data_1hvn_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 1hvn _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 ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? . . . . . 0 C--O 1.234 0.248 0 CA-C-O 120.634 0.254 . . . . 0.0 110.502 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.9 t -61.34 148.32 41.81 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.764 164.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -125.88 -11.24 6.6 Favored 'General case' 0 C--O 1.245 0.863 0 O-C-N 120.534 -1.354 . . . . 0.0 111.302 -175.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.525 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.26 -44.14 92.42 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.507 -0.746 . . . . 0.0 110.261 162.647 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.4 p -112.31 -50.98 2.87 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.679 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 118.01 7.8 11.2 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 -178.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -90.22 169.16 11.37 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.258 -0.471 . . . . 0.0 110.411 178.206 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.4 138.6 31.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.415 -172.029 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.85 -65.29 0.37 Allowed Glycine 0 CA--C 1.528 0.868 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 164.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -100.62 172.32 7.17 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 122.485 -0.421 . . . . 0.0 110.513 -158.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.517 HG13 ' N ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -87.2 155.84 3.26 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.714 -169.882 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.525 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -48.33 -52.52 21.21 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.31 -1.314 . . . . 0.0 113.13 156.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -24.21 66.31 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.846 -167.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . . . . . . . . 0.275 0.0 OUTLIER -115.88 11.84 15.63 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.467 -171.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -65.21 -147.94 0.01 OUTLIER 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.757 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.65 -38.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.95 -0.469 . . . . 0.0 110.353 -173.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.581 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.435 171.435 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.307 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.8 t -62.17 143.69 56.42 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.57 160.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -119.1 -13.56 9.37 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 114.316 -1.311 . . . . 0.0 111.255 -177.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.538 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.15 -41.71 88.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.289 166.61 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -111.79 -56.4 2.39 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.471 -1.241 . . . . 0.0 111.707 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 106.92 22.97 7.31 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -169.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -93.24 173.71 7.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.45 -0.375 . . . . 0.0 110.299 167.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.15 119.65 38.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.291 -168.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.84 57.16 2.08 Favored Glycine 0 CA--C 1.529 0.925 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 163.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -175.3 171.82 2.83 Favored 'General case' 0 C--O 1.238 0.479 0 O-C-N 122.426 -0.455 . . . . 0.0 110.015 157.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.527 HG12 ' HB2' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -89.2 151.77 3.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.748 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.343 -166.009 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.538 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -50.68 -47.03 58.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.973 -1.467 . . . . 0.0 113.258 159.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . 0.527 ' HB2' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.39 -7.9 2.33 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.547 0.689 . . . . 0.0 110.983 -165.87 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.466 ' HB3' ' CG2' ' E' ' 12' ' ' ILE . 0.0 OUTLIER -133.48 13.98 4.11 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.009 -164.218 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 44.8 t -78.86 -117.7 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -156.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 170.71 -73.09 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 120.824 -1.172 . . . . 0.0 109.853 -165.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.564 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.774 -179.744 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.312 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.4 t -62.1 148.47 44.18 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.562 159.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -125.01 -13.42 6.84 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.177 -175.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.541 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -58.7 -40.34 83.36 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 121.611 -0.68 . . . . 0.0 110.364 164.321 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.8 p -114.15 -55.06 2.54 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.665 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 133.87 -39.89 1.66 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.556 -1.017 . . . . 0.0 110.556 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -62.26 165.57 5.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.237 -0.482 . . . . 0.0 110.38 -170.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.07 129.98 44.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.355 -166.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.75 45.24 2.13 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 110.393 -1.083 . . . . 0.0 110.393 161.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.2 p-80 -177.1 166.75 2.42 Favored 'General case' 0 C--O 1.242 0.669 0 O-C-N 122.486 -0.42 . . . . 0.0 110.063 158.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.471 ' CG2' ' HB3' ' E' ' 15' ' ' ASN . 2.6 tt -86.14 155.75 3.38 Favored 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-N 114.434 -1.257 . . . . 0.0 109.214 -167.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.541 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.34 -47.1 62.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.123 -1.399 . . . . 0.0 113.023 160.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . 0.47 ' HB2' ' CD1' ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.76 -11.22 6.91 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.452 0.644 . . . . 0.0 110.904 -167.593 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.471 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.26 0.0 OUTLIER -128.54 11.78 6.32 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 119.176 -1.01 . . . . 0.0 110.547 -167.731 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 33.4 t -81.64 163.72 22.34 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -162.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.41 29.48 0.2 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.266 164.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.592 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.312 172.653 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.328 0 CA-C-O 120.493 0.187 . . . . 0.0 110.548 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.8 t -60.92 151.24 30.81 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.986 163.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -129.23 -12.0 4.59 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 120.851 -1.156 . . . . 0.0 111.028 -172.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.528 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.76 -41.88 92.04 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 121.751 -0.593 . . . . 0.0 110.178 160.604 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 30.0 p -114.85 -55.67 2.46 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.837 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 135.07 -39.63 1.66 Allowed Glycine 0 CA--C 1.525 0.694 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.626 -169.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -61.65 155.48 22.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.161 0.505 . . . . 0.0 110.425 -166.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -75.53 142.45 42.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.306 -171.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 119.27 -66.43 0.4 Allowed Glycine 0 CA--C 1.527 0.828 0 N-CA-C 110.391 -1.083 . . . . 0.0 110.391 162.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.0 p-80 -102.03 173.65 6.29 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 122.459 -0.436 . . . . 0.0 110.432 -158.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.516 HG13 ' N ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -90.79 155.14 3.09 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.637 -168.15 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.528 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -47.13 -51.76 17.18 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.373 -1.285 . . . . 0.0 113.775 156.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.89 -8.73 2.38 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.401 0.619 . . . . 0.0 111.117 -166.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.462 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -130.97 11.03 5.07 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 119.039 -1.064 . . . . 0.0 110.225 -167.175 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.9 t -79.84 163.51 24.33 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -161.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.68 -24.65 8.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.448 167.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.711 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.276 -167.987 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . 0.511 ' HG3' ' CE1' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.433 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.7 t -61.39 145.76 50.55 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.484 155.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . 0.511 ' CE1' ' HG3' ' E' ' 2' ' ' LYS . 1.5 m-85 -120.63 -14.49 8.6 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.133 -176.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.541 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.21 -41.55 88.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.333 166.464 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.4 p -111.83 -54.94 2.56 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.475 -1.239 . . . . 0.0 111.628 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.9 -35.76 2.33 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 -171.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -61.84 164.46 6.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.35 -0.425 . . . . 0.0 110.343 -170.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.63 131.96 34.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.308 -166.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 127.7 -63.2 0.61 Allowed Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 162.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -101.96 174.94 5.71 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.278 -0.543 . . . . 0.0 110.523 -157.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.47 ' CG2' ' HB3' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -88.84 153.27 3.25 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.478 -168.67 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.541 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -50.17 -47.29 54.51 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.073 -1.421 . . . . 0.0 113.382 158.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -8.06 2.27 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.466 0.65 . . . . 0.0 111.035 -166.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.47 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.252 0.0 OUTLIER -132.41 12.61 4.56 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 119.28 -0.968 . . . . 0.0 110.014 -164.757 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.6 t -84.13 164.82 18.95 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -158.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.69 -39.87 2.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.364 167.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.501 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.325 -170.014 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.44 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.7 t -61.59 146.48 48.75 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.518 157.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -121.64 -14.87 8.09 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.069 -175.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.54 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.01 -42.57 90.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.314 165.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -110.81 -55.45 2.48 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.663 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 128.72 -35.94 2.54 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 -170.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.79 157.15 18.67 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.232 -0.484 . . . . 0.0 110.262 -173.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -91.21 123.08 34.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.38 -162.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.14 51.46 0.99 Allowed Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 160.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -178.44 175.69 1.12 Allowed 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.459 -0.436 . . . . 0.0 110.433 158.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.473 HG13 ' N ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -90.14 154.4 3.15 Favored 'Isoleucine or valine' 0 C--O 1.245 0.864 0 CA-C-O 118.064 -0.97 . . . . 0.0 109.316 -167.534 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.8 -47.16 64.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 113.674 -1.603 . . . . 0.0 113.053 158.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . 0.461 ' HB2' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.37 -10.65 3.31 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.408 0.623 . . . . 0.0 111.41 -167.56 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.465 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.257 0.0 OUTLIER -130.29 14.43 5.6 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 119.01 -1.076 . . . . 0.0 110.468 -167.276 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.8 t -85.34 140.01 31.13 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.36 0.6 . . . . 0.0 109.849 -160.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -95.67 -34.88 11.79 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.389 171.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.591 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.251 -168.332 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.365 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.2 t -61.85 147.05 47.81 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.413 156.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -123.12 -13.44 7.75 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.144 -175.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.536 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.31 -41.45 89.07 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.832 -0.542 . . . . 0.0 110.173 165.002 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' E' ' 18' ' ' ALA . 27.6 p -111.82 -55.52 2.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.423 -1.262 . . . . 0.0 111.766 177.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 129.15 -37.12 2.26 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.636 -0.985 . . . . 0.0 110.636 -170.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 9.8 mttm -61.79 150.78 36.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.277 -174.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.16 141.51 38.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.31 -166.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 125.9 -68.13 0.52 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 162.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -101.42 176.58 5.19 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 122.44 -0.447 . . . . 0.0 110.31 -158.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.485 HG13 ' N ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -88.93 154.13 3.19 Favored 'Isoleucine or valine' 0 C--O 1.243 0.719 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.672 -169.351 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.536 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -49.65 -48.63 49.23 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 113.971 -1.468 . . . . 0.0 113.44 158.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 2.5 tpt85 -60.54 -8.03 2.54 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 121.526 0.679 . . . . 0.0 110.874 -166.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.46 ' HB3' ' CG2' ' E' ' 12' ' ' ILE . 0.0 OUTLIER -136.03 12.03 3.34 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 118.927 -1.109 . . . . 0.0 109.65 -163.237 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 37.5 t -72.58 -72.0 0.26 Allowed 'General case' 0 C--O 1.245 0.854 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -158.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 20.2 ttp85 78.3 -54.86 0.49 Allowed 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 120.673 -1.267 . . . . 0.0 111.362 -155.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . 0.46 ' HB3' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.24 0.586 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.318 -168.