t . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.481 -179.926 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.0 m120 . . . . . 0 N--CA 1.461 0.081 0 CA-C-O 120.822 0.344 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.503 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 4.3 t -150.63 131.91 14.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.579 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 63.0 mtm -100.04 156.87 16.93 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.401 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.81 120.7 37.63 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.29 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.8 mt -97.56 110.32 25.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.485 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.2 m -85.2 139.91 31.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.473 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.7 mt -113.69 151.28 32.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.496 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.9 t -67.27 -2.25 5.7 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.194 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.279 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.636 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 10.8 tpp . . . . . 0 C--O 1.233 0.206 0 CA-C-O 120.819 0.342 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.2 p 48.9 -162.86 0.03 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.693 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.2 p -156.76 135.23 11.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.332 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -157.38 143.86 17.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 27.6 m -102.05 121.55 42.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.79 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.434 ' HB3' HD11 ' A' ' 46' ' ' LEU . 25.7 m-85 -107.14 114.51 28.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.845 0.355 . . . . 0.0 110.595 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.1 p -132.96 1.72 3.59 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.889 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -157.74 25.84 0.28 Allowed 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.935 -0.306 . . . . 0.0 111.437 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.766 HG12 ' H ' ' A' ' 35' ' ' ASP . 13.9 t 50.2 177.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.264 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.766 ' H ' HG12 ' A' ' 34' ' ' VAL . 9.8 m-20 58.08 94.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -168.14 -43.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.919 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.5 t 164.65 -22.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.68 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.441 ' HG2' HD21 ' A' ' 43' ' ' ASN . 0.9 OUTLIER -49.39 147.8 5.26 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.985 -179.662 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -56.8 141.23 92.6 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.229 1.953 . . . . 0.0 111.33 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -47.82 -42.69 26.82 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.627 ' CB ' HG13 ' A' ' 81' ' ' VAL . 22.7 m-85 -54.13 -37.08 63.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.676 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.994 HD13 HD12 ' A' ' 45' ' ' ILE . 2.0 mm -71.67 -24.96 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.383 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.559 HD22 ' N ' ' A' ' 43' ' ' ASN . 1.5 m120 -60.41 -40.84 92.39 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.507 ' O ' HG23 ' A' ' 48' ' ' VAL . 10.9 t70 -55.48 -44.46 76.52 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.922 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.994 HD12 HD13 ' A' ' 42' ' ' ILE . 19.3 mt -58.08 -62.7 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.192 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.368 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.469 ' HA ' HG11 ' A' ' 51' ' ' VAL . 49.0 mt -43.15 -35.52 1.39 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.799 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -81.74 -13.83 57.28 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 44' ' ' ASP . 40.8 t -77.29 119.46 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.827 0.346 . . . . 0.0 110.616 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -54.49 143.75 23.25 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.827 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 90.31 -0.55 78.27 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.666 ' O ' ' N ' ' A' ' 53' ' ' SER . 4.1 t -80.41 -19.28 12.0 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt 52.34 -68.1 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 123.412 0.685 . . . . 0.0 111.233 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.666 ' N ' ' O ' ' A' ' 51' ' ' VAL . 18.5 p -174.62 174.45 2.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.107 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 86.1 mt -135.55 147.07 28.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.642 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -135.04 108.75 8.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.253 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -93.8 129.39 40.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.281 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 8.4 p -162.92 148.18 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.126 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 7.2 tpp 50.28 -146.3 0.42 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.394 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 40.4 p-10 -95.83 43.33 1.08 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.619 0.247 . . . . 0.0 111.482 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -163.62 173.7 12.65 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.8 0.333 . . . . 0.0 110.84 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 14.3 mt -137.95 132.9 44.11 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.608 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 t -100.58 109.09 21.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.13 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.3 t -99.95 110.18 26.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.538 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.633 ' O ' ' O ' ' A' ' 51' ' ' VAL . 1.4 m-20 -89.43 146.46 24.63 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.291 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.0 pttp -120.15 171.6 8.36 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.313 0.383 . . . . 0.0 110.392 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.434 ' O ' ' C ' ' A' ' 67' ' ' ASN . 0.3 OUTLIER -58.49 -176.64 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.97 -179.583 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.434 ' C ' ' O ' ' A' ' 66' ' ' GLU . 2.6 m120 -32.06 -60.25 0.27 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.058 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -138.25 -52.19 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.899 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 47.92 -150.25 0.14 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.06 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -142.44 125.08 15.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.467 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 39.6 m95 -73.5 -45.53 53.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.209 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -56.35 -21.34 23.97 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.077 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 m -86.29 -45.08 11.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.197 0.523 . . . . 0.0 110.128 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.97 -38.96 44.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.435 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.496 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.5 mt -49.26 -58.05 9.97 Favored Pre-proline 0 N--CA 1.464 0.232 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -46.17 -32.33 10.14 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 122.171 1.914 . . . . 0.0 111.474 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -80.9 -41.31 23.22 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 48.4 t -66.5 -41.77 89.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.537 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -54.02 -42.62 69.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.735 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.98 -32.75 15.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.154 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.821 HG21 HD11 ' A' ' 45' ' ' ILE . 11.3 t -59.67 -63.33 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.443 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -86.71 -29.96 22.03 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 121.004 -0.279 . . . . 0.0 111.514 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.056 0.455 . . . . 0.0 110.676 -179.496 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.985 0.421 . . . . 0.0 110.545 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.7 mt -80.71 110.38 16.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.636 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.5 mm -104.94 -24.34 4.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.448 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.465 0.317 0 CA-C-O 120.872 0.368 . . . . 0.0 111.198 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.548 ' N ' ' HZ1' ' A' ' 65' ' ' LYS . 24.5 t-20 . . . . . 0 N--CA 1.462 0.147 0 CA-C-O 120.499 0.19 . . . . 0.0 110.996 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.4 ' O ' HG23 ' A' ' 14' ' ' THR . 3.8 t -146.73 128.18 14.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.835 0.35 . . . . 0.0 110.613 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 33.3 mtm -109.01 154.12 22.65 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.555 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.5 mtpt -106.75 118.72 37.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.294 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 56.7 mt -96.28 121.99 47.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.709 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.1 m -86.79 124.5 33.11 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.5 mt -96.01 -154.09 0.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.322 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.8 m -63.91 -3.06 2.19 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.636 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 . . . . . 0 C--O 1.233 0.205 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.846 179.973 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.0 tpp . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 120.547 0.213 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 28' ' ' SER . 0.6 OUTLIER 69.55 -161.51 0.17 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -178.867 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.673 ' H ' HG22 ' A' ' 27' ' ' THR . 97.8 p -159.06 144.73 16.33 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.306 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -161.14 156.68 24.72 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.787 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -132.18 128.1 37.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.454 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -107.03 128.83 54.71 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.478 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.8 p -117.76 4.51 12.26 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.683 ' O ' HG23 ' A' ' 34' ' ' VAL . 8.9 ttmm -155.55 -100.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.291 -1.322 . . . . 0.0 109.185 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 33' ' ' LYS . 59.5 t -166.27 97.72 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 114.686 -1.143 . . . . 0.0 109.823 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -161.87 -147.88 0.14 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.304 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 62.66 3.75 1.22 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.968 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 p 65.8 17.65 10.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.342 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.574 HE21 ' ND2' ' A' ' 43' ' ' ASN . 3.2 pt20 -55.52 175.81 0.19 Allowed Pre-proline 0 CA--C 1.528 0.105 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.77 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.427 ' CD ' ' HB2' ' A' ' 38' ' ' GLN . 3.7 Cg_exo -71.11 125.57 11.57 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 121.911 1.741 . . . . 0.0 111.4 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.52 -37.72 5.64 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.155 0.502 . . . . 0.0 109.978 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.507 ' HB3' HG13 ' A' ' 81' ' ' VAL . 17.9 m-85 -53.79 -33.42 55.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.398 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.886 HD13 HD12 ' A' ' 45' ' ' ILE . 4.2 mm -78.58 -19.77 13.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.317 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.574 ' ND2' HE21 ' A' ' 38' ' ' GLN . 2.0 m120 -62.3 -37.69 86.53 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.584 ' O ' ' N ' ' A' ' 48' ' ' VAL . 22.6 t0 -57.78 -50.7 72.37 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.825 178.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.886 HD12 HD13 ' A' ' 42' ' ' ILE . 13.6 mt -48.66 -51.94 10.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.584 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.3 mt -65.14 -38.1 89.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.983 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 37.9 mttm -83.95 -9.82 58.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.722 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.584 ' N ' ' O ' ' A' ' 44' ' ' ASP . 2.6 t -78.21 123.66 35.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 -49.96 133.74 22.2 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.722 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.6 -44.68 1.39 Allowed Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 94.8 t -79.72 138.56 19.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.799 0.333 . . . . 0.0 110.413 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.457 ' NZ ' ' O ' ' A' ' 65' ' ' LYS . 5.6 ttpm? -105.49 -33.08 8.24 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.111 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -176.43 179.53 1.18 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.511 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 76.8 mt -141.06 153.36 20.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.775 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -140.11 107.56 5.56 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.55 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.424 ' CD2' ' N ' ' A' ' 57' ' ' VAL . 10.4 t-160 -96.11 142.22 28.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.906 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.542 HG22 ' N ' ' A' ' 58' ' ' MET . 13.1 p -162.47 164.9 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.828 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.542 ' N ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER 27.96 -90.1 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.894 -179.602 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.525 ' H ' ' CG ' ' A' ' 58' ' ' MET . 8.5 p-10 -144.7 42.85 1.36 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.954 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.479 ' CD1' ' C ' ' A' ' 60' ' ' PHE . 8.5 p90 -163.96 151.0 11.9 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.569 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 77.6 mt -113.99 134.49 56.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.518 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.5 t -106.58 111.62 24.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.556 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 16.0 t -99.17 106.03 18.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -96.13 138.85 33.15 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.883 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.548 ' HZ1' ' N ' ' A' ' 13' ' ' ASN . 2.1 pttm -116.54 -171.59 2.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.212 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.429 ' O ' ' ND2' ' A' ' 13' ' ' ASN . 19.4 mt-10 -61.64 -151.89 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.41 0.444 . . . . 0.0 110.834 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.421 ' OD1' ' N ' ' A' ' 68' ' ' ASP . 5.5 p30 -64.95 -44.5 89.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.315 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.421 ' N ' ' OD1' ' A' ' 67' ' ' ASN . 1.9 t0 -143.4 -53.91 0.37 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.821 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.18 -151.78 0.22 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.486 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -140.56 129.93 23.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.299 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.547 ' HE1' ' HZ2' ' A' ' 65' ' ' LYS . 30.1 m95 -85.15 -44.28 13.09 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.519 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.545 ' CD ' ' H ' ' A' ' 72' ' ' GLU . 16.6 mp0 -55.23 -22.42 17.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.158 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.7 m -90.9 -45.43 8.77 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.102 0.477 . . . . 0.0 110.641 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.25 -38.62 18.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.441 -178.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.534 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 4.4 tt -48.54 -58.08 9.2 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.306 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 2.8 Cg_endo -44.31 -31.24 4.21 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 122.587 2.192 . . . . 0.0 112.072 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.422 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 24.0 mttt -81.22 -49.45 10.77 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.181 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.3 t -50.39 -53.52 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.596 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -55.06 -40.61 70.49 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.824 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -51.87 -33.01 34.61 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.844 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.531 HG21 HD11 ' A' ' 45' ' ' ILE . 17.7 t -58.89 -54.39 34.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -84.98 39.76 0.78 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.42 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.055 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 59.1 pttt . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.681 0.277 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.6 mt -80.45 123.86 37.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.42 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.1 mm -109.59 -44.65 6.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.6 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.529 -179.795 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.476 ' O ' ' N ' ' A' ' 65' ' ' LYS . 1.2 m120 . . . . . 0 N--CA 1.462 0.165 0 CA-C-O 120.305 0.098 . . . . 0.0 110.854 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.416 ' CB ' ' HA ' ' A' ' 64' ' ' ASP . 11.1 t -148.35 135.46 20.23 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.656 0.265 . . . . 0.0 110.347 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.438 ' HG2' ' CZ2' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -114.75 164.61 13.82 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.992 -179.698 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -99.7 127.7 45.82 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.254 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.1 mt -99.03 121.95 50.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.344 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.0 m -87.76 134.03 33.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.593 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 15.8 mt -105.04 165.14 11.29 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.88 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t -70.18 -8.22 48.11 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 . . . . . 0 CA--C 1.531 0.214 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.526 -179.421 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 8.3 mtt . . . . . 0 CA--C 1.529 0.15 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.481 HG22 ' H ' ' A' ' 28' ' ' SER . 1.1 m -163.13 -141.53 0.06 Allowed 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.481 ' H ' HG22 ' A' ' 27' ' ' THR . 96.9 p -158.69 135.92 9.94 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.22 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -156.09 135.39 12.22 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.527 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.3 m -104.02 121.42 43.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.187 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -114.11 114.46 26.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.959 0.409 . . . . 0.0 110.949 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.7 p -124.38 -7.08 7.57 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.481 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.523 ' CG ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -158.41 50.96 0.4 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.955 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.626 HG12 ' N ' ' A' ' 35' ' ' ASP . 47.4 t 52.68 168.96 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.121 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.626 ' N ' HG12 ' A' ' 34' ' ' VAL . 46.2 t0 -162.62 -106.38 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.558 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -169.09 -52.08 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.522 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.9 p -48.39 -21.9 0.61 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.716 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.47 ' OE1' ' N ' ' A' ' 35' ' ' ASP . 2.3 pt20 -86.99 147.06 41.99 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.499 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -54.67 136.32 70.5 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 121.64 1.56 . . . . 0.0 110.716 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -47.31 -37.08 10.24 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.468 ' CB ' HG13 ' A' ' 81' ' ' VAL . 17.6 m-85 -55.16 -34.82 64.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.441 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.879 HD13 HD12 ' A' ' 45' ' ' ILE . 1.9 mm -72.9 -22.02 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.581 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -62.1 -40.46 95.94 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 178.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -55.5 -51.9 65.46 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.173 179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.879 HD12 HD13 ' A' ' 42' ' ' ILE . 9.0 mt -49.34 -60.65 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.684 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 68.1 mt -46.61 -35.14 5.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.224 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -14.39 58.14 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.513 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.13 109.85 12.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 120.845 0.355 . . . . 0.0 110.224 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -52.45 136.2 32.19 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.432 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 103.79 -5.13 46.77 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.632 ' O ' ' N ' ' A' ' 53' ' ' SER . 6.0 t -82.34 -21.23 9.76 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 CA-C-N 115.107 -0.547 . . . . 0.0 111.448 -179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 17.1 ttmt 54.92 -65.25 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.677 0.791 . . . . 0.0 111.163 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.632 ' N ' ' O ' ' A' ' 51' ' ' VAL . 1.1 t -172.97 172.06 4.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.587 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.415 ' N ' ' OG ' ' A' ' 53' ' ' SER . 95.4 mt -140.06 149.36 22.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.872 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -140.75 117.26 10.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.221 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -95.59 139.78 31.36 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.975 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.529 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 12.6 p -165.78 144.0 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.032 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.401 ' HG3' ' N ' ' A' ' 59' ' ' ASP . 16.6 ptp 37.3 -130.32 0.15 Allowed 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.288 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 58' ' ' MET . 4.2 p-10 -99.72 43.98 1.04 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.529 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 1.9 p90 -167.33 160.9 13.87 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.534 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 20.1 mt -128.86 136.03 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.346 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -103.32 107.68 18.6 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 39.4 t -101.87 120.31 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.175 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.617 ' O ' ' O ' ' A' ' 51' ' ' VAL . 0.8 OUTLIER -100.71 120.59 40.31 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.028 -179.501 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 13' ' ' ASN . 8.7 pttp -102.41 165.4 11.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.027 0.442 . . . . 0.0 111.137 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -82.6 130.35 35.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.109 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 -51.91 -33.43 37.0 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.875 0.369 . . . . 0.0 110.689 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -67.85 -35.52 78.71 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.817 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.42 162.53 16.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.517 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -111.19 158.65 18.68 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.824 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.438 ' CZ2' ' HG2' ' A' ' 15' ' ' MET . 32.1 m95 -71.5 -49.13 44.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.266 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -50.74 -20.52 1.28 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.535 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.5 m -88.38 -44.88 10.44 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.113 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -80.88 -38.91 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.927 -178.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.552 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -49.15 -57.76 10.66 Favored Pre-proline 0 N--CA 1.466 0.356 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.13 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -43.0 -36.27 5.29 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.648 2.232 . . . . 0.0 112.296 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -81.42 -40.15 23.84 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.84 0.353 . . . . 0.0 110.384 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.443 ' O ' HG23 ' A' ' 81' ' ' VAL . 68.1 t -59.55 -53.41 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.579 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -52.02 -35.32 46.59 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.448 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -50.5 -32.6 18.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.998 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.874 HG21 HD11 ' A' ' 45' ' ' ILE . 18.9 t -60.55 -58.44 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.331 -179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' A' ' 82' ' ' PHE . 1.1 m-85 -81.52 8.13 10.33 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.255 -179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.529 0.169 0 CA-C-O 120.913 0.387 . . . . 0.0 110.472 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? . . . . . 0 N--CA 1.461 0.101 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 62.3 mt -79.32 108.14 12.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.241 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.8 mm -111.75 -76.96 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-N 115.912 -0.586 . . . . 0.0 109.557 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.471 ' H ' ' HB ' ' A' ' 18' ' ' THR . 5.8 m . . . . . 0 C--O 1.235 0.335 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.127 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 30.4 m120 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.385 0.136 . . . . 0.0 110.968 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.409 ' O ' HG23 ' A' ' 14' ' ' THR . 3.0 t -148.54 127.07 12.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.188 0.518 . . . . 0.0 111.644 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.2 ptp -112.1 167.67 10.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.968 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.4 mttp -99.37 166.59 11.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.434 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.4 mt -145.05 105.12 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.978 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.471 ' HB ' ' H ' ' A' ' 5' ' ' SER . 4.5 m -88.58 147.69 24.46 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.508 ' O ' ' CB ' ' A' ' 20' ' ' SER . 11.0 mt -102.85 -10.53 18.99 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.508 ' CB ' ' O ' ' A' ' 19' ' ' LEU . 4.0 p 91.65 -1.07 0.17 Allowed 'General case' 0 N--CA 1.472 0.629 0 O-C-N 123.447 0.467 . . . . 0.0 110.889 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 . . . . . 0 C--N 1.331 -0.2 0 CA-C-O 120.857 0.361 . . . . 0.0 110.964 -179.487 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.414 ' O ' ' CB ' ' A' ' 27' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.181 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.414 ' CB ' ' O ' ' A' ' 26' ' ' MET . 0.2 OUTLIER 80.82 159.76 0.16 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.218 -179.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 p -153.2 134.58 14.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.454 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -163.65 144.36 8.85 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.687 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.67 117.87 35.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.588 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.471 ' CG ' ' OE1' ' A' ' 38' ' ' GLN . 73.7 m-85 -109.24 111.66 23.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.438 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 81.9 p -118.32 -13.26 9.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.361 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.444 ' O ' ' C ' ' A' ' 34' ' ' VAL . 17.6 pttt -155.87 61.45 0.59 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.179 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.444 ' C ' ' O ' ' A' ' 33' ' ' LYS . 18.7 t 29.62 90.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.296 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -80.3 -102.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.442 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -175.01 90.28 0.05 Allowed 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.2 p 169.17 -40.58 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.584 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.529 HE22 ' CD1' ' A' ' 46' ' ' LEU . 19.3 pt20 -69.33 147.88 97.22 Favored Pre-proline 0 C--N 1.329 -0.305 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -53.77 137.77 67.75 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 121.883 1.722 . . . . 0.0 111.588 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.39 -38.06 5.59 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.379 0.609 . . . . 0.0 109.455 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.625 ' HB3' HG13 ' A' ' 81' ' ' VAL . 24.4 m-85 -55.33 -31.91 62.07 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.682 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.985 HD13 HD12 ' A' ' 45' ' ' ILE . 2.9 mm -77.55 -22.02 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.553 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.401 ' ND2' HG13 ' A' ' 34' ' ' VAL . 9.3 m120 -64.77 -36.09 83.17 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 178.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.54 ' O ' HG23 ' A' ' 48' ' ' VAL . 1.4 m-20 -58.84 -51.78 68.53 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.203 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.985 HD12 HD13 ' A' ' 42' ' ' ILE . 39.5 mt -48.9 -50.81 13.57 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.873 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.529 ' CD1' HE22 ' A' ' 38' ' ' GLN . 12.0 mt -64.43 -36.18 83.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.054 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -82.54 -6.89 59.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.616 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 44' ' ' ASP . 8.7 t -75.39 111.54 11.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -51.62 100.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.726 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 156.53 -44.52 0.52 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 39.9 t -77.66 149.11 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -105.02 -33.35 8.35 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.496 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.456 ' OG ' ' N ' ' A' ' 54' ' ' ILE . 1.4 t -178.71 175.31 1.08 Allowed 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.129 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.456 ' N ' ' OG ' ' A' ' 53' ' ' SER . 46.8 mt -142.48 152.26 17.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.788 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.412 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 19.8 t80 -137.83 108.52 6.62 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.139 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 -95.45 132.54 40.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.199 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.744 HG22 ' H ' ' A' ' 58' ' ' MET . 9.8 p -162.29 175.72 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.327 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.744 ' H ' HG22 ' A' ' 57' ' ' VAL . 14.8 ttt 34.54 -100.34 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.357 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -140.58 11.36 2.29 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.83 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -128.35 172.31 11.2 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.142 0.496 . . . . 0.0 111.23 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.1 mt -135.01 133.79 53.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.884 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.5 t -104.78 110.18 22.42 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.507 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.7 t -100.09 114.35 38.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.437 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -109.1 140.51 42.56 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.071 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -133.12 -172.09 2.85 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.703 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -98.4 -172.52 2.35 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -87.5 -47.21 8.92 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.054 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -48.94 -34.13 12.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.798 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.16 170.07 11.81 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.602 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -134.18 173.66 11.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.554 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.7 m95 -85.46 -54.77 4.37 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.451 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -51.53 -20.79 2.07 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 m -87.39 -45.48 10.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.909 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -76.54 -37.21 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.333 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.463 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.3 mm? -48.18 -61.95 2.66 Favored Pre-proline 0 N--CA 1.466 0.356 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.349 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -42.96 -32.73 2.82 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 C-N-CA 122.853 2.369 . . . . 0.0 112.587 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -83.29 -49.57 9.27 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.568 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.484 ' O ' HG23 ' A' ' 81' ' ' VAL . 17.6 t -57.15 -48.55 81.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.158 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -53.14 -40.73 64.46 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.038 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -51.38 -34.64 35.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.7 HG21 HD11 ' A' ' 45' ' ' ILE . 18.5 t -53.23 -60.19 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.08 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.84 49.65 1.76 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.378 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 . . . . . 0 C--O 1.234 0.258 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.08 179.391 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.2 mtm . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -166.84 62.8 0.09 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.624 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 52.6 mt 55.1 101.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.326 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 mm -105.44 -30.06 2.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.486 -179.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 89.0 p -172.59 139.99 0.99 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.035 0.445 . . . . 0.0 111.608 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.676 HG22 ' H ' ' A' ' 7' ' ' SER . 19.3 mm -94.51 175.89 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.68 178.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.676 ' H ' HG22 ' A' ' 6' ' ' ILE . 3.4 t -140.85 139.19 34.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.918 0.39 . . . . 0.0 110.641 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -76.56 147.93 37.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.307 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 11' ' ' ASN . 0.0 OUTLIER -149.46 151.36 33.28 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.851 -179.591 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -46.99 -41.51 25.99 Favored 'Trans proline' 0 C--N 1.307 -1.635 0 C-N-CA 122.407 2.071 . . . . 0.0 112.05 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.454 ' O ' HG23 ' A' ' 9' ' ' THR . 13.7 t-20 -95.74 178.59 5.4 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.229 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -140.76 20.13 2.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.379 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -88.37 -24.15 23.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.377 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.401 HG23 ' O ' ' A' ' 14' ' ' THR . 12.5 t -150.14 129.64 13.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.967 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -116.55 154.48 30.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.265 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.05 134.61 37.55 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.937 0.399 . . . . 0.0 110.721 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.4 mt -98.34 123.24 50.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.318 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 86.1 m -85.53 131.47 34.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.002 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.4 mt -101.16 162.17 13.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.363 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 62.2 p -67.5 -5.55 15.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.293 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -92.07 165.64 13.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.714 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 92.5 p -150.65 171.51 17.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.474 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 24' ' ' GLU . 27.1 mmt180 44.1 -158.56 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.794 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.401 ' C ' ' O ' ' A' ' 23' ' ' ARG . 