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? . . . . . 0 N--CA 1.465 0.287 0 CA-C-O 121.441 0.639 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.4 t -61.76 136.68 58.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.907 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -113.5 -13.17 12.83 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 114.67 -1.15 . . . . 0.0 111.193 -177.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.542 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.21 -49.51 77.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.455 166.946 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.6 p -102.72 -56.32 2.26 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.576 176.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 135.19 -29.6 2.91 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 -177.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.22 145.63 53.04 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.046 -0.577 . . . . 0.0 110.342 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.47 158.02 34.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.357 -166.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 60.93 48.81 84.39 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.619 -0.993 . . . . 0.0 110.619 161.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -171.25 170.6 5.95 Favored 'General case' 0 C--O 1.241 0.612 0 O-C-N 122.024 -0.692 . . . . 0.0 110.03 153.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.49 HG13 ' N ' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -91.08 146.52 6.11 Favored 'Isoleucine or valine' 0 C--O 1.246 0.904 0 CA-C-O 117.724 -1.131 . . . . 0.0 109.125 -160.344 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.09 -51.12 56.53 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.726 -1.579 . . . . 0.0 113.257 158.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . 0.414 ' HA ' ' HD2' ' E' ' 14' ' ' ARG . 28.4 tpt85 -60.62 -8.54 2.94 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.274 0.559 . . . . 0.0 111.092 -167.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.471 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -130.64 17.47 5.28 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.313 -170.542 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.2 t -89.33 145.62 25.24 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.464 0.65 . . . . 0.0 109.716 -166.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 -36.83 9.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.487 175.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.527 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.427 -173.663 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . 0.517 ' HG3' ' CE2' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.418 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 t -61.78 145.11 53.53 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.519 156.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . 0.517 ' CE2' ' HG3' ' E' ' 2' ' ' LYS . 2.4 m-85 -120.77 -14.4 8.55 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.029 -175.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.539 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.27 -42.94 92.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.345 166.046 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -110.09 -55.49 2.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.557 -1.202 . . . . 0.0 111.636 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 128.94 -36.12 2.48 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.565 -1.014 . . . . 0.0 110.565 -170.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -61.84 154.73 25.14 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.123 -0.538 . . . . 0.0 110.26 -173.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -90.33 123.61 34.23 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.323 -164.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.17 49.0 0.96 Allowed Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 160.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.0 p-80 -178.27 175.5 1.19 Allowed 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.481 -0.423 . . . . 0.0 110.348 158.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.494 HG21 ' ND2' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -89.93 153.89 3.19 Favored 'Isoleucine or valine' 0 C--O 1.246 0.873 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.273 -167.003 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.539 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.23 -48.13 62.16 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 113.735 -1.575 . . . . 0.0 113.153 158.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . 0.42 ' HB2' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.75 -8.47 3.02 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.35 0.595 . . . . 0.0 110.961 -166.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.494 ' ND2' HG21 ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -132.1 15.47 4.67 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.392 -167.774 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 t -86.3 164.56 17.04 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -161.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . 0.461 ' HG3' ' N ' ' E' ' 18' ' ' ALA . 1.3 ptt180 -129.2 -34.15 1.89 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.522 174.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . 0.461 ' N ' ' HG3' ' E' ' 17' ' ' ARG . . . . . . . . 0 C--O 1.239 0.551 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.365 -169.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.39 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 25.2 t -62.33 140.97 58.51 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.479 156.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -115.61 -14.61 11.46 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.232 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.54 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -58.85 -40.07 83.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.515 168.706 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -112.89 -56.38 2.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.328 -1.306 . . . . 0.0 111.685 175.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.77 14.93 12.77 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.048 -0.821 . . . . 0.0 111.048 -170.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.06 160.76 15.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.929 0.395 . . . . 0.0 110.241 166.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -92.07 130.47 37.8 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.341 -170.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 134.32 -57.1 0.7 Allowed Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 163.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -109.67 172.16 7.02 Favored 'General case' 0 C--O 1.24 0.554 0 O-C-N 122.556 -0.379 . . . . 0.0 110.323 -159.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.474 HG13 ' N ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -85.48 154.23 3.5 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-N 114.263 -1.335 . . . . 0.0 109.326 -170.163 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -50.13 -47.53 54.02 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.287 158.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . 0.456 ' HB2' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.99 -8.19 2.17 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.397 0.618 . . . . 0.0 111.1 -166.366 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.474 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.255 0.0 OUTLIER -131.47 13.34 5.0 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 119.349 -0.941 . . . . 0.0 110.098 -165.377 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.8 t -84.4 134.87 34.46 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.121 0.486 . . . . 0.0 109.756 -159.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -107.6 17.43 22.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.518 170.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.573 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.385 -173.356 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . 0.507 ' HG3' ' CE2' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.326 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.0 t -62.36 142.05 58.0 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.496 158.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . 0.507 ' CE2' ' HG3' ' E' ' 2' ' ' LYS . 1.0 OUTLIER -118.35 -13.68 9.8 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.206 -177.476 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.542 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.18 -43.64 92.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.465 166.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -108.91 -56.85 2.22 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.74 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.08 12.25 12.54 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -172.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.92 168.5 15.98 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 168.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -97.93 125.08 42.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.429 -171.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.42 50.16 3.04 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 162.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 45.9 p-80 -174.02 172.39 3.4 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 122.444 -0.445 . . . . 0.0 110.167 158.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.47 ' CG2' ' HB3' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -90.54 152.9 3.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.915 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.232 -165.277 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.43 -47.17 63.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 113.786 -1.552 . . . . 0.0 113.113 158.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -10.0 3.54 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.398 0.618 . . . . 0.0 111.159 -167.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.47 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.257 0.0 OUTLIER -130.7 14.53 5.38 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 118.982 -1.087 . . . . 0.0 110.524 -167.949 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.0 t -86.68 155.77 20.26 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.307 0.575 . . . . 0.0 109.848 -162.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.09 -27.34 4.21 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.518 176.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.555 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.38 -170.304 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.236 0 N-CA-C 110.459 -0.2 . . . . 0.0 110.459 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 28.3 t -61.95 143.85 55.89 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.788 162.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -119.8 -13.42 9.09 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.189 -177.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.542 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.23 -41.53 88.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.38 166.421 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -112.22 -56.82 2.35 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.775 177.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 111.59 19.39 7.45 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -171.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -96.12 139.28 32.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.089 0.471 . . . . 0.0 110.294 168.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -64.29 137.85 58.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.354 -174.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.94 -68.22 0.47 Allowed Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.396 -1.081 . . . . 0.0 110.396 162.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.9 p-80 -98.98 174.84 6.15 Favored 'General case' 0 C--O 1.239 0.533 0 O-C-N 122.42 -0.459 . . . . 0.0 110.398 -158.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.468 ' CG2' ' HB3' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -89.75 153.17 3.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-N 114.695 -1.139 . . . . 0.0 109.197 -166.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.4 -47.63 62.87 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.89 -1.504 . . . . 0.0 113.152 158.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -9.37 2.57 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.406 0.622 . . . . 0.0 111.224 -167.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.468 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.259 0.0 OUTLIER -130.85 13.82 5.3 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 118.914 -1.114 . . . . 0.0 110.451 -167.12 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.5 t -84.55 153.24 23.37 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.095 0.474 . . . . 0.0 109.802 -160.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.94 -49.95 6.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.393 170.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.664 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.312 -168.685 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . 0.46 ' HG3' ' CE1' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.215 0 CA-C-O 121.248 0.546 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.3 t -59.24 150.9 24.39 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.91 159.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . 0.46 ' CE1' ' HG3' ' E' ' 2' ' ' LYS . 58.7 m-85 -129.94 -7.36 4.45 Favored 'General case' 0 C--O 1.246 0.87 0 O-C-N 120.552 -1.342 . . . . 0.0 111.61 -178.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.545 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -58.4 -39.48 79.78 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 121.451 -0.781 . . . . 0.0 110.28 160.85 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 26.4 p -115.7 -53.19 2.6 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.685 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.0 -28.74 3.63 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.596 -1.002 . . . . 0.0 110.596 -173.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.51 147.82 47.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.316 -0.442 . . . . 0.0 110.277 -167.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -76.47 125.71 29.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.305 -166.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 138.86 -66.67 0.52 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.439 -1.065 . . . . 0.0 110.439 163.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -98.22 176.93 5.55 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.42 -0.459 . . . . 0.0 110.404 -158.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.464 ' CG2' ' HB3' ' E' ' 15' ' ' ASN . 0.8 OUTLIER -89.21 153.14 3.25 Favored 'Isoleucine or valine' 0 C--O 1.243 0.754 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.44 -170.042 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.545 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.82 -46.93 64.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 113.688 -1.596 . . . . 0.0 113.109 159.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -8.27 1.95 Allowed 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.512 0.672 . . . . 0.0 111.201 -166.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.464 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.253 0.0 OUTLIER -132.02 13.72 4.74 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.153 -164.834 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 28.0 t -84.44 126.57 33.37 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.159 0.504 . . . . 0.0 109.722 -157.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.24 -19.92 20.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.304 168.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.546 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.292 -168.697 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.22 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.6 t -62.08 142.46 57.54 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.593 162.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.52 -14.68 10.29 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.1 -177.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.524 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -58.97 -43.95 91.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.435 167.564 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.6 p -110.75 -55.93 2.42 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.589 178.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.81 15.21 11.19 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 -172.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.9 mttt -92.0 161.57 14.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.183 167.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -90.94 135.86 33.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.347 -167.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.77 51.1 4.39 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 162.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -175.72 172.36 2.55 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 122.513 -0.404 . . . . 0.0 110.313 158.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.508 HG13 ' N ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -86.63 155.97 3.32 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.569 -169.042 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.11 -49.93 59.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.278 -1.328 . . . . 0.0 112.391 156.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . 0.479 ' HA ' ' HD2' ' E' ' 14' ' ' ARG . 16.4 tpt85 -61.21 -22.79 65.09 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.938 -168.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.457 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.287 0.0 OUTLIER -115.78 27.07 9.54 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.538 -171.24 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.1 t -93.9 159.44 15.18 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.718 -165.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.75 28.26 1.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.401 168.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.464 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.414 -179.528 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.324 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 t -61.69 142.69 57.05 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.728 161.