50.3 mt-10 32.56 -96.95 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.623 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 134.62 139.02 4.02 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 21.7 mtp -90.49 -123.61 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.4 p -75.47 164.1 26.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.735 0.302 . . . . 0.0 110.537 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.1 p -158.2 101.26 1.73 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.505 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.443 ' H ' ' HB3' ' A' ' 56' ' ' HIS . 3.8 m-20 -162.82 160.24 24.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.752 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 m -102.58 135.23 44.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.286 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -119.16 106.57 12.5 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.168 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.88 -3.05 8.19 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.725 -179.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.0 pttt -154.09 34.76 0.43 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.545 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.765 HG12 ' H ' ' A' ' 35' ' ' ASP . 17.8 t 51.57 177.93 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.555 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.765 ' H ' HG12 ' A' ' 34' ' ' VAL . 12.7 t70 62.52 109.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.846 0.355 . . . . 0.0 110.859 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 175.24 21.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.74 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 p 74.69 18.23 2.79 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.055 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.21 172.07 9.87 Favored Pre-proline 0 C--N 1.332 -0.166 0 N-CA-C 109.929 -0.396 . . . . 0.0 109.929 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -73.11 130.13 14.99 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.519 2.146 . . . . 0.0 111.388 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.85 -37.2 8.39 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.024 0.44 . . . . 0.0 110.28 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.64 ' CB ' HG13 ' A' ' 81' ' ' VAL . 8.0 m-85 -54.21 -33.28 57.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.721 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 1.059 HD13 HD12 ' A' ' 45' ' ' ILE . 3.0 mm -77.47 -23.62 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.163 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.411 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.578 HD22 ' N ' ' A' ' 43' ' ' ASN . 0.9 OUTLIER -60.81 -35.76 77.3 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.715 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.783 ' O ' HG23 ' A' ' 48' ' ' VAL . 3.9 t70 -58.33 -51.66 68.87 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.526 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 1.059 HD12 HD13 ' A' ' 42' ' ' ILE . 61.4 mt -50.31 -50.14 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.805 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -62.92 -37.33 86.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.525 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -83.6 -10.07 58.49 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.06 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.783 HG23 ' O ' ' A' ' 44' ' ' ASP . 27.5 t -76.3 116.86 20.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 49' ' ' GLU . 8.9 mt-10 -51.73 134.39 30.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.681 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 113.49 -30.21 7.4 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 43.0 t -79.47 145.0 10.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.738 0.304 . . . . 0.0 110.202 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -103.11 -52.34 3.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.224 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 p -169.98 178.45 3.95 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.637 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 82.7 mt -138.59 151.4 24.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.184 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.41 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 17.9 t80 -138.23 107.59 6.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.005 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.569 ' CE1' HD11 ' A' ' 61' ' ' ILE . 2.2 t-160 -94.57 131.64 40.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.248 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.448 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 1.5 p -165.59 156.9 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.444 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 7.7 ttm 44.0 -138.99 0.31 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.45 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -103.68 38.99 1.69 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.695 0.283 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.448 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 37.2 p90 -158.26 170.82 21.4 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.987 0.422 . . . . 0.0 111.009 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.569 HD11 ' CE1' ' A' ' 56' ' ' HIS . 58.0 mt -138.06 133.21 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.656 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 m -101.04 111.41 23.61 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.155 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.3 t -103.53 117.38 48.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.06 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 64' ' ' ASP . 0.2 OUTLIER -106.19 141.88 36.8 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.46 -179.632 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -121.78 -171.57 2.26 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.957 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -97.19 131.73 43.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -50.57 -26.68 5.57 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.84 0.353 . . . . 0.0 110.608 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -71.46 -33.22 69.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.66 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.87 -172.93 4.22 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.835 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -134.17 -175.36 3.83 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.277 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -99.06 -46.81 5.46 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.185 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.597 ' CD ' ' H ' ' A' ' 72' ' ' GLU . 2.1 mp0 -53.26 -21.89 6.1 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.233 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.479 HG23 ' N ' ' A' ' 74' ' ' VAL . 6.2 t -86.29 -43.78 12.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.163 0.506 . . . . 0.0 110.222 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.479 ' N ' HG23 ' A' ' 73' ' ' THR . 1.0 OUTLIER -78.68 -37.77 21.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.838 -178.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.533 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.8 mp -47.65 -57.47 9.83 Favored Pre-proline 0 N--CA 1.467 0.396 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.0 Cg_exo -44.32 -32.25 5.08 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 122.497 2.131 . . . . 0.0 112.217 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -81.84 -41.21 21.37 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.249 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 85.9 t -60.67 -45.1 98.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.842 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -53.76 -40.98 66.67 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.575 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.27 -32.89 62.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.367 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.64 HG13 ' CB ' ' A' ' 41' ' ' PHE . 16.7 t -56.74 -66.63 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.887 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -83.26 27.23 0.59 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.754 0.311 . . . . 0.0 110.999 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -160.26 88.11 0.8 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.073 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.454 ' O ' ' CB ' ' A' ' 85' ' ' GLU . 0.4 OUTLIER -164.17 21.63 0.07 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.799 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.454 ' CB ' ' O ' ' A' ' 84' ' ' LEU . 4.2 tp10 83.32 123.71 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.29 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -109.14 115.2 29.58 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.658 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -152.05 -178.83 7.01 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.31 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -121.6 71.24 0.96 Allowed 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.076 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -45.47 120.23 2.45 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.6 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 78.4 t60 -155.99 -36.36 0.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.714 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 117.815 -1.088 . . . . 0.0 110.48 -179.781 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.46 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.489 1.499 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -150.77 158.53 44.26 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.918 -179.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 mt -80.81 122.96 36.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.159 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.5 mm -107.24 -19.11 6.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.609 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.4 t -167.62 126.8 1.32 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.98 0.419 . . . . 0.0 111.183 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.787 HG22 ' H ' ' A' ' 7' ' ' SER . 29.5 mt -98.87 178.6 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.271 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.787 ' H ' HG22 ' A' ' 6' ' ' ILE . 51.6 p -140.16 145.37 37.42 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -161.2 -12.39 0.04 OUTLIER 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.751 0.786 . . . . 0.0 110.131 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.642 ' H ' ' CD ' ' A' ' 10' ' ' PRO . 1.7 m -111.65 -38.8 0.11 Allowed Pre-proline 0 C--N 1.309 -1.156 0 CA-C-N 114.08 -1.418 . . . . 0.0 111.721 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.642 ' CD ' ' H ' ' A' ' 9' ' ' THR . 3.0 Cg_exo -71.6 -13.76 30.09 Favored 'Trans proline' 0 N--CA 1.491 1.364 0 C-N-CA 121.862 1.708 . . . . 0.0 111.941 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -145.19 -152.45 0.42 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.684 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.463 ' C ' ' H ' ' A' ' 14' ' ' THR . 13.9 t-160 -175.97 149.33 0.9 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.444 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 5.5 m120 69.36 -16.93 0.23 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.458 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.463 ' H ' ' C ' ' A' ' 12' ' ' HIS . 9.9 t -148.05 128.01 13.58 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.76 0.314 . . . . 0.0 110.449 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.49 ' SD ' ' O ' ' A' ' 7' ' ' SER . 52.2 mtm -107.91 143.73 36.13 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.674 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 131.66 44.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.836 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.6 mt -95.92 115.36 34.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.641 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.1 m -84.48 127.78 34.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.388 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' A' ' 21' ' ' GLU . 36.7 mt -99.57 -173.48 2.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.273 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 96.8 p -63.35 -1.79 1.24 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.706 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.405 ' H ' ' C ' ' A' ' 19' ' ' LEU . 62.7 mt-10 56.92 83.15 0.1 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.72 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.3 t -91.9 138.29 31.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.342 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 45.2 mtp85 -70.75 121.11 17.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.689 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 38.94 68.37 0.35 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.932 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -143.25 -38.89 0.07 OUTLIER Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 6.2 mmt -94.41 110.08 21.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.665 0.269 . . . . 0.0 110.516 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 75.3 p -76.73 -124.18 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.291 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 81.1 p -156.19 143.11 18.87 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.248 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -154.01 164.7 38.02 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.816 0.341 . . . . 0.0 110.822 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 57.5 m -144.84 115.19 7.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.886 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -104.28 132.39 50.58 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.341 0.591 . . . . 0.0 111.45 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.419 ' O ' ' CB ' ' A' ' 33' ' ' LYS . 11.9 p -120.6 57.42 0.96 Allowed 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER 89.52 106.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.792 -177.818 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.444 ' C ' ' O ' ' A' ' 33' ' ' LYS . 0.3 OUTLIER 15.57 108.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 114.47 -1.241 . . . . 0.0 113.378 -178.592 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.665 ' H ' ' NE2' ' A' ' 38' ' ' GLN . 8.7 p30 -158.4 -175.02 5.09 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.126 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 50.69 -100.2 0.08 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.436 0.16 . . . . 0.0 110.994 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.3 t -174.43 61.02 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.097 0.475 . . . . 0.0 110.867 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.665 ' NE2' ' H ' ' A' ' 35' ' ' ASP . 1.8 pm0 -82.53 153.68 68.25 Favored Pre-proline 0 N--CA 1.463 0.203 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -55.0 137.6 76.64 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 121.716 1.611 . . . . 0.0 110.902 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.23 -38.98 9.14 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.424 0.63 . . . . 0.0 109.41 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.538 ' CB ' HG13 ' A' ' 81' ' ' VAL . 3.6 m-85 -55.2 -34.82 64.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.429 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.92 HD13 HD12 ' A' ' 45' ' ' ILE . 2.4 mm -76.55 -22.7 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.3 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.433 HD22 ' N ' ' A' ' 43' ' ' ASN . 2.4 m120 -62.15 -36.34 81.54 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.617 ' O ' HG23 ' A' ' 48' ' ' VAL . 6.2 m-20 -55.93 -53.6 54.84 Favored 'General case' 0 CA--C 1.523 -0.095 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.593 178.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.92 HD12 HD13 ' A' ' 42' ' ' ILE . 53.0 mt -47.71 -52.46 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.485 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -65.32 -37.42 87.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.901 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.8 mttm -82.22 -10.9 58.98 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.741 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 44' ' ' ASP . 4.4 t -77.06 121.09 28.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.255 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -52.62 145.48 11.8 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.795 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.92 -29.95 10.24 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 86.7 t -78.29 150.66 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 120.813 0.339 . . . . 0.0 110.724 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.444 ' HZ3' ' HB2' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -109.07 -58.8 1.98 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.317 -179.454 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 91.6 p -166.38 -176.94 3.83 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.521 -178.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.604 HD11 HG21 ' A' ' 45' ' ' ILE . 63.9 mt -137.74 152.21 26.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.985 0.421 . . . . 0.0 111.212 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -139.09 109.71 6.63 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.283 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -97.81 136.63 37.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.366 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.615 HG22 ' N ' ' A' ' 58' ' ' MET . 11.6 p -166.55 169.51 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.049 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.615 ' N ' HG22 ' A' ' 57' ' ' VAL . 3.1 ttm 41.03 -107.53 0.08 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.937 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -139.69 44.77 1.94 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.149 0.5 . . . . 0.0 109.949 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -161.96 168.76 22.31 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.604 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 75.2 mt -129.31 126.15 63.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.422 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.0 t -97.08 116.22 28.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.288 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 39.7 t -105.81 118.54 53.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.348 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -105.26 142.04 35.72 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.99 0.424 . . . . 0.0 110.54 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.481 ' HZ2' ' C ' ' A' ' 70' ' ' ASN . 45.1 pttt -128.92 -171.1 2.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.666 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -98.39 137.86 36.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.507 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.485 ' N ' ' OD1' ' A' ' 67' ' ' ASN . 6.1 p-10 -54.18 -27.9 36.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.676 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.64 -33.02 74.92 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.98 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.95 177.51 6.94 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.899 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.481 ' C ' ' HZ2' ' A' ' 65' ' ' LYS . 29.5 m120 -131.68 163.19 28.69 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.75 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.441 ' CZ2' ' HG3' ' A' ' 15' ' ' MET . 54.7 m95 -77.88 -55.28 5.44 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.275 -179.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -46.87 -21.07 0.17 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.768 0.318 . . . . 0.0 111.06 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.3 m -88.23 -45.74 9.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.283 0.563 . . . . 0.0 110.467 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -84.22 -38.36 13.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.062 -178.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.577 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 0.9 OUTLIER -47.59 -55.1 18.11 Favored Pre-proline 0 N--CA 1.464 0.239 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 -178.851 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.577 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.4 Cg_exo -41.99 -33.06 2.03 Favored 'Trans proline' 0 N--CA 1.49 1.319 0 C-N-CA 122.545 2.163 . . . . 0.0 112.246 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.517 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 0.1 OUTLIER -82.72 -51.46 7.68 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.329 179.397 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 45.1 t -43.87 -53.9 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.593 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -54.25 -40.83 68.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.638 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -49.18 -32.48 10.37 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.327 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.538 HG13 ' CB ' ' A' ' 41' ' ' PHE . 17.0 t -61.38 -59.64 3.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.56 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -85.7 44.55 1.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.016 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -160.59 -35.08 0.05 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.533 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.416 HD21 ' CD1' ' A' ' 41' ' ' PHE . 15.1 mt 39.72 56.16 2.39 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.892 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 42.22 -150.93 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.682 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -114.39 126.52 55.08 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 46.9 m-70 -151.55 -168.98 3.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.585 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 62.37 3.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.213 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.466 ' CG ' ' N ' ' A' ' 90' ' ' HIS . 16.1 t60 -60.6 -103.5 0.0 OUTLIER 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.197 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.466 ' N ' ' CG ' ' A' ' 89' ' ' HIS . 2.3 m-70 -130.96 -36.9 1.32 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.343 . . . . 0.0 110.124 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 14.2 t60 . . . . . 0 C--O 1.221 -0.408 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.459 179.782 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.2 mtm . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.4 mtmm -130.28 -169.93 2.23 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.337 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.486 ' C ' HD12 ' A' ' 4' ' ' ILE . 55.3 mt -81.94 127.09 39.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.337 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.502 ' N ' HD12 ' A' ' 4' ' ' ILE . 1.8 mp -109.19 -55.93 4.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.473 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.8 p -171.13 147.42 2.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.664 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mt -91.32 152.25 3.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.014 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 54.1 p -93.63 -157.82 0.57 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.741 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -72.96 154.8 40.38 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.976 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.552 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 0.3 OUTLIER -149.95 59.85 4.01 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.137 -179.254 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.552 ' HD3' ' N ' ' A' ' 9' ' ' THR . 2.8 Cg_endo -76.73 20.43 0.61 Allowed 'Trans proline' 0 C--N 1.308 -1.579 0 C-N-CA 122.645 2.23 . . . . 0.0 112.181 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -142.75 -16.92 0.69 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.689 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.415 ' CG ' ' H ' ' A' ' 13' ' ' ASN . 3.8 t60 63.27 -157.18 0.33 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.754 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.415 ' H ' ' CG ' ' A' ' 12' ' ' HIS . 16.5 m120 71.55 -51.79 0.69 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.21 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.513 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 8.8 t -145.72 129.24 16.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 0.0 111.164 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.9 mtm -109.77 158.71 17.85 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.369 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -97.6 124.23 41.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.376 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 54.5 mt -98.1 122.31 49.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.751 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 96.7 m -86.39 132.11 34.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.441 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.8 mt -102.02 174.13 6.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.334 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 88.8 p -65.18 -5.24 6.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.098 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 66.07 131.29 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.566 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.6 t -149.23 117.06 6.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.021 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 39.28 90.28 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.676 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 51.31 -91.31 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.855 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -156.13 -162.62 11.54 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -146.11 80.79 1.58 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.866 0.365 . . . . 0.0 110.172 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.0 t 38.79 -151.87 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.629 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.2 p -157.01 141.85 16.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.444 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -156.77 136.06 12.08 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.762 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.1 m -99.36 128.92 45.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.032 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.541 ' CZ ' ' HB3' ' A' ' 38' ' ' GLN . 54.0 m-85 -113.49 118.55 34.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.726 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.3 p -125.22 -12.01 6.91 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.356 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.485 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 19.7 pttm -155.38 31.87 0.38 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.612 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.608 HG12 ' N ' ' A' ' 35' ' ' ASP . 59.6 t 73.71 166.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.468 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.608 ' N ' HG12 ' A' ' 34' ' ' VAL . 33.3 t70 -155.6 -110.32 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.425 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -167.94 -39.45 0.02 OUTLIER 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.733 0.301 . . . . 0.0 110.435 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.0 t -57.92 -31.49 66.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.282 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 31' ' ' TYR . 2.5 pt20 -80.16 153.79 74.6 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.472 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -59.25 138.85 87.21 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.057 1.838 . . . . 0.0 111.386 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.61 -39.96 12.12 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.109 0.48 . . . . 0.0 109.885 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.696 ' CB ' HG13 ' A' ' 81' ' ' VAL . 15.6 m-85 -54.28 -47.52 72.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.772 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.992 HD13 HD12 ' A' ' 45' ' ' ILE . 1.6 mm -55.91 -27.65 22.99 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.386 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.21 -43.92 97.75 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.413 ' OD2' HG22 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -55.75 -37.62 68.73 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.157 179.28 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.992 HD12 HD13 ' A' ' 42' ' ' ILE . 22.1 mt -62.5 -48.81 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.158 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.618 ' O ' HG21 ' A' ' 51' ' ' VAL . 51.1 mt -55.49 -32.9 63.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.838 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -78.81 -4.51 49.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.28 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.937 ' O ' HG22 ' A' ' 51' ' ' VAL . 58.0 t -77.91 103.57 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -46.92 110.87 0.33 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.661 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 125.26 6.25 6.34 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.937 HG22 ' O ' ' A' ' 48' ' ' VAL . 0.0 OUTLIER -78.8 -21.65 12.9 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.204 0 CA-C-O 118.759 -0.639 . . . . 0.0 112.51 -179.51 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.9 ttmm 51.83 -64.19 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.231 0.469 . . . . 0.0 111.074 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.757 ' N ' ' O ' ' A' ' 51' ' ' VAL . 1.3 p -172.62 165.76 5.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.163 0.506 . . . . 0.0 111.654 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 83.4 mt -140.78 149.64 21.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.24 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -136.8 115.83 12.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.771 0.32 . . . . 0.0 111.006 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -100.2 132.94 45.28 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.977 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.49 HG13 ' CZ ' ' A' ' 60' ' ' PHE . 6.2 p -164.37 153.27 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.825 0.345 . . . . 0.0 110.902 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 13.0 ttt 46.04 -106.83 0.13 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.185 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -133.15 16.5 4.14 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.647 0.261 . . . . 0.0 110.931 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.49 ' CZ ' HG13 ' A' ' 57' ' ' VAL . 50.7 p90 -131.1 164.3 25.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.116 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.8 mt -133.9 130.08 55.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.146 -179.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.09 109.56 21.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.7 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.403 ' O ' ' HA ' ' A' ' 14' ' ' THR . 59.6 t -101.17 119.74 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.682 ' O ' ' O ' ' A' ' 51' ' ' VAL . 0.9 OUTLIER -97.86 154.33 17.71 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.251 179.799 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.587 ' HD2' ' HB3' ' A' ' 69' ' ' ALA . 12.0 pttt -132.42 165.35 24.49 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.237 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.705 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 51.5 mm-40 -52.4 168.84 0.09 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.204 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -34.97 -42.92 0.17 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.066 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -133.55 -54.2 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.139 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.705 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . . . 48.84 -159.21 0.05 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.0 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -145.26 114.51 7.06 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.744 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -71.6 -38.4 70.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.169 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.11 -26.18 48.81 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.951 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.6 m -89.39 -45.84 9.17 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.108 0.48 . . . . 0.0 110.54 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.2 t -66.97 -39.43 83.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.715 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.446 ' CB ' ' CD ' ' A' ' 76' ' ' PRO . 1.4 mm? -49.26 -62.1 2.76 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.83 -0.168 . . . . 0.0 111.385 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' A' ' 75' ' ' LEU . 2.9 Cg_endo -50.29 -31.75 30.68 Favored 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.495 2.13 . . . . 0.0 112.556 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -78.32 -47.12 18.43 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.329 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.72 -39.38 70.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.475 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -55.78 -43.45 76.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.368 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.58 -34.02 48.75 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.378 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.858 HG21 HD11 ' A' ' 45' ' ' ILE . 12.9 t -60.4 -61.68 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.756 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -84.39 10.81 9.74 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.918 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -157.48 76.59 0.83 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.138 0.494 . . . . 0.0 110.179 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.669 ' H ' HD12 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -73.99 -78.93 0.09 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.885 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.99 147.27 38.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.154 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -63.8 127.96 33.7 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.221 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -84.08 86.99 7.13 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.63 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -163.64 89.94 0.61 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.645 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -98.11 -129.39 0.18 Allowed 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -76.96 168.21 20.5 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.471 0.177 . . . . 0.0 110.565 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.3 t60 . . . . . 0 C--O 1.218 -0.553 0 CA-C-O 117.824 -1.084 . . . . 0.0 110.65 179.873 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 ttt . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 32.1 pttt -169.72 -164.14 0.42 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.928 0.394 . . . . 0.0 111.111 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.644 ' C ' HD12 ' A' ' 4' ' ' ILE . 96.7 mt -84.62 122.63 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.759 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.721 ' N ' HD12 ' A' ' 4' ' ' ILE . 1.8 mp -109.68 -31.73 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-O 121.203 0.525 . . . . 0.0 109.752 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.0 t -167.88 158.03 10.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.159 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.8 mt -148.14 111.56 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.063 0.459 . . . . 0.0 111.165 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 26.1 p 43.83 -145.3 0.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.828 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.422 ' H ' ' H ' ' A' ' 9' ' ' THR . 1.0 OUTLIER -151.77 -8.32 0.22 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.066 0.936 . . . . 0.0 109.247 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.819 HG23 ' O ' ' A' ' 9' ' ' THR . 15.3 t -129.71 93.86 33.56 Favored Pre-proline 0 C--N 1.312 -1.052 0 CA-C-N 113.427 -1.715 . . . . 0.0 109.825 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -70.73 26.18 0.2 Allowed 'Trans proline' 0 C--N 1.302 -1.894 0 C-N-CA 122.358 2.039 . . . . 0.0 112.229 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.505 ' H ' ' C ' ' A' ' 9' ' ' THR . 58.3 t30 -141.95 89.67 2.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.124 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 45.1 t60 -155.32 -114.45 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.997 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -149.18 -35.27 0.18 Allowed 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.8 t -136.73 126.66 25.86 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.87 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.417 ' HG2' ' CH2' ' A' ' 71' ' ' TRP . 13.1 ptp -107.78 154.79 21.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.12 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.4 tttt -102.03 128.12 48.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.464 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.7 mt -99.14 114.12 36.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.91 0.386 . . . . 0.0 111.086 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 84.4 m -88.5 128.04 35.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.497 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.579 HD11 HD11 ' A' ' 61' ' ' ILE . 69.1 mt -102.06 161.48 13.65 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.531 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.42 -1.49 6.6 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.47 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -94.19 114.58 26.72 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.255 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 36.7 m -151.74 76.92 1.21 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.908 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.405 ' H ' ' H ' ' A' ' 24' ' ' GLU . 34.7 ttp85 -168.08 -5.45 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.644 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.405 ' H ' ' H ' ' A' ' 23' ' ' ARG . 5.6 tm-20 -166.47 -46.62 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.157 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.03 166.27 38.42 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 11.8 mtt -94.92 -82.77 0.36 Allowed 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.01 -0.276 . . . . 0.0 110.307 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.643 HG22 ' H ' ' A' ' 28' ' ' SER . 1.8 m -162.98 -143.67 0.08 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.885 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.643 ' H ' HG22 ' A' ' 27' ' ' THR . 11.7 p -156.08 130.3 8.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.245 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -162.28 138.54 7.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.283 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 52.0 m -98.76 148.12 24.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.27 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.401 ' CD1' ' OE1' ' A' ' 38' ' ' GLN . 22.7 m-85 -135.58 120.07 18.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.479 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.3 p -125.06 -7.49 7.16 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.531 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 34' ' ' VAL . 33.4 pttt -158.45 58.38 0.45 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.234 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.423 ' C ' ' O ' ' A' ' 33' ' ' LYS . 19.2 t 26.56 101.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 O-C-N 123.649 0.593 . . . . 0.0 112.521 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -159.49 -156.74 0.53 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.285 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 56.55 -100.24 0.11 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.841 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.5 t -168.2 63.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.401 ' OE1' ' CD1' ' A' ' 31' ' ' TYR . 9.6 mt-30 -92.9 144.9 29.21 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.16 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.462 ' O ' ' N ' ' A' ' 42' ' ' ILE . 3.1 Cg_exo -55.59 134.22 62.66 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 121.596 1.531 . . . . 0.0 110.201 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.408 ' C ' ' O ' ' A' ' 39' ' ' PRO . . . -41.29 -41.44 1.9 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.401 0.619 . . . . 0.0 109.852 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.665 ' CB ' HG13 ' A' ' 81' ' ' VAL . 7.7 m-85 -52.69 -37.98 59.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.202 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.933 HD13 HD12 ' A' ' 45' ' ' ILE . 2.0 mm -70.01 -26.3 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.816 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.556 HD22 ' N ' ' A' ' 43' ' ' ASN . 1.0 OUTLIER -61.17 -38.47 86.6 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.673 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 48' ' ' VAL . 33.6 t70 -55.53 -53.79 52.07 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.829 179.