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -119.59 -11.86 9.38 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.436 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.542 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -58.82 -42.44 89.17 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.862 -0.524 . . . . 0.0 110.4 166.024 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.5 p -110.39 -55.97 2.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.684 175.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 118.41 7.28 11.15 Favored Glycine 0 CA--C 1.52 0.405 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.206 -173.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.06 171.23 10.0 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.521 -0.339 . . . . 0.0 110.219 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -95.95 137.63 34.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.355 -167.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.73 48.59 10.04 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 162.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.8 p-80 -171.98 169.59 5.62 Favored 'General case' 0 C--O 1.239 0.524 0 O-C-N 122.431 -0.452 . . . . 0.0 110.289 156.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.463 HG13 ' N ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -88.98 154.44 3.17 Favored 'Isoleucine or valine' 0 C--O 1.246 0.89 0 CA-C-N 114.616 -1.174 . . . . 0.0 109.089 -167.599 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -52.02 -46.06 64.84 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 113.79 -1.55 . . . . 0.0 113.009 158.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.37 -11.77 4.81 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.392 0.615 . . . . 0.0 111.404 -167.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.463 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.259 0.0 OUTLIER -127.53 13.85 7.04 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.557 -167.367 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.0 t -87.08 165.55 15.7 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 -160.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.06 28.4 0.92 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.26 167.397 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.557 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.369 169.961 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.83 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.301 0 O4'-C1'-N19 109.329 1.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.83 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.62 1 P-O3'-C3' 107.798 -9.918 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.817 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.649 1 P-O3'-C3' 107.666 -10.029 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.8 " O5'" " C2'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.648 1 P-O3'-C3' 107.855 -9.871 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.726 " O5'" " C2'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.801 1 P-O3'-C3' 108.471 -9.358 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . . . . . . . . . 11.1 p . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -116.84 142.25 47.17 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.502 -162.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.9 t -61.34 148.32 41.81 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.764 164.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -125.88 -11.24 6.6 Favored 'General case' 0 C--O 1.245 0.863 0 O-C-N 120.534 -1.354 . . . . 0.0 111.302 -175.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.525 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.26 -44.14 92.42 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.507 -0.746 . . . . 0.0 110.261 162.647 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.4 p -112.31 -50.98 2.87 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.679 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 118.01 7.8 11.2 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 -178.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -90.22 169.16 11.37 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.258 -0.471 . . . . 0.0 110.411 178.206 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.4 138.6 31.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.415 -172.029 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.85 -65.29 0.37 Allowed Glycine 0 CA--C 1.528 0.868 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 164.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -100.62 172.32 7.17 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 122.485 -0.421 . . . . 0.0 110.513 -158.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.517 HG13 ' N ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -87.2 155.84 3.26 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.714 -169.882 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.525 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -48.33 -52.52 21.21 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.31 -1.314 . . . . 0.0 113.13 156.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -24.21 66.31 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.846 -167.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . . . . . . . . 0.275 0.0 OUTLIER -115.88 11.84 15.63 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.467 -171.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -65.21 -147.94 0.01 OUTLIER 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.757 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.65 -38.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.95 -0.469 . . . . 0.0 110.353 -173.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.581 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.435 171.435 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.828 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.307 0 O4'-C1'-N19 109.321 1.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.828 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.608 1.539 1 P-O3'-C3' 107.796 -9.92 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.798 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.681 1 P-O3'-C3' 107.701 -9.999 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.798 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.682 1 P-O3'-C3' 107.811 -9.908 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.729 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.756 1 P-O3'-C3' 108.411 -9.407 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.461 HG21 " C1'" ' D' ' 5' ' ' ' DC' . 26.8 m . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.74 131.55 54.83 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.354 -165.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.8 t -62.17 143.69 56.42 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.57 160.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -119.1 -13.56 9.37 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 114.316 -1.311 . . . . 0.0 111.255 -177.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.538 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.15 -41.71 88.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.289 166.61 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -111.79 -56.4 2.39 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.471 -1.241 . . . . 0.0 111.707 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 106.92 22.97 7.31 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -169.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -93.24 173.71 7.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.45 -0.375 . . . . 0.0 110.299 167.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.15 119.65 38.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.291 -168.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.84 57.16 2.08 Favored Glycine 0 CA--C 1.529 0.925 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 163.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -175.3 171.82 2.83 Favored 'General case' 0 C--O 1.238 0.479 0 O-C-N 122.426 -0.455 . . . . 0.0 110.015 157.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.527 HG12 ' HB2' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -89.2 151.77 3.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.748 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.343 -166.009 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.538 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -50.68 -47.03 58.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.973 -1.467 . . . . 0.0 113.258 159.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . 0.527 ' HB2' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.39 -7.9 2.33 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.547 0.689 . . . . 0.0 110.983 -165.87 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.466 ' HB3' ' CG2' ' E' ' 12' ' ' ILE . 0.0 OUTLIER -133.48 13.98 4.11 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.009 -164.218 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 44.8 t -78.86 -117.7 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -156.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 170.71 -73.09 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 120.824 -1.172 . . . . 0.0 109.853 -165.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.564 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.774 -179.744 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.831 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.312 0 O4'-C1'-N19 109.335 1.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.831 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.636 1 P-O3'-C3' 107.791 -9.924 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.803 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.695 1 P-O3'-C3' 107.71 -9.991 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.803 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.758 1 P-O3'-C3' 107.794 -9.922 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.731 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.801 1 P-O3'-C3' 108.479 -9.351 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.416 HG11 ' C2 ' ' D' ' 5' ' ' ' DC' . 9.9 p . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.85 129.09 44.83 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.409 -161.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.4 t -62.1 148.47 44.18 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.562 159.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -125.01 -13.42 6.84 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.177 -175.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.541 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -58.7 -40.34 83.36 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 121.611 -0.68 . . . . 0.0 110.364 164.321 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.8 p -114.15 -55.06 2.54 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.665 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 133.87 -39.89 1.66 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.556 -1.017 . . . . 0.0 110.556 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -62.26 165.57 5.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.237 -0.482 . . . . 0.0 110.38 -170.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.07 129.98 44.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.355 -166.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.75 45.24 2.13 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 110.393 -1.083 . . . . 0.0 110.393 161.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.2 p-80 -177.1 166.75 2.42 Favored 'General case' 0 C--O 1.242 0.669 0 O-C-N 122.486 -0.42 . . . . 0.0 110.063 158.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.48 ' HA ' ' N4 ' ' D' ' 4' ' ' ' DC' . 2.6 tt -86.14 155.75 3.38 Favored 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-N 114.434 -1.257 . . . . 0.0 109.214 -167.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.541 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.34 -47.1 62.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.123 -1.399 . . . . 0.0 113.023 160.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . 0.47 ' HB2' ' CD1' ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.76 -11.22 6.91 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.452 0.644 . . . . 0.0 110.904 -167.593 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.471 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.26 0.0 OUTLIER -128.54 11.78 6.32 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 119.176 -1.01 . . . . 0.0 110.547 -167.731 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 33.4 t -81.64 163.72 22.34 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -162.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.41 29.48 0.2 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.266 164.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.592 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.312 172.653 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.833 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.389 0 O4'-C1'-N19 109.321 1.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.833 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.619 1 P-O3'-C3' 107.792 -9.924 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.82 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.693 1 P-O3'-C3' 107.661 -10.033 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.807 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.782 1 P-O3'-C3' 107.823 -9.898 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.723 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.882 1 P-O3'-C3' 108.455 -9.371 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.491 HG11 " H1'" ' D' ' 5' ' ' ' DC' . 14.2 p . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.11 137.33 50.32 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.548 -161.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.8 t -60.92 151.24 30.81 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.986 163.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -129.23 -12.0 4.59 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 120.851 -1.156 . . . . 0.0 111.028 -172.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.528 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.76 -41.88 92.04 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 121.751 -0.593 . . . . 0.0 110.178 160.604 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 30.0 p -114.85 -55.67 2.46 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.837 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 135.07 -39.63 1.66 Allowed Glycine 0 CA--C 1.525 0.694 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.626 -169.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -61.65 155.48 22.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.161 0.505 . . . . 0.0 110.425 -166.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -75.53 142.45 42.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.306 -171.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 119.27 -66.43 0.4 Allowed Glycine 0 CA--C 1.527 0.828 0 N-CA-C 110.391 -1.083 . . . . 0.0 110.391 162.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.0 p-80 -102.03 173.65 6.29 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 122.459 -0.436 . . . . 0.0 110.432 -158.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.517 ' HB ' ' N4 ' ' D' ' 5' ' ' ' DC' . 0.7 OUTLIER -90.79 155.14 3.09 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.637 -168.15 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.528 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -47.13 -51.76 17.18 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.373 -1.285 . . . . 0.0 113.775 156.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.89 -8.73 2.38 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.401 0.619 . . . . 0.0 111.117 -166.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.462 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -130.97 11.03 5.07 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 119.039 -1.064 . . . . 0.0 110.225 -167.175 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.9 t -79.84 163.51 24.33 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -161.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.68 -24.65 8.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.448 167.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.711 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.276 -167.987 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.829 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.38 0 O4'-C1'-N19 109.331 1.914 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.829 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.596 1 P-O3'-C3' 107.786 -9.929 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.802 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.626 1 P-O3'-C3' 107.667 -10.028 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.798 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.74 1 P-O3'-C3' 107.823 -9.898 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.729 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.776 1 P-O3'-C3' 108.494 -9.339 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.506 HG13 ' C2 ' ' D' ' 5' ' ' ' DC' . 8.6 p . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . 0.511 ' HG3' ' CE1' ' E' ' 4' ' ' PHE . 0.0 OUTLIER -98.21 127.39 44.12 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.186 163.222 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.7 t -61.39 145.76 50.55 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.484 155.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . 0.511 ' CE1' ' HG3' ' E' ' 2' ' ' LYS . 1.5 m-85 -120.63 -14.49 8.6 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.133 -176.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.541 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.21 -41.55 88.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.333 166.464 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.4 p -111.83 -54.94 2.56 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.475 -1.239 . . . . 0.0 111.628 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.9 -35.76 2.33 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 -171.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -61.84 164.46 6.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.35 -0.425 . . . . 0.0 110.343 -170.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.63 131.96 34.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.308 -166.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 127.7 -63.2 0.61 Allowed Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 162.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -101.96 174.94 5.71 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.278 -0.543 . . . . 0.0 110.523 -157.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.511 HD11 ' C5 ' ' D' ' 4' ' ' ' DC' . 