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.933 HD12 HD13 ' A' ' 42' ' ' ILE . 84.4 mt -45.76 -53.76 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.241 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.5 mt -67.18 -36.88 82.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.871 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -81.18 -8.46 59.76 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.078 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.56 ' N ' ' O ' ' A' ' 44' ' ' ASP . 3.9 t -79.52 115.05 21.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -51.19 113.23 0.88 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.637 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 139.68 -39.94 1.47 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.5 t -78.62 147.75 6.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -108.95 -35.58 6.31 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.375 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.469 ' OG ' ' N ' ' A' ' 54' ' ' ILE . 3.1 t -172.96 176.54 3.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.123 0.487 . . . . 0.0 111.189 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.469 ' N ' ' OG ' ' A' ' 53' ' ' SER . 83.2 mt -137.11 154.5 31.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.655 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -138.3 109.14 6.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.262 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -95.48 129.39 42.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.988 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.422 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 5.0 p -163.33 162.91 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.214 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.422 ' N ' HG22 ' A' ' 57' ' ' VAL . 3.1 ttt 37.29 -137.02 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.023 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -102.87 39.87 1.47 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.737 0.303 . . . . 0.0 110.663 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.422 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 38.6 p90 -161.88 169.58 21.0 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.965 0.412 . . . . 0.0 111.373 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.579 HD11 HD11 ' A' ' 19' ' ' LEU . 4.0 mp -138.19 135.4 44.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.431 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.07 154.83 17.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.167 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.2 t -142.74 112.49 2.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.581 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.7 p-10 -99.04 143.46 29.3 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.011 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.485 ' NZ ' ' NE1' ' A' ' 71' ' ' TRP . 16.6 pttm -124.41 -176.23 3.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.524 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -90.59 129.83 36.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.082 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.34 -34.69 7.15 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -34.42 76.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.562 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.32 166.08 14.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.691 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -108.11 177.48 4.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.584 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.485 ' NE1' ' NZ ' ' A' ' 65' ' ' LYS . 12.2 m95 -98.05 -44.78 6.5 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.591 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.415 ' O ' ' CD ' ' A' ' 76' ' ' PRO . 2.7 pp20? -56.05 -21.27 20.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.673 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.522 HG23 ' N ' ' A' ' 74' ' ' VAL . 15.4 t -86.22 -44.65 11.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.313 0.577 . . . . 0.0 109.71 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.522 ' N ' HG23 ' A' ' 73' ' ' THR . 0.9 OUTLIER -75.39 -37.51 38.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.961 -179.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.455 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 2.5 mt -48.56 -61.34 3.31 Favored Pre-proline 0 N--CA 1.466 0.365 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.3 Cg_exo -42.51 -31.65 1.99 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 C-N-CA 122.415 2.076 . . . . 0.0 112.126 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.496 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 0.8 OUTLIER -80.44 -41.97 23.52 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.07 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 81' ' ' VAL . 38.4 t -52.36 -56.15 7.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.216 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -53.09 -33.95 54.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.022 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -54.4 -32.85 58.07 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.219 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.665 HG13 ' CB ' ' A' ' 41' ' ' PHE . 22.0 t -56.95 -64.37 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.018 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.452 ' CD1' ' N ' ' A' ' 82' ' ' PHE . 0.7 OUTLIER -85.22 29.88 0.63 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.101 -179.541 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -162.77 90.13 0.69 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.756 0.312 . . . . 0.0 110.821 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.442 ' O ' ' C ' ' A' ' 85' ' ' GLU . 0.5 OUTLIER -164.25 12.77 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.815 -179.718 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 84' ' ' LEU . 71.9 mm-40 30.61 67.63 0.12 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.702 0.287 . . . . 0.0 111.458 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 19.9 t-160 -61.84 -78.54 0.04 OUTLIER 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.879 0.371 . . . . 0.0 110.185 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -89.67 -170.32 2.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.63 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 34.0 p-80 -141.81 -4.32 1.08 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.6 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -54.23 133.18 44.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.386 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -64.45 114.62 4.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.822 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.178 179.724 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mtt . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -125.22 170.43 11.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.778 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 66.8 mt -81.7 126.34 39.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.799 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.3 mm -110.06 -17.71 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.205 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -169.99 137.54 1.62 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.796 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.712 ' N ' HD12 ' A' ' 6' ' ' ILE . 2.1 mp -94.39 94.46 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.407 -179.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.485 ' CB ' ' H ' ' A' ' 16' ' ' LYS . 19.4 p 44.14 -149.21 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.356 178.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -115.38 -137.83 0.37 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.416 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.742 ' H ' ' CD ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -124.88 -40.37 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.878 -179.459 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.742 ' CD ' ' H ' ' A' ' 9' ' ' THR . 3.7 Cg_exo -71.11 9.9 0.77 Allowed 'Trans proline' 0 C--N 1.314 -1.28 0 C-N-CA 121.969 1.779 . . . . 0.0 112.121 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -93.99 169.15 10.49 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.238 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -172.24 -41.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.034 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -89.3 -19.4 25.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.01 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.44 ' O ' HG23 ' A' ' 14' ' ' THR . 8.6 t -149.25 126.48 11.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.425 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.652 ' SD ' ' CE2' ' A' ' 71' ' ' TRP . 6.7 mtp -108.21 132.21 53.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.39 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.485 ' H ' ' CB ' ' A' ' 7' ' ' SER . 10.7 ttmm -94.27 121.65 36.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.57 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 58.2 mt -93.6 126.3 46.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.844 0.354 . . . . 0.0 110.684 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.3 m -88.13 137.03 32.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.656 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.3 mt -114.98 155.02 27.71 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.398 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.7 p -68.64 2.99 2.07 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.916 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -89.48 173.74 8.18 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.292 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.6 t -151.87 85.23 1.29 Allowed 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.65 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.415 ' O ' ' N ' ' A' ' 25' ' ' GLY . 25.3 ptt-85 36.45 -153.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 O-C-N 123.339 0.399 . . . . 0.0 110.635 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 36.36 32.48 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.778 0.323 . . . . 0.0 111.353 179.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 23' ' ' ARG . . . -171.68 -47.27 0.04 OUTLIER Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 8.0 mmm -91.44 114.1 26.55 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.344 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.0 m -73.59 -131.53 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.243 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.3 p -156.98 133.77 10.17 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.615 0.245 . . . . 0.0 110.419 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -156.43 130.12 8.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.499 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.69 150.5 21.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.403 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -130.76 117.53 19.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.975 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.7 p -118.69 -10.22 10.05 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.187 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.11 48.89 0.33 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.816 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.617 HG12 ' N ' ' A' ' 35' ' ' ASP . 53.8 t 53.68 167.69 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.488 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.617 ' N ' HG12 ' A' ' 34' ' ' VAL . 13.2 m-20 -160.07 -101.93 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.496 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.42 ' C ' ' N ' ' A' ' 38' ' ' GLN . 24.2 t0 -172.48 -50.23 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.455 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.8 m -49.49 -15.35 0.15 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.852 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.436 ' CG ' HD21 ' A' ' 43' ' ' ASN . 1.4 pt20 -93.48 147.52 33.82 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.14 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -55.77 137.59 78.93 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 C-N-CA 121.805 1.67 . . . . 0.0 110.584 179.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.97 -39.09 8.44 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.321 0.582 . . . . 0.0 109.463 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.599 ' CB ' HG13 ' A' ' 81' ' ' VAL . 5.8 m-85 -55.75 -31.03 62.2 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.264 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.982 HD13 HD12 ' A' ' 45' ' ' ILE . 1.7 mm -77.02 -24.53 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 N-CA-C 110.156 -0.312 . . . . 0.0 110.156 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.436 HD21 ' CG ' ' A' ' 38' ' ' GLN . 9.2 m120 -62.53 -39.65 94.26 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.585 ' O ' ' N ' ' A' ' 48' ' ' VAL . 25.4 t70 -57.7 -52.14 66.66 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.789 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.982 HD12 HD13 ' A' ' 42' ' ' ILE . 56.4 mt -45.41 -52.95 2.06 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.472 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 26.5 mt -61.62 -38.07 86.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.053 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.6 mtpt -84.61 -6.88 59.39 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.172 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.585 ' N ' ' O ' ' A' ' 44' ' ' ASP . 3.7 t -79.86 119.4 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.038 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -52.99 126.24 19.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.82 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 127.22 -39.34 1.96 Allowed Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.5 t -79.75 147.96 6.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.76 0.314 . . . . 0.0 110.735 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -108.97 -34.55 6.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.709 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.1 t -174.09 179.12 1.97 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.067 0.461 . . . . 0.0 110.968 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.0 mt -145.9 138.98 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.075 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -126.6 112.79 15.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.086 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.2 t-160 -93.53 131.24 38.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.418 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.505 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 2.0 p -164.02 156.58 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.837 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.6 ttt 41.27 -141.43 0.08 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.494 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -100.31 27.67 5.53 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 121.173 -0.211 . . . . 0.0 111.069 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.505 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 14.1 p90 -144.62 169.69 17.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.995 0.426 . . . . 0.0 111.056 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.2 mt -136.45 136.86 48.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.307 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.11 110.14 22.12 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.481 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.6 t -98.7 112.5 30.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.683 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 -104.29 134.01 48.23 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.469 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.3 pttt -122.09 -172.91 2.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.404 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -96.32 127.13 42.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.462 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -45.86 -24.75 0.43 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.969 0.414 . . . . 0.0 110.461 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -68.61 -35.22 77.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.004 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.09 163.05 17.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.755 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -111.59 174.03 6.06 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.487 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.652 ' CE2' ' SD ' ' A' ' 15' ' ' MET . 41.0 m95 -92.52 -48.07 6.81 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.019 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -50.59 -22.31 1.95 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.782 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.473 ' CG2' ' N ' ' A' ' 74' ' ' VAL . 4.7 t -88.88 -44.26 10.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.284 0.564 . . . . 0.0 110.166 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.473 ' N ' ' CG2' ' A' ' 73' ' ' THR . 0.9 OUTLIER -77.47 -37.65 25.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.321 -179.16 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.0 OUTLIER -48.42 -60.25 4.77 Favored Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.479 -179.109 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.7 Cg_exo -42.91 -31.31 2.16 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.507 2.138 . . . . 0.0 111.893 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 25.5 mttm -81.4 -41.1 22.42 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.08 -53.76 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.035 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -51.39 -40.97 60.32 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.635 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -52.41 -33.09 42.14 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.97 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.599 HG13 ' CB ' ' A' ' 41' ' ' PHE . 31.1 t -58.85 -63.12 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.753 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -83.65 23.36 0.97 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.887 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -155.99 95.25 1.61 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.053 0.454 . . . . 0.0 110.16 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.536 HD13 ' H ' ' A' ' 85' ' ' GLU . 0.3 OUTLIER -159.69 -107.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.307 179.635 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.536 ' H ' HD13 ' A' ' 84' ' ' LEU . 11.5 mm-40 44.3 -162.54 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.718 0.294 . . . . 0.0 110.607 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -78.98 149.21 32.32 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.4 ' ND1' ' C ' ' A' ' 87' ' ' HIS . 13.6 t-80 -82.19 -53.76 5.81 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 65.3 112.17 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.233 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -73.83 107.68 6.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.666 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.409 ' H ' ' H ' ' A' ' 91' ' ' HIS . 1.5 t60 -171.76 3.66 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.132 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.409 ' H ' ' H ' ' A' ' 90' ' ' HIS . 17.2 t-80 . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 118.195 -0.907 . . . . 0.0 111.078 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 36.7 pttt -150.81 -163.99 1.91 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.398 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.593 ' C ' HD12 ' A' ' 4' ' ' ILE . 82.0 mt -80.21 131.7 33.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.766 0.317 . . . . 0.0 110.842 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.593 HD12 ' C ' ' A' ' 3' ' ' ILE . 1.7 mp -108.56 -47.61 7.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.007 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.5 p -172.1 148.67 2.24 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.896 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.798 HG22 ' H ' ' A' ' 7' ' ' SER . 34.9 mt -92.52 178.98 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.028 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.798 ' H ' HG22 ' A' ' 6' ' ' ILE . 12.3 t -92.56 -163.82 1.1 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.507 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -90.16 -6.27 55.52 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.84 0.828 . . . . 0.0 110.462 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 9' ' ' THR . 11.6 t -123.09 55.15 7.31 Favored Pre-proline 0 C--N 1.311 -1.087 0 CA-C-N 113.931 -1.486 . . . . 0.0 110.22 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.418 ' CD ' ' N ' ' A' ' 9' ' ' THR . 2.3 Cg_endo -52.52 -3.67 0.11 Allowed 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 122.924 2.416 . . . . 0.0 113.169 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.456 ' N ' ' OD1' ' A' ' 11' ' ' ASN . 0.5 OUTLIER -137.47 -159.48 0.96 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.572 0.225 . . . . 0.0 110.563 -179.242 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.449 ' N ' ' CD2' ' A' ' 12' ' ' HIS . 3.7 m170 79.49 77.26 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.104 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.4 m120 67.04 -54.96 0.45 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.492 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.2 t -147.84 157.13 43.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.886 0.374 . . . . 0.0 110.971 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.75 161.3 35.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.44 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.42 ' HG2' ' H ' ' A' ' 17' ' ' ILE . 6.7 ttmm -92.03 162.44 14.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.805 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.42 ' H ' ' HG2' ' A' ' 16' ' ' LYS . 71.3 mt -138.68 113.96 8.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.14 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.8 m -84.9 119.2 25.08 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.255 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.548 ' C ' ' H ' ' A' ' 21' ' ' GLU . 64.4 mt -104.5 166.96 10.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.379 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.8 m -69.6 34.3 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.321 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.548 ' H ' ' C ' ' A' ' 19' ' ' LEU . 10.0 mm-40 -87.08 -170.31 3.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.299 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.566 ' O ' ' CB ' ' A' ' 23' ' ' ARG . 34.3 t -149.06 -29.9 0.26 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.23 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.566 ' CB ' ' O ' ' A' ' 22' ' ' SER . 40.2 ttt180 102.29 155.81 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 113.588 -1.642 . . . . 0.0 109.612 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.468 ' CB ' ' O ' ' A' ' 23' ' ' ARG . 6.6 tt0 83.53 27.29 0.1 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.669 -178.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -151.2 -43.34 0.02 OUTLIER Glycine 0 CA--C 1.527 0.827 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 14.8 mtt -91.24 125.28 35.96 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.786 0.327 . . . . 0.0 110.865 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.493 HG23 ' N ' ' A' ' 28' ' ' SER . 9.8 t -75.91 -135.88 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.214 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.493 ' N ' HG23 ' A' ' 27' ' ' THR . 18.2 p -155.73 135.25 12.47 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.673 0.273 . . . . 0.0 110.553 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -158.7 142.13 14.99 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.24 148.56 26.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.324 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -129.73 111.99 13.19 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.201 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.2 p -123.62 -0.83 8.57 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.088 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 35.6 mtmt -151.77 25.44 0.66 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.738 0.304 . . . . 0.0 110.84 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.643 HG12 ' N ' ' A' ' 35' ' ' ASP . 60.0 t 54.85 170.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.052 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.643 ' N ' HG12 ' A' ' 34' ' ' VAL . 12.6 t0 70.54 99.1 0.06 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.546 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -172.73 21.08 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.091 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.1 p 76.93 13.49 2.16 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.169 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.46 174.2 6.5 Favored Pre-proline 0 N--CA 1.465 0.279 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -71.68 129.04 15.02 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.32 2.013 . . . . 0.0 111.192 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.68 -36.88 7.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.958 0.409 . . . . 0.0 110.342 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.622 ' HB3' HG13 ' A' ' 81' ' ' VAL . 31.6 m-85 -54.49 -32.94 58.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.841 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.95 HD13 HD12 ' A' ' 45' ' ' ILE . 4.0 mm -76.52 -20.81 14.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.285 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.525 HD22 ' N ' ' A' ' 43' ' ' ASN . 1.8 m120 -62.65 -40.18 96.2 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.602 ' O ' HG23 ' A' ' 48' ' ' VAL . 21.5 m-20 -57.11 -52.5 65.06 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.726 178.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.95 HD12 HD13 ' A' ' 42' ' ' ILE . 73.8 mt -49.04 -49.76 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.599 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.9 mt -63.34 -36.8 84.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.687 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -83.16 -10.9 58.38 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.22 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 44' ' ' ASP . 19.7 t -76.3 124.9 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.911 0.386 . . . . 0.0 110.165 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.486 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 1.8 pm0 -51.14 138.54 19.95 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.142 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 106.35 -35.59 4.95 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.762 -0.935 . . . . 0.0 110.762 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 31.3 t -78.71 138.61 19.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.867 0.365 . . . . 0.0 110.63 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -103.04 -55.13 2.48 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.129 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 64.7 m -161.19 -179.49 7.5 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.465 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.401 HG22 ' N ' ' A' ' 55' ' ' PHE . 93.7 mt -138.02 153.02 26.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.12 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.407 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 20.2 t80 -139.1 110.58 7.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.462 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -98.42 133.09 43.29 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.437 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.43 HG22 ' N ' ' A' ' 58' ' ' MET . 9.3 p -164.5 158.74 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.715 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.43 ' N ' HG22 ' A' ' 57' ' ' VAL . 0.2 OUTLIER 46.22 -137.98 0.61 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.383 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -105.06 44.04 1.06 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.001 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -165.75 172.27 11.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.777 0.322 . . . . 0.0 110.653 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 68.7 mt -135.13 143.55 36.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.385 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.3 t -114.46 114.32 25.65 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.713 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.2 t -99.53 111.93 30.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.886 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.28 146.85 27.43 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.955 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.516 ' HZ1' ' C ' ' A' ' 70' ' ' ASN . 11.5 ptpt -124.52 -164.01 1.22 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.138 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -66.11 -153.6 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.684 0.278 . . . . 0.0 110.506 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.441 ' ND2' ' H ' ' A' ' 67' ' ' ASN . 0.3 OUTLIER -55.04 -48.2 73.74 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.746 0.308 . . . . 0.0 110.367 179.752 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -154.06 -42.98 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.453 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 46.79 -137.45 0.72 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.738 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.516 ' C ' ' HZ1' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -141.88 135.42 29.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.036 179.724 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -91.53 -45.17 8.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.942 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -54.63 -21.93 12.02 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.85 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.465 HG23 ' N ' ' A' ' 74' ' ' VAL . 6.0 t -86.02 -44.11 12.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.115 0.483 . . . . 0.0 110.16 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.465 ' N ' HG23 ' A' ' 73' ' ' THR . 1.1 t -74.26 -38.75 48.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.485 -179.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.502 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.1 mp -48.58 -58.97 6.94 Favored Pre-proline 0 N--CA 1.465 0.299 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 2.9 Cg_endo -46.39 -32.45 11.0 Favored 'Trans proline' 0 N--CA 1.491 1.334 0 C-N-CA 122.471 2.114 . . . . 0.0 111.931 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.68 -42.07 22.65 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.962 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 74.3 t -58.62 -43.84 88.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.095 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -53.7 -44.86 70.13 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.031 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.38 -32.71 40.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.396 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.622 HG13 ' HB3' ' A' ' 41' ' ' PHE . 15.2 t -57.84 -62.75 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.469 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -87.9 -33.84 18.36 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -79.56 50.34 1.12 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.828 0.347 . . . . 0.0 111.351 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.3 mt -77.46 52.45 0.96 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.107 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -72.02 117.32 13.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.986 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -95.06 -83.15 0.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.038 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.3 t-160 -154.9 -42.91 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.782 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -67.45 134.58 51.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.121 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -56.22 156.21 5.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.564 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -142.55 82.23 1.77 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.058 0.456 . . . . 0.0 110.702 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.219 -0.51 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.158 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.507 ' N ' ' H ' ' A' ' 20' ' ' SER . 23.1 mtt . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.9 pttt -149.68 56.88 0.98 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.691 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 39.6 mt 57.43 101.83 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.605 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.6 mm -102.72 -17.72 6.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.798 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.0 t -168.07 118.2 0.79 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.481 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.453 ' CG2' ' N ' ' A' ' 7' ' ' SER . 5.4 mm -93.98 154.32 3.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.852 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.453 ' N ' ' CG2' ' A' ' 6' ' ' ILE . 15.1 t 62.22 140.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.276 -0.875 . . . . 0.0 112.399 178.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.401 ' H ' ' H ' ' A' ' 9' ' ' THR . 1.2 tm-20 -173.7 -7.63 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.572 -1.195 . . . . 0.0 109.91 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.481 ' C ' ' H ' ' A' ' 11' ' ' ASN . 23.6 m -105.6 131.52 21.68 Favored Pre-proline 0 C--N 1.311 -1.078 0 CA-C-N 113.907 -1.497 . . . . 0.0 109.186 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -58.64 3.52 0.15 Allowed 'Trans proline' 0 C--N 1.307 -1.614 0 C-N-CA 121.944 1.763 . . . . 0.0 112.745 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.481 ' H ' ' C ' ' A' ' 9' ' ' THR . 35.8 t30 -91.28 179.04 5.81 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.4 p-80 -140.36 -3.48 1.35 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.261 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -85.05 -16.78 39.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.822 0.344 . . . . 0.0 110.352 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.503 ' HB ' ' HA ' ' A' ' 64' ' ' ASP . 4.3 t -150.63 131.91 14.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.579 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 63.0 mtm -100.04 156.87 16.93 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.401 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.81 120.7 37.63 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.29 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.8 mt -97.56 110.32 25.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.485 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.2 m -85.2 139.91 31.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.473 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.7 mt -113.69 151.28 32.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.496 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.507 ' H ' ' N ' ' A' ' 1' ' ' MET . 41.9 t -67.27 -2.25 5.7 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.194 179.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.83 158.41 16.83 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.636 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.9 m -147.48 -161.98 1.45 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.927 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.459 ' O ' ' N ' ' A' ' 25' ' ' GLY . 11.3 mtt85 41.53 -142.88 0.07 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.497 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 36.84 -92.49 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.394 0.434 . . . . 0.0 111.126 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 23' ' ' ARG . . . 147.5 -13.98 1.4 Allowed Glycine 0 CA--C 1.523 0.569 0 N-CA-C 110.864 -0.894 . . . . 0.0 110.864 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 10.8 tpp 52.81 23.19 2.65 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.819 0.342 . . . . 0.0 110.111 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.2 p 48.9 -162.86 0.03 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.693 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.2 p -156.76 135.23 11.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.332 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -157.38 143.86 17.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 27.6 m -102.05 121.55 42.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.79 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.434 ' HB3' HD11 ' A' ' 46' ' ' LEU . 25.7 m-85 -107.14 114.51 28.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.845 0.355 . . . . 0.0 110.595 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.1 p -132.96 1.72 3.59 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.889 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -157.74 25.84 0.28 Allowed 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.935 -0.306 . . . . 0.0 111.437 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.766 HG12 ' H ' ' A' ' 35' ' ' ASP . 13.9 t 50.2 177.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.264 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.766 ' H ' HG12 ' A' ' 34' ' ' VAL . 9.8 m-20 58.08 94.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -168.14 -43.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.919 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.5 t 164.65 -22.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.68 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.441 ' HG2' HD21 ' A' ' 43' ' ' ASN . 0.9 OUTLIER -49.39 147.8 5.26 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.985 -179.662 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -56.8 141.23 92.6 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.229 1.953 . . . . 0.0 111.33 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -47.82 -42.69 26.82 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.627 ' CB ' HG13 ' A' ' 81' ' ' VAL . 22.7 m-85 -54.13 -37.08 63.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.676 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.994 HD13 HD12 ' A' ' 45' ' ' ILE . 2.0 mm -71.67 -24.96 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.383 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.559 HD22 ' N ' ' A' ' 43' ' ' ASN . 1.5 m120 -60.41 -40.84 92.39 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.507 ' O ' HG23 ' A' ' 48' ' ' VAL . 10.9 t70 -55.48 -44.46 76.52 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.922 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.994 HD12 HD13 ' A' ' 42' ' ' ILE . 19.3 mt -58.08 -62.7 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.192 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.368 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.469 ' HA ' HG11 ' A' ' 51' ' ' VAL . 49.0 mt -43.15 -35.52 1.39 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.799 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -81.74 -13.83 57.28 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 44' ' ' ASP . 40.8 t -77.29 119.46 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.827 0.346 . . . . 0.0 110.616 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -54.49 143.75 23.25 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.827 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 90.31 -0.55 78.27 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.666 ' O ' ' N ' ' A' ' 53' ' ' SER . 4.1 t -80.41 -19.28 12.0 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt 52.34 -68.1 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 123.412 0.685 . . . . 0.0 111.233 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.666 ' N ' ' O ' ' A' ' 51' ' ' VAL . 18.5 p -174.62 174.45 2.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.107 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 86.1 mt -135.55 147.07 28.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.642 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -135.04 108.75 8.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.253 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -93.8 129.39 40.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.281 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 8.4 p -162.92 148.18 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.126 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 7.2 tpp 50.28 -146.3 0.42 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.394 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 40.4 p-10 -95.83 43.33 1.08 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.619 0.247 . . . . 0.0 111.482 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -163.62 173.7 12.65 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.8 0.333 . . . . 0.0 110.84 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 14.3 mt -137.95 132.9 44.11 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.608 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 t -100.58 109.09 21.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.13 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.3 t -99.95 110.18 26.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.538 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.633 ' O ' ' O ' ' A' ' 51' ' ' VAL . 1.4 m-20 -89.43 146.46 24.63 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.291 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.0 pttp -120.15 171.6 8.36 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.313 0.383 . . . . 0.0 110.392 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.434 ' O ' ' C ' ' A' ' 67' ' ' ASN . 0.3 OUTLIER -58.49 -176.64 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.97 -179.583 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.434 ' C ' ' O ' ' A' ' 66' ' ' GLU . 