0.6 OUTLIER -88.84 153.27 3.25 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.478 -168.67 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.541 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -50.17 -47.29 54.51 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.073 -1.421 . . . . 0.0 113.382 158.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -8.06 2.27 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.466 0.65 . . . . 0.0 111.035 -166.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.47 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.252 0.0 OUTLIER -132.41 12.61 4.56 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 119.28 -0.968 . . . . 0.0 110.014 -164.757 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.6 t -84.13 164.82 18.95 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -158.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.69 -39.87 2.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.364 167.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.501 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.325 -170.014 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.826 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.32 0 O4'-C1'-N19 109.33 1.912 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.826 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.587 1 P-O3'-C3' 107.782 -9.931 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.797 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.688 1 P-O3'-C3' 107.642 -10.048 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.797 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.668 1 P-O3'-C3' 107.774 -9.939 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.729 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.819 1 P-O3'-C3' 108.468 -9.36 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.507 HG13 ' C2 ' ' D' ' 5' ' ' ' DC' . 9.5 p . . . . . 0 N--CA 1.475 0.809 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.29 127.1 39.95 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.272 162.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.7 t -61.59 146.48 48.75 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.518 157.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -121.64 -14.87 8.09 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.069 -175.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.54 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.01 -42.57 90.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.314 165.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -110.81 -55.45 2.48 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.663 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 128.72 -35.94 2.54 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 -170.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.79 157.15 18.67 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.232 -0.484 . . . . 0.0 110.262 -173.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -91.21 123.08 34.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.38 -162.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.14 51.46 0.99 Allowed Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 160.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -178.44 175.69 1.12 Allowed 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.459 -0.436 . . . . 0.0 110.433 158.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.518 ' HB ' ' N4 ' ' D' ' 5' ' ' ' DC' . 0.6 OUTLIER -90.14 154.4 3.15 Favored 'Isoleucine or valine' 0 C--O 1.245 0.864 0 CA-C-O 118.064 -0.97 . . . . 0.0 109.316 -167.534 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.8 -47.16 64.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 113.674 -1.603 . . . . 0.0 113.053 158.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . 0.461 ' HB2' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.37 -10.65 3.31 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.408 0.623 . . . . 0.0 111.41 -167.56 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.465 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.257 0.0 OUTLIER -130.29 14.43 5.6 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 119.01 -1.076 . . . . 0.0 110.468 -167.276 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.8 t -85.34 140.01 31.13 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.36 0.6 . . . . 0.0 109.849 -160.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -95.67 -34.88 11.79 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.389 171.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.591 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.251 -168.332 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.831 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.277 0 O4'-C1'-N19 109.297 1.872 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.831 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.646 1 P-O3'-C3' 107.808 -9.91 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.811 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.63 1 P-O3'-C3' 107.697 -10.003 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.797 " O5'" " C2'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.661 1 P-O3'-C3' 107.812 -9.907 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.725 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.818 1 P-O3'-C3' 108.468 -9.36 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.507 HG13 ' C2 ' ' D' ' 5' ' ' ' DC' . 4.8 p . . . . . 0 N--CA 1.477 0.913 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.69 121.86 43.28 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.254 166.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.2 t -61.85 147.05 47.81 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.413 156.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -123.12 -13.44 7.75 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.144 -175.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.536 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.31 -41.45 89.07 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.832 -0.542 . . . . 0.0 110.173 165.002 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' E' ' 18' ' ' ALA . 27.6 p -111.82 -55.52 2.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.423 -1.262 . . . . 0.0 111.766 177.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 129.15 -37.12 2.26 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.636 -0.985 . . . . 0.0 110.636 -170.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 9.8 mttm -61.79 150.78 36.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.277 -174.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.16 141.51 38.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.31 -166.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 125.9 -68.13 0.52 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 162.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -101.42 176.58 5.19 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 122.44 -0.447 . . . . 0.0 110.31 -158.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.513 ' HB ' ' N4 ' ' D' ' 5' ' ' ' DC' . 0.6 OUTLIER -88.93 154.13 3.19 Favored 'Isoleucine or valine' 0 C--O 1.243 0.719 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.672 -169.351 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.536 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -49.65 -48.63 49.23 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 113.971 -1.468 . . . . 0.0 113.44 158.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 2.5 tpt85 -60.54 -8.03 2.54 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 121.526 0.679 . . . . 0.0 110.874 -166.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.46 ' HB3' ' CG2' ' E' ' 12' ' ' ILE . 0.0 OUTLIER -136.03 12.03 3.34 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 118.927 -1.109 . . . . 0.0 109.65 -163.237 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 37.5 t -72.58 -72.0 0.26 Allowed 'General case' 0 C--O 1.245 0.854 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -158.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 20.2 ttp85 78.3 -54.86 0.49 Allowed 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 120.673 -1.267 . . . . 0.0 111.362 -155.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . 0.46 ' HB3' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.24 0.586 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.318 -168.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.802 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.26 0 O4'-C1'-N19 109.279 1.849 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.806 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.598 1 P-O3'-C3' 107.808 -9.91 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.813 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.683 1 P-O3'-C3' 107.693 -10.006 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.813 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.667 1 P-O3'-C3' 107.789 -9.926 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.731 " O5'" " C2'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.803 1 P-O3'-C3' 108.453 -9.373 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.488 ' N ' ' C2 ' ' D' ' 5' ' ' ' DC' . 9.8 p . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? -156.48 132.54 9.79 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.69 158.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.4 t -61.76 136.68 58.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.907 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -113.5 -13.17 12.83 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 114.67 -1.15 . . . . 0.0 111.193 -177.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.542 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.21 -49.51 77.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.455 166.946 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.6 p -102.72 -56.32 2.26 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.576 176.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 135.19 -29.6 2.91 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 -177.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.22 145.63 53.04 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.046 -0.577 . . . . 0.0 110.342 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.47 158.02 34.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.357 -166.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 60.93 48.81 84.39 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.619 -0.993 . . . . 0.0 110.619 161.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -171.25 170.6 5.95 Favored 'General case' 0 C--O 1.241 0.612 0 O-C-N 122.024 -0.692 . . . . 0.0 110.03 153.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.523 ' HB ' ' N4 ' ' D' ' 5' ' ' ' DC' . 0.5 OUTLIER -91.08 146.52 6.11 Favored 'Isoleucine or valine' 0 C--O 1.246 0.904 0 CA-C-O 117.724 -1.131 . . . . 0.0 109.125 -160.344 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.09 -51.12 56.53 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.726 -1.579 . . . . 0.0 113.257 158.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . 0.414 ' HA ' ' HD2' ' E' ' 14' ' ' ARG . 28.4 tpt85 -60.62 -8.54 2.94 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.274 0.559 . . . . 0.0 111.092 -167.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.471 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -130.64 17.47 5.28 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.313 -170.542 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.2 t -89.33 145.62 25.24 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.464 0.65 . . . . 0.0 109.716 -166.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 -36.83 9.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.487 175.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.527 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.427 -173.663 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.829 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.342 0 O4'-C1'-N19 109.312 1.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.829 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.591 1 P-O3'-C3' 107.784 -9.93 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.796 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.641 1 P-O3'-C3' 107.663 -10.031 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.796 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.728 1 P-O3'-C3' 107.844 -9.88 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.729 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.846 1 P-O3'-C3' 108.497 -9.336 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.519 HG13 ' C2 ' ' D' ' 5' ' ' ' DC' . 7.9 p . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . 0.517 ' HG3' ' CE2' ' E' ' 4' ' ' PHE . 0.0 OUTLIER -85.05 118.64 24.74 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.159 162.812 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 t -61.78 145.11 53.53 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.519 156.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . 0.517 ' CE2' ' HG3' ' E' ' 2' ' ' LYS . 2.4 m-85 -120.77 -14.4 8.55 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.029 -175.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.539 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.27 -42.94 92.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.345 166.046 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -110.09 -55.49 2.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.557 -1.202 . . . . 0.0 111.636 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 128.94 -36.12 2.48 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.565 -1.014 . . . . 0.0 110.565 -170.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -61.84 154.73 25.14 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.123 -0.538 . . . . 0.0 110.26 -173.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -90.33 123.61 34.23 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.323 -164.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.17 49.0 0.96 Allowed Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 160.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.0 p-80 -178.27 175.5 1.19 Allowed 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.481 -0.423 . . . . 0.0 110.348 158.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.516 ' HB ' ' N4 ' ' D' ' 5' ' ' ' DC' . 0.6 OUTLIER -89.93 153.89 3.19 Favored 'Isoleucine or valine' 0 C--O 1.246 0.873 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.273 -167.003 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.539 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.23 -48.13 62.16 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 113.735 -1.575 . . . . 0.0 113.153 158.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . 0.42 ' HB2' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.75 -8.47 3.02 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.35 0.595 . . . . 0.0 110.961 -166.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.494 ' ND2' HG21 ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -132.1 15.47 4.67 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.392 -167.774 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 t -86.3 164.56 17.04 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -161.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . 0.461 ' HG3' ' N ' ' E' ' 18' ' ' ALA . 1.3 ptt180 -129.2 -34.15 1.89 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.522 174.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . 0.461 ' N ' ' HG3' ' E' ' 17' ' ' ARG . . . . . . . . 0 C--O 1.239 0.551 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.365 -169.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.828 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.309 0 O4'-C1'-N19 109.363 1.954 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.828 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.603 1 P-O3'-C3' 107.817 -9.903 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.796 " C2'" " O5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.641 1 P-O3'-C3' 107.702 -9.999 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.796 " O5'" " C2'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.745 1 P-O3'-C3' 107.859 -9.867 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.73 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.841 1 P-O3'-C3' 108.477 -9.352 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.457 HG13 ' C2 ' ' D' ' 5' ' ' ' DC' . 8.9 p . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.62 125.74 47.04 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.221 -162.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 25.2 t -62.33 140.97 58.51 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.479 156.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -115.61 -14.61 11.46 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.232 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.54 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -58.85 -40.07 83.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.515 168.706 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -112.89 -56.38 2.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.328 -1.306 . . . . 0.0 111.685 175.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.77 14.93 12.77 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.048 -0.821 . . . . 0.0 111.048 -170.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.06 160.76 15.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.929 0.395 . . . . 0.0 110.241 166.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -92.07 130.47 37.8 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.341 -170.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 134.32 -57.1 0.7 Allowed Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 163.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -109.67 172.16 7.02 Favored 'General case' 0 C--O 1.24 0.554 0 O-C-N 122.556 -0.379 . . . . 0.0 110.323 -159.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.511 HD12 ' C5 ' ' D' ' 4' ' ' ' DC' . 0.6 OUTLIER -85.48 154.23 3.5 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-N 114.263 -1.335 . . . . 0.0 109.326 -170.163 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -50.13 -47.53 54.02 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.287 158.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . 0.456 ' HB2' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.99 -8.19 2.17 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.397 0.618 . . . . 0.0 111.1 -166.366 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.474 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.255 0.0 OUTLIER -131.47 13.34 5.0 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 119.349 -0.941 . . . . 0.0 110.098 -165.377 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.8 t -84.4 134.87 34.46 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.121 0.486 . . . . 0.0 109.756 -159.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -107.6 17.43 22.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.518 170.