2.6 m120 -32.06 -60.25 0.27 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.058 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -138.25 -52.19 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.899 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 47.92 -150.25 0.14 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.06 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -142.44 125.08 15.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.467 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 39.6 m95 -73.5 -45.53 53.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.209 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -56.35 -21.34 23.97 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.077 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 m -86.29 -45.08 11.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.197 0.523 . . . . 0.0 110.128 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.97 -38.96 44.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.435 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.496 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.5 mt -49.26 -58.05 9.97 Favored Pre-proline 0 N--CA 1.464 0.232 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -46.17 -32.33 10.14 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 122.171 1.914 . . . . 0.0 111.474 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -80.9 -41.31 23.22 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 48.4 t -66.5 -41.77 89.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.537 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -54.02 -42.62 69.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.735 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.98 -32.75 15.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.154 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.821 HG21 HD11 ' A' ' 45' ' ' ILE . 11.3 t -59.67 -63.33 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.443 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -86.71 -29.96 22.03 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 121.004 -0.279 . . . . 0.0 111.514 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.445 ' C ' ' H ' ' A' ' 85' ' ' GLU . 8.7 tt0 -79.04 57.36 2.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.056 0.455 . . . . 0.0 110.676 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.9 mt -76.58 36.83 0.16 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.35 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.445 ' H ' ' C ' ' A' ' 83' ' ' GLU . 2.3 pt-20 33.2 80.27 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.531 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -58.99 127.47 32.38 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.436 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 32.6 t-80 -152.91 -59.75 0.14 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.382 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -55.29 151.7 9.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.374 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.2 m80 -56.4 174.29 0.14 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.862 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -44.05 147.33 0.52 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.06 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.066 -0.968 . . . . 0.0 110.767 -179.954 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpp? . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -135.03 161.78 34.33 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.545 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.7 mt -80.71 110.38 16.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.636 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.5 mm -104.94 -24.34 4.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.448 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -165.94 125.55 1.67 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.872 0.368 . . . . 0.0 111.198 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.783 HG22 ' H ' ' A' ' 7' ' ' SER . 26.5 mt -95.64 178.72 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.783 ' H ' HG22 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -142.12 113.7 7.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.997 0.427 . . . . 0.0 110.327 179.696 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.48 140.96 29.59 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.85 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.05 171.88 6.24 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.781 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -71.68 -12.35 28.9 Favored 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.287 1.991 . . . . 0.0 111.399 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -102.3 112.81 25.65 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.217 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.534 ' CG ' ' O ' ' A' ' 12' ' ' HIS . 24.1 p-80 -98.28 83.47 3.07 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.086 0.469 . . . . 0.0 110.669 -179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.56 ' CA ' ' HZ3' ' A' ' 65' ' ' LYS . 24.5 t-20 -153.08 -31.86 0.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.996 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.4 ' O ' HG23 ' A' ' 14' ' ' THR . 3.8 t -146.73 128.18 14.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.835 0.35 . . . . 0.0 110.613 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 33.3 mtm -109.01 154.12 22.65 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.555 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.5 mtpt -106.75 118.72 37.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.294 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 56.7 mt -96.28 121.99 47.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.709 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.1 m -86.79 124.5 33.11 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.5 mt -96.01 -154.09 0.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.322 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.8 m -63.91 -3.06 2.19 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.636 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 57.81 91.85 0.04 OUTLIER 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.846 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 6.3 m -89.51 -170.15 2.74 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.509 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.42 ' O ' ' C ' ' A' ' 24' ' ' GLU . 0.2 OUTLIER -72.92 63.67 0.66 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.194 -179.445 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.42 ' C ' ' O ' ' A' ' 23' ' ' ARG . 27.0 mt-10 34.44 53.99 0.61 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.047 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.481 ' C ' ' H ' ' A' ' 27' ' ' THR . . . -146.06 -91.45 0.11 Allowed Glycine 0 CA--C 1.523 0.588 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.0 tpp 49.63 9.06 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.547 0.213 . . . . 0.0 111.068 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 28' ' ' SER . 0.6 OUTLIER 69.55 -161.51 0.17 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -178.867 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.673 ' H ' HG22 ' A' ' 27' ' ' THR . 97.8 p -159.06 144.73 16.33 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.306 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -161.14 156.68 24.72 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.787 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -132.18 128.1 37.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.454 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -107.03 128.83 54.71 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.478 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.8 p -117.76 4.51 12.26 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.683 ' O ' HG23 ' A' ' 34' ' ' VAL . 8.9 ttmm -155.55 -100.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.291 -1.322 . . . . 0.0 109.185 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 33' ' ' LYS . 59.5 t -166.27 97.72 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 114.686 -1.143 . . . . 0.0 109.823 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -161.87 -147.88 0.14 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.304 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 62.66 3.75 1.22 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.968 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 p 65.8 17.65 10.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.342 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.574 HE21 ' ND2' ' A' ' 43' ' ' ASN . 3.2 pt20 -55.52 175.81 0.19 Allowed Pre-proline 0 CA--C 1.528 0.105 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.77 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.427 ' CD ' ' HB2' ' A' ' 38' ' ' GLN . 3.7 Cg_exo -71.11 125.57 11.57 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 121.911 1.741 . . . . 0.0 111.4 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.52 -37.72 5.64 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.155 0.502 . . . . 0.0 109.978 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.507 ' HB3' HG13 ' A' ' 81' ' ' VAL . 17.9 m-85 -53.79 -33.42 55.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.398 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.886 HD13 HD12 ' A' ' 45' ' ' ILE . 4.2 mm -78.58 -19.77 13.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.317 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.574 ' ND2' HE21 ' A' ' 38' ' ' GLN . 2.0 m120 -62.3 -37.69 86.53 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.584 ' O ' ' N ' ' A' ' 48' ' ' VAL . 22.6 t0 -57.78 -50.7 72.37 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.825 178.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.886 HD12 HD13 ' A' ' 42' ' ' ILE . 13.6 mt -48.66 -51.94 10.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.584 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.3 mt -65.14 -38.1 89.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.983 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 37.9 mttm -83.95 -9.82 58.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.722 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.584 ' N ' ' O ' ' A' ' 44' ' ' ASP . 2.6 t -78.21 123.66 35.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 -49.96 133.74 22.2 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.722 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.6 -44.68 1.39 Allowed Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 94.8 t -79.72 138.56 19.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.799 0.333 . . . . 0.0 110.413 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.457 ' NZ ' ' O ' ' A' ' 65' ' ' LYS . 5.6 ttpm? -105.49 -33.08 8.24 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.111 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -176.43 179.53 1.18 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.511 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 76.8 mt -141.06 153.36 20.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.775 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -140.11 107.56 5.56 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.55 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.424 ' CD2' ' N ' ' A' ' 57' ' ' VAL . 10.4 t-160 -96.11 142.22 28.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.906 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.542 HG22 ' N ' ' A' ' 58' ' ' MET . 13.1 p -162.47 164.9 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.828 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.542 ' N ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER 27.96 -90.1 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.894 -179.602 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.525 ' H ' ' CG ' ' A' ' 58' ' ' MET . 8.5 p-10 -144.7 42.85 1.36 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.954 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.479 ' CD1' ' C ' ' A' ' 60' ' ' PHE . 8.5 p90 -163.96 151.0 11.9 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.569 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 77.6 mt -113.99 134.49 56.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.518 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.5 t -106.58 111.62 24.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.556 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 16.0 t -99.17 106.03 18.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -96.13 138.85 33.15 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.883 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.56 ' HZ3' ' CA ' ' A' ' 13' ' ' ASN . 2.1 pttm -116.54 -171.59 2.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.212 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.429 ' O ' ' ND2' ' A' ' 13' ' ' ASN . 19.4 mt-10 -61.64 -151.89 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.41 0.444 . . . . 0.0 110.834 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.421 ' OD1' ' N ' ' A' ' 68' ' ' ASP . 5.5 p30 -64.95 -44.5 89.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.315 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.421 ' N ' ' OD1' ' A' ' 67' ' ' ASN . 1.9 t0 -143.4 -53.91 0.37 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.821 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.18 -151.78 0.22 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.486 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -140.56 129.93 23.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.299 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.507 ' HE1' ' NZ ' ' A' ' 65' ' ' LYS . 30.1 m95 -85.15 -44.28 13.09 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.519 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.545 ' CD ' ' H ' ' A' ' 72' ' ' GLU . 16.6 mp0 -55.23 -22.42 17.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.158 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.7 m -90.9 -45.43 8.77 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.102 0.477 . . . . 0.0 110.641 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.25 -38.62 18.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.441 -178.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.534 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 4.4 tt -48.54 -58.08 9.2 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.306 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 2.8 Cg_endo -44.31 -31.24 4.21 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 122.587 2.192 . . . . 0.0 112.072 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.422 ' O ' ' HB3' ' A' ' 80' ' ' ALA . 24.0 mttt -81.22 -49.45 10.77 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.181 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.3 t -50.39 -53.52 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.596 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -55.06 -40.61 70.49 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.824 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -51.87 -33.01 34.61 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.844 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.531 HG21 HD11 ' A' ' 45' ' ' ILE . 17.7 t -58.89 -54.39 34.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -84.98 39.76 0.78 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.42 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.516 ' C ' ' H ' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -159.91 -78.36 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.055 179.747 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 14.4 mt 70.31 -35.26 0.32 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.894 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.516 ' H ' ' C ' ' A' ' 83' ' ' GLU . 1.3 tm-20 -70.42 132.7 46.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.254 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.409 ' ND1' ' C ' ' A' ' 86' ' ' HIS . 1.7 p80 -50.54 162.36 0.25 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.936 0.398 . . . . 0.0 111.31 -179.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.443 ' CG ' ' O ' ' A' ' 87' ' ' HIS . 21.9 p-80 -157.01 91.38 1.19 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.25 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.6 m170 -73.9 -132.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.134 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 38.8 t60 -158.65 -51.22 0.06 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.43 . . . . 0.0 109.997 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.403 ' CD2' ' H ' ' A' ' 90' ' ' HIS . 3.9 p80 -59.6 145.54 44.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.455 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.404 ' CG ' ' O ' ' A' ' 91' ' ' HIS . 12.2 t-80 . . . . . 0 C--O 1.221 -0.4 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.794 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.8 mtt . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -141.83 -163.21 1.53 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.564 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.6 mt -80.45 123.86 37.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.42 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.1 mm -109.59 -44.65 6.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.6 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 t -171.08 153.58 3.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.529 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.497 HG22 ' H ' ' A' ' 7' ' ' SER . 1.1 mm -97.41 -161.63 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.497 ' H ' HG22 ' A' ' 6' ' ' ILE . 42.0 m -147.88 73.52 1.27 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.776 0.322 . . . . 0.0 110.404 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.549 ' CD ' ' H ' ' A' ' 8' ' ' GLU . 0.8 OUTLIER -41.27 130.64 2.86 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.258 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 t -148.27 148.38 28.92 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.292 -179.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -49.44 -13.55 0.45 Allowed 'Trans proline' 0 C--N 1.311 -1.441 0 C-N-CA 122.429 2.086 . . . . 0.0 111.895 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -98.41 163.55 12.65 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.406 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 56.1 m80 -140.03 -144.86 0.17 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.041 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.476 ' O ' ' N ' ' A' ' 65' ' ' LYS . 1.2 m120 70.05 -41.68 0.49 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.854 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.416 ' CB ' ' HA ' ' A' ' 64' ' ' ASP . 11.1 t -148.35 135.46 20.23 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.656 0.265 . . . . 0.0 110.347 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.438 ' HG2' ' CZ2' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -114.75 164.61 13.82 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.992 -179.698 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -99.7 127.7 45.82 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.254 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.1 mt -99.03 121.95 50.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.344 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.0 m -87.76 134.03 33.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.593 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 15.8 mt -105.04 165.14 11.29 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.88 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t -70.18 -8.22 48.11 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -98.17 99.45 10.7 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.526 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.425 ' O ' ' C ' ' A' ' 23' ' ' ARG . 7.3 t -90.85 179.92 5.66 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.797 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 24' ' ' GLU . 37.7 mmm-85 33.04 -122.96 0.08 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.81 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.435 ' C ' ' O ' ' A' ' 23' ' ' ARG . 2.4 mp0 34.01 -106.93 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 O-C-N 123.319 0.387 . . . . 0.0 110.595 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 134.52 127.93 2.77 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 8.3 mtt -92.64 -92.91 0.16 Allowed 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.481 HG22 ' H ' ' A' ' 28' ' ' SER . 1.1 m -163.13 -141.53 0.06 Allowed 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.481 ' H ' HG22 ' A' ' 27' ' ' THR . 96.9 p -158.69 135.92 9.94 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.22 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -156.09 135.39 12.22 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.527 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.3 m -104.02 121.42 43.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.187 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -114.11 114.46 26.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.959 0.409 . . . . 0.0 110.949 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.7 p -124.38 -7.08 7.57 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.481 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.523 ' CG ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -158.41 50.96 0.4 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.955 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.626 HG12 ' N ' ' A' ' 35' ' ' ASP . 47.4 t 52.68 168.96 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.121 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.626 ' N ' HG12 ' A' ' 34' ' ' VAL . 46.2 t0 -162.62 -106.38 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.558 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -169.09 -52.08 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.522 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.9 p -48.39 -21.9 0.61 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.716 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.47 ' OE1' ' N ' ' A' ' 35' ' ' ASP . 2.3 pt20 -86.99 147.06 41.99 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.499 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -54.67 136.32 70.5 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 121.64 1.56 . . . . 0.0 110.716 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -47.31 -37.08 10.24 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.468 ' CB ' HG13 ' A' ' 81' ' ' VAL . 17.6 m-85 -55.16 -34.82 64.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.441 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.879 HD13 HD12 ' A' ' 45' ' ' ILE . 1.9 mm -72.9 -22.02 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.581 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -62.1 -40.46 95.94 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 178.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -55.5 -51.9 65.46 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.173 179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.879 HD12 HD13 ' A' ' 42' ' ' ILE . 9.0 mt -49.34 -60.65 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.684 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 68.1 mt -46.61 -35.14 5.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.224 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -14.39 58.14 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.513 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.13 109.85 12.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 120.845 0.355 . . . . 0.0 110.224 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -52.45 136.2 32.19 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.432 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 103.79 -5.13 46.77 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.632 ' O ' ' N ' ' A' ' 53' ' ' SER . 6.0 t -82.34 -21.23 9.76 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 CA-C-N 115.107 -0.547 . . . . 0.0 111.448 -179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 17.1 ttmt 54.92 -65.25 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.677 0.791 . . . . 0.0 111.163 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.632 ' N ' ' O ' ' A' ' 51' ' ' VAL . 1.1 t -172.97 172.06 4.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.587 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.415 ' N ' ' OG ' ' A' ' 53' ' ' SER . 95.4 mt -140.06 149.36 22.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.872 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -140.75 117.26 10.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.221 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -95.59 139.78 31.36 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.975 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.529 ' CG1' ' CZ ' ' A' ' 60' ' ' PHE . 12.6 p -165.78 144.0 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.032 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.401 ' HG3' ' N ' ' A' ' 59' ' ' ASP . 16.6 ptp 37.3 -130.32 0.15 Allowed 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.288 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 58' ' ' MET . 4.2 p-10 -99.72 43.98 1.04 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.529 ' CZ ' ' CG1' ' A' ' 57' ' ' VAL . 1.9 p90 -167.33 160.9 13.87 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.534 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 20.1 mt -128.86 136.03 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.346 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -103.32 107.68 18.6 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 39.4 t -101.87 120.31 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.175 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.617 ' O ' ' O ' ' A' ' 51' ' ' VAL . 0.8 OUTLIER -100.71 120.59 40.31 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.028 -179.501 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 13' ' ' ASN . 8.7 pttp -102.41 165.4 11.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.027 0.442 . . . . 0.0 111.137 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -82.6 130.35 35.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.109 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 -51.91 -33.43 37.0 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.875 0.369 . . . . 0.0 110.689 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -67.85 -35.52 78.71 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.817 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.42 162.53 16.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.517 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -111.19 158.65 18.68 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.824 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.438 ' CZ2' ' HG2' ' A' ' 15' ' ' MET . 32.1 m95 -71.5 -49.13 44.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.266 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -50.74 -20.52 1.28 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.535 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.5 m -88.38 -44.88 10.44 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.113 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -80.88 -38.91 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.927 -178.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.552 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -49.15 -57.76 10.66 Favored Pre-proline 0 N--CA 1.466 0.356 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.13 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -43.0 -36.27 5.29 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.648 2.232 . . . . 0.0 112.296 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -81.42 -40.15 23.84 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.84 0.353 . . . . 0.0 110.384 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.443 ' O ' HG23 ' A' ' 81' ' ' VAL . 68.1 t -59.55 -53.41 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.579 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -52.02 -35.32 46.59 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.448 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -50.5 -32.6 18.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.998 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.874 HG21 HD11 ' A' ' 45' ' ' ILE . 18.9 t -60.55 -58.44 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.331 -179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' A' ' 82' ' ' PHE . 1.1 m-85 -81.52 8.13 10.33 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.255 -179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -159.81 82.7 0.73 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 120.913 0.387 . . . . 0.0 110.472 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.9 mt -76.43 52.18 0.76 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.191 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 53.28 -177.24 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -72.01 -34.29 68.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.7 -179.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 22.7 t-80 -86.72 103.71 15.43 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.58 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.457 ' ND1' ' N ' ' A' ' 89' ' ' HIS . 59.4 t-80 -61.82 160.24 12.34 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.513 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.457 ' N ' ' ND1' ' A' ' 88' ' ' HIS . 20.8 t-80 -74.12 -82.78 0.06 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.909 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.439 ' CD2' ' N ' ' A' ' 91' ' ' HIS . 40.4 p-80 42.02 -155.1 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.119 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.476 ' ND1' ' N ' ' A' ' 91' ' ' HIS . 2.5 p-80 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.522 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 mtt . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -151.68 179.22 8.59 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.263 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 62.3 mt -79.32 108.14 12.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.241 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.8 mm -111.75 -76.96 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-N 115.912 -0.586 . . . . 0.0 109.557 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.471 ' H ' ' HB ' ' A' ' 18' ' ' THR . 5.8 m -74.78 122.96 24.11 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.127 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.43 HG23 ' SD ' ' A' ' 15' ' ' MET . 7.5 mt -98.05 -67.6 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 CA-C-O 121.816 0.817 . . . . 0.0 110.547 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.4 t 64.97 128.66 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 113.998 -1.456 . . . . 0.0 110.05 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.423 ' CD ' ' N ' ' A' ' 8' ' ' GLU . 1.7 pm0 -127.49 -165.0 1.42 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.34 166.93 15.8 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.805 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -69.39 -14.37 37.14 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.197 1.932 . . . . 0.0 112.387 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.462 ' ND2' ' OD1' ' A' ' 13' ' ' ASN . 1.6 p-10 -106.73 -10.85 15.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.476 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.417 ' O ' ' ND2' ' A' ' 13' ' ' ASN . 81.0 m80 48.61 94.04 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.378 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.462 ' OD1' ' ND2' ' A' ' 11' ' ' ASN . 30.4 m120 -149.96 -38.98 0.14 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.968 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.409 ' O ' HG23 ' A' ' 14' ' ' THR . 3.0 t -148.54 127.07 12.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.188 0.518 . . . . 0.0 111.644 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.43 ' SD ' HG23 ' A' ' 6' ' ' ILE . 2.2 ptp -112.1 167.67 10.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.968 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.427 ' N ' ' O ' ' A' ' 6' ' ' ILE . 32.4 mttp -99.37 166.59 11.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.434 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.4 mt -145.05 105.12 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.978 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.471 ' HB ' ' H ' ' A' ' 5' ' ' SER . 4.5 m -88.58 147.69 24.46 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.508 ' O ' ' CB ' ' A' ' 20' ' ' SER . 11.0 mt -102.85 -10.53 18.99 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.508 ' CB ' ' O ' ' A' ' 19' ' ' LEU . 4.0 p 91.65 -1.07 0.17 Allowed 'General case' 0 N--CA 1.472 0.629 0 O-C-N 123.447 0.467 . . . . 0.0 110.889 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -143.87 155.55 44.14 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.857 0.361 . . . . 0.0 110.964 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.0 m -150.77 177.46 10.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.085 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.403 ' O ' ' C ' ' A' ' 24' ' ' GLU . 11.0 ttm180 -168.6 36.48 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.787 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.403 ' C ' ' O ' ' A' ' 23' ' ' ARG . 9.6 mp0 38.22 36.12 0.11 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.177 0.513 . . . . 0.0 110.458 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 161.76 60.3 0.02 OUTLIER Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.817 -0.913 . . . . 0.0 110.817 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.414 ' O ' ' CB ' ' A' ' 27' ' ' THR . 0.4 OUTLIER -91.45 21.36 4.6 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.414 ' CB ' ' O ' ' A' ' 26' ' ' MET . 0.2 OUTLIER 80.82 159.76 0.16 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.218 -179.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 p -153.2 134.58 14.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.454 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -163.65 144.36 8.85 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.687 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.67 117.87 35.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.588 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.471 ' CG ' ' OE1' ' A' ' 38' ' ' GLN . 73.7 m-85 -109.24 111.66 23.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.438 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 81.9 p -118.32 -13.26 9.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.361 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.444 ' O ' ' C ' ' A' ' 34' ' ' VAL . 17.6 pttt -155.87 61.45 0.59 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.179 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.444 ' C ' ' O ' ' A' ' 33' ' ' LYS . 18.7 t 29.62 90.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.296 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -80.3 -102.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.442 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -175.01 90.28 0.05 Allowed 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.2 p 169.17 -40.58 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.584 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.529 HE22 ' CD1' ' A' ' 46' ' ' LEU . 19.3 pt20 -69.33 147.88 97.22 Favored Pre-proline 0 C--N 1.329 -0.305 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -53.77 137.77 67.75 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 121.883 1.722 . . . . 0.0 111.588 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -45.39 -38.06 5.59 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.379 0.609 . . . . 0.0 109.455 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.625 ' HB3' HG13 ' A' ' 81' ' ' VAL . 24.4 m-85 -55.33 -31.91 62.07 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.682 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.985 HD13 HD12 ' A' ' 45' ' ' ILE . 2.9 mm -77.55 -22.02 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.553 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.401 ' ND2' HG13 ' A' ' 34' ' ' VAL . 9.3 m120 -64.77 -36.09 83.17 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 178.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.54 ' O ' HG23 ' A' ' 48' ' ' VAL . 1.4 m-20 -58.84 -51.78 68.53 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.203 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.985 HD12 HD13 ' A' ' 42' ' ' ILE . 39.5 mt -48.9 -50.81 13.57 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.873 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.529 ' CD1' HE22 ' A' ' 38' ' ' GLN . 12.0 mt -64.43 -36.18 83.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.054 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -82.54 -6.89 59.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.616 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 44' ' ' ASP . 8.7 t -75.39 111.54 11.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -51.62 100.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.726 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 156.53 -44.52 0.52 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 39.9 t -77.66 149.11 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -105.02 -33.35 8.35 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.496 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.456 ' OG ' ' N ' ' A' ' 54' ' ' ILE . 1.4 t -178.71 175.31 1.08 Allowed 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.129 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.456 ' N ' ' OG ' ' A' ' 53' ' ' SER . 46.8 mt -142.48 152.26 17.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.788 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.412 ' CZ ' ' HB ' ' A' ' 57' ' ' VAL . 19.8 t80 -137.83 108.52 6.62 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.139 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 -95.45 132.54 40.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.199 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.744 HG22 ' H ' ' A' ' 58' ' ' MET . 9.8 p -162.29 175.72 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.327 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.744 ' H ' HG22 ' A' ' 57' ' ' VAL . 14.8 ttt 34.54 -100.34 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.357 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -140.58 11.36 2.29 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.83 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -128.35 172.31 11.2 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.142 0.496 . . . . 0.0 111.23 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.1 mt -135.01 133.79 53.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.884 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.5 t -104.78 110.18 22.42 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.507 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.7 t -100.09 114.35 38.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.437 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -109.1 140.51 42.56 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.071 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -133.12 -172.09 2.85 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.703 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -98.4 -172.52 2.35 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -87.5 -47.21 8.92 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.054 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -48.94 -34.13 12.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.798 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.16 170.07 11.81 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.602 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -134.18 173.66 11.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.554 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.7 m95 -85.46 -54.77 4.37 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.451 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -51.53 -20.79 2.07 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 m -87.39 -45.48 10.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.909 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -76.54 -37.21 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.333 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.463 ' N ' ' HD2' ' A' ' 76' ' ' PRO . 1.3 mm? -48.18 -61.95 2.66 Favored Pre-proline 0 N--CA 1.466 0.356 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.349 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 75' ' ' LEU . 3.2 Cg_exo -42.96 -32.73 2.82 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 C-N-CA 122.853 2.369 . . . . 0.0 112.587 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -83.29 -49.57 9.27 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.568 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.484 ' O ' HG23 ' A' ' 81' ' ' VAL . 17.6 t -57.15 -48.55 81.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.158 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -53.14 -40.73 64.46 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.038 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.488 ' O ' HD22 ' A' ' 84' ' ' LEU . . . -51.38 -34.64 35.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.7 HG21 HD11 ' A' ' 45' ' ' ILE . 18.5 t -53.23 -60.19 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.08 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.84 49.65 1.76 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.378 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -157.6 -76.78 0.08 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.08 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 80' ' ' ALA . 3.6 mm? 57.53 7.75 0.56 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.94 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -70.92 121.49 18.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.995 0.426 . . . . 0.0 110.785 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -111.46 150.92 29.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.845 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 51.21 62.68 2.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.228 0.537 . . . . 0.0 110.303 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.505 ' ND1' ' O ' ' A' ' 88' ' ' HIS . 10.2 p80 -74.19 93.36 2.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.737 -179.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -89.88 55.36 3.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.246 0.546 . . . . 0.0 110.427 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -71.44 134.96 46.97 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.286 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.7 p-80 . . . . . 0 C--O 1.219 -0.522 0 CA-C-O 117.849 -1.072 . . . . 0.0 111.331 -179.756 . . . . . . . . 0 0 . 1 stop_ save_