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.573 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.385 -173.356 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.827 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.338 0 O4'-C1'-N19 109.314 1.893 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.827 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.603 1 P-O3'-C3' 107.798 -9.919 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.802 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.746 1 P-O3'-C3' 107.734 -9.972 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.802 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.794 1 P-O3'-C3' 107.824 -9.897 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.727 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.801 1 P-O3'-C3' 108.437 -9.386 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.45 HG12 " C1'" ' D' ' 5' ' ' ' DC' . 8.0 p . . . . . 0 N--CA 1.473 0.691 0 CA-C-O 121.008 0.433 . . . . 0.0 109.868 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . 0.507 ' HG3' ' CE2' ' E' ' 4' ' ' PHE . 0.0 OUTLIER -107.13 134.08 50.78 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.241 -164.896 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.0 t -62.36 142.05 58.0 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.496 158.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . 0.507 ' CE2' ' HG3' ' E' ' 2' ' ' LYS . 1.0 OUTLIER -118.35 -13.68 9.8 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.206 -177.476 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.542 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.18 -43.64 92.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.465 166.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -108.91 -56.85 2.22 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.74 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.08 12.25 12.54 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -172.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.92 168.5 15.98 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 168.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -97.93 125.08 42.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.429 -171.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.42 50.16 3.04 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 162.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 45.9 p-80 -174.02 172.39 3.4 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 122.444 -0.445 . . . . 0.0 110.167 158.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.523 ' HB ' ' N4 ' ' D' ' 5' ' ' ' DC' . 0.6 OUTLIER -90.54 152.9 3.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.915 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.232 -165.277 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.43 -47.17 63.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 113.786 -1.552 . . . . 0.0 113.113 158.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -10.0 3.54 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.398 0.618 . . . . 0.0 111.159 -167.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.47 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.257 0.0 OUTLIER -130.7 14.53 5.38 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 118.982 -1.087 . . . . 0.0 110.524 -167.949 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.0 t -86.68 155.77 20.26 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.307 0.575 . . . . 0.0 109.848 -162.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.09 -27.34 4.21 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.518 176.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.555 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.38 -170.304 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.825 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.394 0 O4'-C1'-N19 109.353 1.941 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.825 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.578 1 P-O3'-C3' 107.784 -9.93 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.806 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.704 1 P-O3'-C3' 107.701 -9.999 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.806 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.639 1 P-O3'-C3' 107.812 -9.907 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.725 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.804 1 P-O3'-C3' 108.494 -9.338 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.52 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 87.5 t . . . . . 0 N--CA 1.474 0.752 0 CA-C-O 121.445 0.641 . . . . 0.0 109.858 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.52 138.9 53.04 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.459 -170.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 28.3 t -61.95 143.85 55.89 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.788 162.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -119.8 -13.42 9.09 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.189 -177.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.542 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.23 -41.53 88.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.38 166.421 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -112.22 -56.82 2.35 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.775 177.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 111.59 19.39 7.45 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -171.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -96.12 139.28 32.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.089 0.471 . . . . 0.0 110.294 168.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -64.29 137.85 58.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.354 -174.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.94 -68.22 0.47 Allowed Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.396 -1.081 . . . . 0.0 110.396 162.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.9 p-80 -98.98 174.84 6.15 Favored 'General case' 0 C--O 1.239 0.533 0 O-C-N 122.42 -0.459 . . . . 0.0 110.398 -158.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.509 ' HB ' ' N4 ' ' D' ' 5' ' ' ' DC' . 0.7 OUTLIER -89.75 153.17 3.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-N 114.695 -1.139 . . . . 0.0 109.197 -166.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.4 -47.63 62.87 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.89 -1.504 . . . . 0.0 113.152 158.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -9.37 2.57 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.406 0.622 . . . . 0.0 111.224 -167.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.468 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.259 0.0 OUTLIER -130.85 13.82 5.3 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 118.914 -1.114 . . . . 0.0 110.451 -167.12 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.5 t -84.55 153.24 23.37 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.095 0.474 . . . . 0.0 109.802 -160.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.94 -49.95 6.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.393 170.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.664 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.312 -168.685 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.829 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.268 0 O4'-C1'-N19 109.355 1.944 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.829 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.608 1.533 1 P-O3'-C3' 107.763 -9.948 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.804 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.621 1 P-O3'-C3' 107.69 -10.008 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.802 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.642 1 P-O3'-C3' 107.792 -9.923 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.726 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.808 1 P-O3'-C3' 108.427 -9.394 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.438 ' CG1' ' N ' ' E' ' 2' ' ' LYS . 2.8 p . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . 0.46 ' HG3' ' CE1' ' E' ' 4' ' ' PHE . 0.0 OUTLIER -86.14 135.05 33.75 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.737 -0.602 . . . . 0.0 110.838 155.92 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.3 t -59.24 150.9 24.39 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.91 159.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . 0.46 ' CE1' ' HG3' ' E' ' 2' ' ' LYS . 58.7 m-85 -129.94 -7.36 4.45 Favored 'General case' 0 C--O 1.246 0.87 0 O-C-N 120.552 -1.342 . . . . 0.0 111.61 -178.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.545 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -58.4 -39.48 79.78 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 121.451 -0.781 . . . . 0.0 110.28 160.85 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 26.4 p -115.7 -53.19 2.6 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.685 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.0 -28.74 3.63 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.596 -1.002 . . . . 0.0 110.596 -173.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.51 147.82 47.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.316 -0.442 . . . . 0.0 110.277 -167.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -76.47 125.71 29.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.305 -166.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 138.86 -66.67 0.52 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.439 -1.065 . . . . 0.0 110.439 163.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -98.22 176.93 5.55 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.42 -0.459 . . . . 0.0 110.404 -158.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.512 ' HB ' ' N4 ' ' D' ' 5' ' ' ' DC' . 0.8 OUTLIER -89.21 153.14 3.25 Favored 'Isoleucine or valine' 0 C--O 1.243 0.754 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.44 -170.042 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.545 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.82 -46.93 64.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 113.688 -1.596 . . . . 0.0 113.109 159.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -8.27 1.95 Allowed 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.512 0.672 . . . . 0.0 111.201 -166.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.464 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.253 0.0 OUTLIER -132.02 13.72 4.74 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.153 -164.834 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 28.0 t -84.44 126.57 33.37 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.159 0.504 . . . . 0.0 109.722 -157.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.24 -19.92 20.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.304 168.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.546 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.292 -168.697 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.82 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.355 0 O4'-C1'-N19 109.313 1.891 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.82 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.607 1 P-O3'-C3' 107.814 -9.905 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.81 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.696 1 P-O3'-C3' 107.721 -9.982 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.81 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.761 1 P-O3'-C3' 107.806 -9.911 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.726 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.837 1 P-O3'-C3' 108.466 -9.362 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.445 ' CG2' ' C2 ' ' D' ' 5' ' ' ' DC' . 34.7 m . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 121.117 0.484 . . . . 0.0 109.901 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.59 132.25 56.69 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.374 -165.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.6 t -62.08 142.46 57.54 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.593 162.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.52 -14.68 10.29 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.1 -177.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.524 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -58.97 -43.95 91.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.435 167.564 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.6 p -110.75 -55.93 2.42 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.589 178.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.81 15.21 11.19 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 -172.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.9 mttt -92.0 161.57 14.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.183 167.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -90.94 135.86 33.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.347 -167.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.77 51.1 4.39 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 162.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -175.72 172.36 2.55 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 122.513 -0.404 . . . . 0.0 110.313 158.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.517 HD12 ' C5 ' ' D' ' 4' ' ' ' DC' . 0.6 OUTLIER -86.63 155.97 3.32 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.569 -169.042 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.11 -49.93 59.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.278 -1.328 . . . . 0.0 112.391 156.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . 0.479 ' HA ' ' HD2' ' E' ' 14' ' ' ARG . 16.4 tpt85 -61.21 -22.79 65.09 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.938 -168.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.457 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.287 0.0 OUTLIER -115.78 27.07 9.54 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.538 -171.24 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.1 t -93.9 159.44 15.18 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.718 -165.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.75 28.26 1.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.401 168.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.464 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.414 -179.528 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.827 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.329 0 O4'-C1'-N19 109.331 1.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.827 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.59 1 P-O3'-C3' 107.78 -9.933 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.797 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.658 1 P-O3'-C3' 107.676 -10.02 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.797 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.71 1 P-O3'-C3' 107.817 -9.902 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.73 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.799 1 P-O3'-C3' 108.457 -9.369 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.468 HG11 " C1'" ' D' ' 5' ' ' ' DC' . 12.3 p . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.62 135.64 53.7 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.42 -165.123 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 t -61.69 142.69 57.05 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.728 161.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -119.59 -11.86 9.38 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.436 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.542 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -58.82 -42.44 89.17 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.862 -0.524 . . . . 0.0 110.4 166.024 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.5 p -110.39 -55.97 2.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.684 175.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 118.41 7.28 11.15 Favored Glycine 0 CA--C 1.52 0.405 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.206 -173.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.06 171.23 10.0 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.521 -0.339 . . . . 0.0 110.219 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -95.95 137.63 34.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.355 -167.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.73 48.59 10.04 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 162.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.8 p-80 -171.98 169.59 5.62 Favored 'General case' 0 C--O 1.239 0.524 0 O-C-N 122.431 -0.452 . . . . 0.0 110.289 156.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.514 HD13 ' C5 ' ' D' ' 4' ' ' ' DC' . 0.6 OUTLIER -88.98 154.44 3.17 Favored 'Isoleucine or valine' 0 C--O 1.246 0.89 0 CA-C-N 114.616 -1.174 . . . . 0.0 109.089 -167.599 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -52.02 -46.06 64.84 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 113.79 -1.55 . . . . 0.0 113.009 158.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.37 -11.77 4.81 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.392 0.615 . . . . 0.0 111.404 -167.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.463 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.259 0.0 OUTLIER -127.53 13.85 7.04 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.557 -167.367 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.0 t -87.08 165.55 15.7 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 -160.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.06 28.4 0.92 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.26 167.397 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.557 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.369 169.961 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? . . . . . 0 C--O 1.234 0.248 0 CA-C-O 120.634 0.254 . . . . 0.0 110.502 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.9 t -61.34 148.32 41.81 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.764 164.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -125.88 -11.24 6.6 Favored 'General case' 0 C--O 1.245 0.863 0 O-C-N 120.534 -1.354 . . . . 0.0 111.302 -175.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 25.0 t-20 -59.26 -44.14 92.42 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.507 -0.746 . . . . 0.0 110.261 162.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.4 p -112.31 -50.98 2.87 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.679 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 118.01 7.8 11.2 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 -178.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -90.22 169.16 11.37 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.258 -0.471 . . . . 0.0 110.411 178.206 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.4 138.6 31.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.415 -172.029 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.85 -65.29 0.37 Allowed Glycine 0 CA--C 1.528 0.868 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 164.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -100.62 172.32 7.17 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 122.485 -0.421 . . . . 0.0 110.513 -158.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.703 HG23 ' H ' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -87.2 155.84 3.26 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.714 -169.882 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -48.33 -52.52 21.21 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.31 -1.314 . . . . 0.0 113.13 156.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.649 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.35 -24.21 66.31 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.846 -167.378 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.703 ' H ' HG23 ' E' ' 12' ' ' ILE 0.275 0.3 OUTLIER -115.88 11.84 15.63 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.467 -171.386 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -65.21 -147.94 0.01 OUTLIER 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.757 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.65 -38.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.95 -0.469 . . . . 0.0 110.353 -173.259 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.581 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.435 171.435 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.307 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.8 t -62.17 143.69 56.42 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.57 160.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -119.1 -13.56 9.37 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 114.316 -1.311 . . . . 0.0 111.255 -177.081 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 26.1 t-20 -59.15 -41.71 88.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.289 166.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -111.79 -56.4 2.39 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.471 -1.241 . . . . 0.0 111.707 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 106.92 22.97 7.31 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -169.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -93.24 173.71 7.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.45 -0.375 . . . . 0.0 110.299 167.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.15 119.65 38.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.291 -168.225 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.84 57.16 2.08 Favored Glycine 0 CA--C 1.529 0.925 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 163.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -175.3 171.82 2.83 Favored 'General case' 0 C--O 1.238 0.479 0 O-C-N 122.426 -0.455 . . . . 0.0 110.015 157.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.591 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -89.2 151.77 3.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.748 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.343 -166.009 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -50.68 -47.03 58.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.973 -1.467 . . . . 0.0 113.258 159.158 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.591 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.39 -7.9 2.33 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.547 0.689 . . . . 0.0 110.983 -165.87 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -133.48 13.98 4.11 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.009 -164.218 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 44.8 t -78.86 -117.7 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -156.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 170.71 -73.09 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 120.824 -1.172 . . . . 0.0 109.853 -165.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.564 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.774 -179.744 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.312 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.4 t -62.1 148.47 44.18 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.562 159.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -125.01 -13.42 6.84 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.177 -175.637 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.54 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 25.5 t-20 -58.7 -40.34 83.36 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 121.611 -0.68 . . . . 0.0 110.364 164.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.8 p -114.15 -55.06 2.54 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.665 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 133.87 -39.89 1.66 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.556 -1.017 . . . . 0.0 110.556 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -62.26 165.57 5.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.237 -0.482 . . . . 0.0 110.38 -170.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.07 129.98 44.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.355 -166.413 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.75 45.24 2.13 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 110.393 -1.083 . . . . 0.0 110.393 161.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.2 p-80 -177.1 166.75 2.42 Favored 'General case' 0 C--O 1.242 0.669 0 O-C-N 122.486 -0.42 . . . . 0.0 110.063 158.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.676 HD13 ' CB ' ' E' ' 14' ' ' ARG . 2.6 tt -86.14 155.75 3.38 Favored 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-N 114.434 -1.257 . . . . 0.0 109.214 -167.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.34 -47.1 62.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.123 -1.399 . . . . 0.0 113.023 160.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.676 ' CB ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.76 -11.22 6.91 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.452 0.644 . . . . 0.0 110.904 -167.593 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.439 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.26 0.1 OUTLIER -128.54 11.78 6.32 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 119.176 -1.01 . . . . 0.0 110.547 -167.731 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 33.4 t -81.64 163.72 22.34 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -162.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.41 29.48 0.2 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.266 164.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.592 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.312 172.653 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.328 0 CA-C-O 120.493 0.187 . . . . 0.0 110.548 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.8 t -60.92 151.24 30.81 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.986 163.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -129.23 -12.0 4.59 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 120.851 -1.156 . . . . 0.0 111.028 -172.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 27.5 t-20 -59.76 -41.88 92.04 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 121.751 -0.593 . . . . 0.0 110.178 160.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 30.0 p -114.85 -55.67 2.46 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.837 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 135.07 -39.63 1.66 Allowed Glycine 0 CA--C 1.525 0.694 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.626 -169.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -61.65 155.48 22.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.161 0.505 . . . . 0.0 110.425 -166.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -75.53 142.45 42.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.306 -171.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 119.27 -66.43 0.4 Allowed Glycine 0 CA--C 1.527 0.828 0 N-CA-C 110.391 -1.083 . . . . 0.0 110.391 162.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.0 p-80 -102.03 173.65 6.29 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 122.459 -0.436 . . . . 0.0 110.432 -158.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.686 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.7 OUTLIER -90.79 155.14 3.09 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.637 -168.15 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.527 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -47.13 -51.76 17.18 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.373 -1.285 . . . . 0.0 113.775 156.319 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.686 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.89 -8.73 2.38 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.401 0.619 . . . . 0.0 111.117 -166.989 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.431 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -130.97 11.03 5.07 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 119.039 -1.064 . . . . 0.0 110.225 -167.175 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.9 t -79.84 163.51 24.33 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -161.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.68 -24.65 8.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.448 167.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.711 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.276 -167.987 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' E' E ' 2' ' ' LYS . . . . . 0.51 ' HG3' ' CE1' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.433 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.7 t -61.39 145.76 50.55 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.484 155.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 4' ' ' PHE . . . . . 0.51 ' CE1' ' HG3' ' E' ' 2' ' ' LYS . 1.5 m-85 -120.63 -14.49 8.6 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.133 -176.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.531 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 24.6 t-20 -59.21 -41.55 88.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.333 166.464 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.4 p -111.83 -54.94 2.56 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.475 -1.239 . . . . 0.0 111.628 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.9 -35.76 2.33 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 -171.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -61.84 164.46 6.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.35 -0.425 . . . . 0.0 110.343 -170.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.63 131.96 34.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.308 -166.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 127.7 -63.2 0.61 Allowed Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 162.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -101.96 174.94 5.71 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.278 -0.543 . . . . 0.0 110.523 -157.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.606 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -88.84 153.27 3.25 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.478 -168.67 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.531 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -50.17 -47.29 54.51 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.073 -1.421 . . . . 0.0 113.382 158.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.606 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.19 -8.06 2.27 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.466 0.65 . . . . 0.0 111.035 -166.086 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.438 ' H ' ' C ' ' E' ' 13' ' ' ALA 0.252 0.0 OUTLIER -132.41 12.61 4.56 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 119.28 -0.968 . . . . 0.0 110.014 -164.757 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.6 t -84.13 164.82 18.95 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -158.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.69 -39.87 2.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.364 167.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.501 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.325 -170.014 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.44 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.7 t -61.59 146.48 48.75 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.518 157.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -121.64 -14.87 8.09 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.069 -175.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.531 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 24.9 t-20 -59.01 -42.57 90.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.314 165.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -110.81 -55.45 2.48 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.663 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 128.72 -35.94 2.54 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 -170.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.79 157.15 18.67 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.232 -0.484 . . . . 0.0 110.262 -173.018 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -91.21 123.08 34.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.38 -162.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.14 51.46 0.99 Allowed Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 160.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -178.44 175.69 1.12 Allowed 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.459 -0.436 . . . . 0.0 110.433 158.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.664 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -90.14 154.4 3.15 Favored 'Isoleucine or valine' 0 C--O 1.245 0.864 0 CA-C-O 118.064 -0.97 . . . . 0.0 109.316 -167.534 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.531 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.8 -47.16 64.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 113.674 -1.603 . . . . 0.0 113.053 158.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.664 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.37 -10.65 3.31 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.408 0.623 . . . . 0.0 111.41 -167.56 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.432 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.257 0.0 OUTLIER -130.29 14.43 5.6 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 119.01 -1.076 . . . . 0.0 110.468 -167.276 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.8 t -85.34 140.01 31.13 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.36 0.6 . . . . 0.0 109.849 -160.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -95.67 -34.88 11.79 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.389 171.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.591 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.251 -168.332 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.365 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.2 t -61.85 147.05 47.81 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.413 156.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -123.12 -13.44 7.75 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.144 -175.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 25.8 t-20 -59.31 -41.45 89.07 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.832 -0.542 . . . . 0.0 110.173 165.002 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -111.82 -55.52 2.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.423 -1.262 . . . . 0.0 111.766 177.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 129.15 -37.12 2.26 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.636 -0.985 . . . . 0.0 110.636 -170.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 9.8 mttm -61.79 150.78 36.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.277 -174.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.16 141.51 38.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.31 -166.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 125.9 -68.13 0.52 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 162.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -101.42 176.58 5.19 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 122.44 -0.447 . . . . 0.0 110.31 -158.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.599 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -88.93 154.13 3.19 Favored 'Isoleucine or valine' 0 C--O 1.243 0.719 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.672 -169.351 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -49.65 -48.63 49.23 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 113.971 -1.468 . . . . 0.0 113.44 158.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.599 ' H ' HG12 ' E' ' 12' ' ' ILE . 2.5 tpt85 -60.54 -8.03 2.54 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 121.526 0.679 . . . . 0.0 110.874 -166.127 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.444 ' H ' ' C ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -136.03 12.03 3.34 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 118.927 -1.109 . . . . 0.0 109.65 -163.237 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 37.5 t -72.58 -72.0 0.26 Allowed 'General case' 0 C--O 1.245 0.854 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -158.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 20.2 ttp85 78.3 -54.86 0.49 Allowed 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 120.673 -1.267 . . . . 0.0 111.362 -155.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.586 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.318 -168.258 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' E' E ' 2' ' ' LYS . . . . . 0.527 ' HA ' ' H ' ' E' ' 10' ' ' GLY . 1.3 ptpp? . . . . . 0 N--CA 1.465 0.287 0 CA-C-O 121.441 0.639 . . . . 0.0 109.69 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.4 t -61.76 136.68 58.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.907 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -113.5 -13.17 12.83 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 114.67 -1.15 . . . . 0.0 111.193 -177.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.525 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 22.6 t-20 -59.21 -49.51 77.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.455 166.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.6 p -102.72 -56.32 2.26 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.576 176.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 135.19 -29.6 2.91 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 -177.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.22 145.63 53.04 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.046 -0.577 . . . . 0.0 110.342 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.47 158.02 34.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.357 -166.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 10' ' ' GLY . . . . . 0.527 ' H ' ' HA ' ' E' ' 2' ' ' LYS . . . 60.93 48.81 84.39 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.619 -0.993 . . . . 0.0 110.619 161.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -171.25 170.6 5.95 Favored 'General case' 0 C--O 1.241 0.612 0 O-C-N 122.024 -0.692 . . . . 0.0 110.03 153.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.64 ' CG1' ' H ' ' E' ' 14' ' ' ARG . 0.5 OUTLIER -91.08 146.52 6.11 Favored 'Isoleucine or valine' 0 C--O 1.246 0.904 0 CA-C-O 117.724 -1.131 . . . . 0.0 109.125 -160.344 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.525 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.09 -51.12 56.53 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.726 -1.579 . . . . 0.0 113.257 158.1 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.64 ' H ' ' CG1' ' E' ' 12' ' ' ILE . 28.4 tpt85 -60.62 -8.54 2.94 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.274 0.559 . . . . 0.0 111.092 -167.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.443 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.1 OUTLIER -130.64 17.47 5.28 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.313 -170.542 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.2 t -89.33 145.62 25.24 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.464 0.65 . . . . 0.0 109.716 -166.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 -36.83 9.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.487 175.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.527 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.427 -173.663 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' E' E ' 2' ' ' LYS . . . . . 0.517 ' HG3' ' CE2' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.418 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 t -61.78 145.11 53.53 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.519 156.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 4' ' ' PHE . . . . . 0.517 ' CE2' ' HG3' ' E' ' 2' ' ' LYS . 2.4 m-85 -120.77 -14.4 8.55 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.029 -175.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.529 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 23.7 t-20 -59.27 -42.94 92.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.345 166.046 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -110.09 -55.49 2.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.557 -1.202 . . . . 0.0 111.636 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 128.94 -36.12 2.48 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.565 -1.014 . . . . 0.0 110.565 -170.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -61.84 154.73 25.14 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.123 -0.538 . . . . 0.0 110.26 -173.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -90.33 123.61 34.23 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.323 -164.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.17 49.0 0.96 Allowed Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 160.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.0 p-80 -178.27 175.5 1.19 Allowed 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.481 -0.423 . . . . 0.0 110.348 158.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.632 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -89.93 153.89 3.19 Favored 'Isoleucine or valine' 0 C--O 1.246 0.873 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.273 -167.003 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.529 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.23 -48.13 62.16 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 113.735 -1.575 . . . . 0.0 113.153 158.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.632 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.75 -8.47 3.02 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.35 0.595 . . . . 0.0 110.961 -166.579 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.438 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -132.1 15.47 4.67 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.392 -167.774 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 t -86.3 164.56 17.04 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -161.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 17' ' ' ARG . . . . . 0.444 ' HG3' ' N ' ' E' ' 18' ' ' ALA . 1.3 ptt180 -129.2 -34.15 1.89 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.522 174.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 18' ' ' ALA . . . . . 0.444 ' N ' ' HG3' ' E' ' 17' ' ' ARG . . . . . . . . 0 C--O 1.239 0.551 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.365 -169.233 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.39 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 25.2 t -62.33 140.97 58.51 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.479 156.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -115.61 -14.61 11.46 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.232 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.53 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 24.0 t-20 -58.85 -40.07 83.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.515 168.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -112.89 -56.38 2.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.328 -1.306 . . . . 0.0 111.685 175.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.77 14.93 12.77 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.048 -0.821 . . . . 0.0 111.048 -170.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.06 160.76 15.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.929 0.395 . . . . 0.0 110.241 166.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -92.07 130.47 37.8 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.341 -170.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 134.32 -57.1 0.7 Allowed Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 163.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -109.67 172.16 7.02 Favored 'General case' 0 C--O 1.24 0.554 0 O-C-N 122.556 -0.379 . . . . 0.0 110.323 -159.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.61 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -85.48 154.23 3.5 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-N 114.263 -1.335 . . . . 0.0 109.326 -170.163 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.53 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -50.13 -47.53 54.02 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.287 158.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.61 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.99 -8.19 2.17 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.397 0.618 . . . . 0.0 111.1 -166.366 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.441 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.255 0.0 OUTLIER -131.47 13.34 5.0 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 119.349 -0.941 . . . . 0.0 110.098 -165.377 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.8 t -84.4 134.87 34.46 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.121 0.486 . . . . 0.0 109.756 -159.233 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -107.6 17.43 22.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.518 170.28 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.573 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.385 -173.356 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' E' E ' 2' ' ' LYS . . . . . 0.505 ' HG3' ' CE2' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.326 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.0 t -62.36 142.05 58.0 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.496 158.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 4' ' ' PHE . . . . . 0.505 ' CE2' ' HG3' ' E' ' 2' ' ' LYS . 1.0 OUTLIER -118.35 -13.68 9.8 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.206 -177.476 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.53 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 23.1 t-20 -59.18 -43.64 92.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.465 166.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -108.91 -56.85 2.22 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.74 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.08 12.25 12.54 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -172.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.92 168.5 15.98 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 168.453 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -97.93 125.08 42.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.429 -171.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.42 50.16 3.04 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 162.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 45.9 p-80 -174.02 172.39 3.4 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 122.444 -0.445 . . . . 0.0 110.167 158.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.635 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -90.54 152.9 3.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.915 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.232 -165.277 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.53 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.43 -47.17 63.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 113.786 -1.552 . . . . 0.0 113.113 158.204 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.635 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.88 -10.0 3.54 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.398 0.618 . . . . 0.0 111.159 -167.244 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.439 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.257 0.0 OUTLIER -130.7 14.53 5.38 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 118.982 -1.087 . . . . 0.0 110.524 -167.949 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.0 t -86.68 155.77 20.26 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.307 0.575 . . . . 0.0 109.848 -162.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.09 -27.34 4.21 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.518 176.415 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.555 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.38 -170.304 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.236 0 N-CA-C 110.459 -0.2 . . . . 0.0 110.459 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 28.3 t -61.95 143.85 55.89 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.788 162.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -119.8 -13.42 9.09 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.189 -177.404 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.532 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 25.2 t-20 -59.23 -41.53 88.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.38 166.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -112.22 -56.82 2.35 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.775 177.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 111.59 19.39 7.45 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -171.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -96.12 139.28 32.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.089 0.471 . . . . 0.0 110.294 168.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -64.29 137.85 58.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.354 -174.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.94 -68.22 0.47 Allowed Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.396 -1.081 . . . . 0.0 110.396 162.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.9 p-80 -98.98 174.84 6.15 Favored 'General case' 0 C--O 1.239 0.533 0 O-C-N 122.42 -0.459 . . . . 0.0 110.398 -158.308 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.685 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.7 OUTLIER -89.75 153.17 3.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-N 114.695 -1.139 . . . . 0.0 109.197 -166.951 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.532 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.4 -47.63 62.87 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.89 -1.504 . . . . 0.0 113.152 158.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.685 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.61 -9.37 2.57 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.406 0.622 . . . . 0.0 111.224 -167.085 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.438 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.259 0.0 OUTLIER -130.85 13.82 5.3 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 118.914 -1.114 . . . . 0.0 110.451 -167.12 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.5 t -84.55 153.24 23.37 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.095 0.474 . . . . 0.0 109.802 -160.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.94 -49.95 6.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.393 170.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.664 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.312 -168.685 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' E' E ' 2' ' ' LYS . . . . . 0.469 ' HG3' ' CE1' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.215 0 CA-C-O 121.248 0.546 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.3 t -59.24 150.9 24.39 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.91 159.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 4' ' ' PHE . . . . . 0.469 ' CE1' ' HG3' ' E' ' 2' ' ' LYS . 58.7 m-85 -129.94 -7.36 4.45 Favored 'General case' 0 C--O 1.246 0.87 0 O-C-N 120.552 -1.342 . . . . 0.0 111.61 -178.286 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.551 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 28.0 t-20 -58.4 -39.48 79.78 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 121.451 -0.781 . . . . 0.0 110.28 160.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 26.4 p -115.7 -53.19 2.6 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.685 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.0 -28.74 3.63 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.596 -1.002 . . . . 0.0 110.596 -173.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.51 147.82 47.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.316 -0.442 . . . . 0.0 110.277 -167.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -76.47 125.71 29.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.305 -166.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 138.86 -66.67 0.52 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.439 -1.065 . . . . 0.0 110.439 163.18 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -98.22 176.93 5.55 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.42 -0.459 . . . . 0.0 110.404 -158.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.655 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.8 OUTLIER -89.21 153.14 3.25 Favored 'Isoleucine or valine' 0 C--O 1.243 0.754 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.44 -170.042 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.551 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.82 -46.93 64.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 113.688 -1.596 . . . . 0.0 113.109 159.706 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.655 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.68 -8.27 1.95 Allowed 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.512 0.672 . . . . 0.0 111.201 -166.443 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' E' ' 13' ' ' ALA 0.253 0.0 OUTLIER -132.02 13.72 4.74 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.153 -164.834 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 28.0 t -84.44 126.57 33.37 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.159 0.504 . . . . 0.0 109.722 -157.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.24 -19.92 20.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.304 168.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.546 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.292 -168.697 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.22 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.6 t -62.08 142.46 57.54 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.593 162.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.52 -14.68 10.29 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.1 -177.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 23.2 t-20 -58.97 -43.95 91.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.435 167.564 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.6 p -110.75 -55.93 2.42 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.589 178.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.81 15.21 11.19 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 -172.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.9 mttt -92.0 161.57 14.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.183 167.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -90.94 135.86 33.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.347 -167.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.77 51.1 4.39 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 162.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -175.72 172.36 2.55 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 122.513 -0.404 . . . . 0.0 110.313 158.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.769 HG23 ' H ' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -86.63 155.97 3.32 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.569 -169.042 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.527 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.11 -49.93 59.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.278 -1.328 . . . . 0.0 112.391 156.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.657 ' H ' HG12 ' E' ' 12' ' ' ILE . 16.4 tpt85 -61.21 -22.79 65.09 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.938 -168.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.769 ' H ' HG23 ' E' ' 12' ' ' ILE 0.287 0.2 OUTLIER -115.78 27.07 9.54 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.538 -171.24 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.1 t -93.9 159.44 15.18 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.718 -165.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 17' ' ' ARG . . . . . 0.43 ' O ' ' HB3' ' E' ' 18' ' ' ALA . 0.0 OUTLIER -145.75 28.26 1.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.401 168.851 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' E' E ' 18' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' E' ' 17' ' ' ARG . . . . . . . . 0 C--O 1.238 0.464 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.414 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.324 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 t -61.69 142.69 57.05 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.728 161.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -119.59 -11.86 9.38 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.436 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.53 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 24.2 t-20 -58.82 -42.44 89.17 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.862 -0.524 . . . . 0.0 110.4 166.024 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.5 p -110.39 -55.97 2.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.684 175.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 118.41 7.28 11.15 Favored Glycine 0 CA--C 1.52 0.405 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.206 -173.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.06 171.23 10.0 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.521 -0.339 . . . . 0.0 110.219 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -95.95 137.63 34.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.355 -167.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.73 48.59 10.04 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 162.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.8 p-80 -171.98 169.59 5.62 Favored 'General case' 0 C--O 1.239 0.524 0 O-C-N 122.431 -0.452 . . . . 0.0 110.289 156.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.656 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -88.98 154.44 3.17 Favored 'Isoleucine or valine' 0 C--O 1.246 0.89 0 CA-C-N 114.616 -1.174 . . . . 0.0 109.089 -167.599 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.53 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -52.02 -46.06 64.84 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 113.79 -1.55 . . . . 0.0 113.009 158.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.656 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.37 -11.77 4.81 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.392 0.615 . . . . 0.0 111.404 -167.559 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.435 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.259 0.0 OUTLIER -127.53 13.85 7.04 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.557 -167.367 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.0 t -87.08 165.55 15.7 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 -160.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.06 28.4 0.92 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.26 167.397 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.557 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.369 169.961 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.83 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.301 0 O4'-C1'-N19 109.329 1.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.842 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.62 1 P-O3'-C3' 107.798 -9.918 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.845 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.649 1 P-O3'-C3' 107.666 -10.029 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.845 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.648 1 P-O3'-C3' 107.855 -9.871 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.761 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.801 1 P-O3'-C3' 108.471 -9.358 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.448 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 11.1 p . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -116.84 142.25 47.17 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.502 -162.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.9 t -61.34 148.32 41.81 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.764 164.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 4' ' ' PHE . . . . . 0.409 ' HB2' ' H42' ' D' ' 2' ' ' ' DC' . 13.0 m-85 -125.88 -11.24 6.6 Favored 'General case' 0 C--O 1.245 0.863 0 O-C-N 120.534 -1.354 . . . . 0.0 111.302 -175.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 25.0 t-20 -59.26 -44.14 92.42 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.507 -0.746 . . . . 0.0 110.261 162.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.4 p -112.31 -50.98 2.87 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.679 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 118.01 7.8 11.2 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 -178.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -90.22 169.16 11.37 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.258 -0.471 . . . . 0.0 110.411 178.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.4 138.6 31.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.415 -172.029 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.85 -65.29 0.37 Allowed Glycine 0 CA--C 1.528 0.868 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 164.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -100.62 172.32 7.17 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 122.485 -0.421 . . . . 0.0 110.513 -158.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.703 HG23 ' H ' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -87.2 155.84 3.26 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.714 -169.882 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.606 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -48.33 -52.52 21.21 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.31 -1.314 . . . . 0.0 113.13 156.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.649 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.35 -24.21 66.31 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.846 -167.378 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.703 ' H ' HG23 ' E' ' 12' ' ' ILE 0.275 0.3 OUTLIER -115.88 11.84 15.63 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.467 -171.386 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -65.21 -147.94 0.01 OUTLIER 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.757 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.65 -38.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.95 -0.469 . . . . 0.0 110.353 -173.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.581 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.435 171.435 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.828 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.307 0 O4'-C1'-N19 109.321 1.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.832 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.539 1 P-O3'-C3' 107.796 -9.92 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.832 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.681 1 P-O3'-C3' 107.701 -9.999 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.832 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.682 1 P-O3'-C3' 107.811 -9.908 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.759 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.756 1 P-O3'-C3' 108.411 -9.407 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.577 HG21 ' O2 ' ' D' ' 4' ' ' ' DC' . 26.8 m . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.74 131.55 54.83 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.354 -165.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.8 t -62.17 143.69 56.42 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.57 160.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -119.1 -13.56 9.37 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 114.316 -1.311 . . . . 0.0 111.255 -177.081 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 26.1 t-20 -59.15 -41.71 88.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.289 166.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -111.79 -56.4 2.39 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.471 -1.241 . . . . 0.0 111.707 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 106.92 22.97 7.31 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -169.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -93.24 173.71 7.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.45 -0.375 . . . . 0.0 110.299 167.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.15 119.65 38.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.291 -168.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.84 57.16 2.08 Favored Glycine 0 CA--C 1.529 0.925 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 163.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -175.3 171.82 2.83 Favored 'General case' 0 C--O 1.238 0.479 0 O-C-N 122.426 -0.455 . . . . 0.0 110.015 157.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.591 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -89.2 151.77 3.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.748 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.343 -166.009 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.624 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -50.68 -47.03 58.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.973 -1.467 . . . . 0.0 113.258 159.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.591 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.39 -7.9 2.33 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.547 0.689 . . . . 0.0 110.983 -165.87 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -133.48 13.98 4.11 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.009 -164.218 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 44.8 t -78.86 -117.7 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -156.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 170.71 -73.09 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 120.824 -1.172 . . . . 0.0 109.853 -165.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.564 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.774 -179.744 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.831 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.312 0 O4'-C1'-N19 109.335 1.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.831 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.636 1 P-O3'-C3' 107.791 -9.924 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.83 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.695 1 P-O3'-C3' 107.71 -9.991 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.83 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.758 1 P-O3'-C3' 107.794 -9.922 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.757 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.801 1 P-O3'-C3' 108.479 -9.351 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.623 HG22 ' H ' ' E' ' 2' ' ' LYS . 9.9 p . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.623 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -97.85 129.09 44.83 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.409 -161.528 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.4 t -62.1 148.47 44.18 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.562 159.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -125.01 -13.42 6.84 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.177 -175.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.54 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 25.5 t-20 -58.7 -40.34 83.36 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 121.611 -0.68 . . . . 0.0 110.364 164.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.8 p -114.15 -55.06 2.54 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.665 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 133.87 -39.89 1.66 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.556 -1.017 . . . . 0.0 110.556 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -62.26 165.57 5.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.237 -0.482 . . . . 0.0 110.38 -170.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.07 129.98 44.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.355 -166.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.75 45.24 2.13 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 110.393 -1.083 . . . . 0.0 110.393 161.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.2 p-80 -177.1 166.75 2.42 Favored 'General case' 0 C--O 1.242 0.669 0 O-C-N 122.486 -0.42 . . . . 0.0 110.063 158.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.676 HD13 ' CB ' ' E' ' 14' ' ' ARG . 2.6 tt -86.14 155.75 3.38 Favored 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-N 114.434 -1.257 . . . . 0.0 109.214 -167.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.62 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.34 -47.1 62.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.123 -1.399 . . . . 0.0 113.023 160.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.676 ' CB ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.76 -11.22 6.91 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.452 0.644 . . . . 0.0 110.904 -167.593 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.439 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.26 0.1 OUTLIER -128.54 11.78 6.32 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 119.176 -1.01 . . . . 0.0 110.547 -167.731 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 33.4 t -81.64 163.72 22.34 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -162.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.41 29.48 0.2 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.266 164.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.592 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.312 172.653 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.833 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.389 0 O4'-C1'-N19 109.321 1.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.848 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.619 1 P-O3'-C3' 107.792 -9.924 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.855 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.693 1 P-O3'-C3' 107.661 -10.033 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.855 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.782 1 P-O3'-C3' 107.823 -9.898 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.765 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.882 1 P-O3'-C3' 108.455 -9.371 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.582 HG12 " H1'" ' D' ' 5' ' ' ' DC' . 14.2 p . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.11 137.33 50.32 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.548 -161.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.8 t -60.92 151.24 30.81 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.986 163.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -129.23 -12.0 4.59 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 120.851 -1.156 . . . . 0.0 111.028 -172.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 27.5 t-20 -59.76 -41.88 92.04 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 121.751 -0.593 . . . . 0.0 110.178 160.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 30.0 p -114.85 -55.67 2.46 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.837 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 135.07 -39.63 1.66 Allowed Glycine 0 CA--C 1.525 0.694 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.626 -169.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -61.65 155.48 22.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.161 0.505 . . . . 0.0 110.425 -166.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -75.53 142.45 42.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.306 -171.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 119.27 -66.43 0.4 Allowed Glycine 0 CA--C 1.527 0.828 0 N-CA-C 110.391 -1.083 . . . . 0.0 110.391 162.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.0 p-80 -102.03 173.65 6.29 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 122.459 -0.436 . . . . 0.0 110.432 -158.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.686 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.7 OUTLIER -90.79 155.14 3.09 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.637 -168.15 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.596 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -47.13 -51.76 17.18 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.373 -1.285 . . . . 0.0 113.775 156.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.686 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.89 -8.73 2.38 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.401 0.619 . . . . 0.0 111.117 -166.989 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.431 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -130.97 11.03 5.07 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 119.039 -1.064 . . . . 0.0 110.225 -167.175 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.9 t -79.84 163.51 24.33 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -161.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.68 -24.65 8.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.448 167.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.711 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.276 -167.987 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.829 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.38 0 O4'-C1'-N19 109.331 1.914 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.829 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.596 1 P-O3'-C3' 107.786 -9.929 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.836 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.626 1 P-O3'-C3' 107.667 -10.028 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.836 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.74 1 P-O3'-C3' 107.823 -9.898 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.762 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.776 1 P-O3'-C3' 108.494 -9.339 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.73 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 8.6 p . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.576 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -98.21 127.39 44.12 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.186 163.222 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.7 t -61.39 145.76 50.55 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.484 155.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 4' ' ' PHE . . . . . 0.51 ' CE1' ' HG3' ' E' ' 2' ' ' LYS . 1.5 m-85 -120.63 -14.49 8.6 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.133 -176.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.531 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 24.6 t-20 -59.21 -41.55 88.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.333 166.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.4 p -111.83 -54.94 2.56 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.475 -1.239 . . . . 0.0 111.628 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.9 -35.76 2.33 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 -171.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -61.84 164.46 6.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.35 -0.425 . . . . 0.0 110.343 -170.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.63 131.96 34.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.308 -166.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 127.7 -63.2 0.61 Allowed Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 162.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -101.96 174.94 5.71 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.278 -0.543 . . . . 0.0 110.523 -157.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.606 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -88.84 153.27 3.25 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.478 -168.67 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.62 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -50.17 -47.29 54.51 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.073 -1.421 . . . . 0.0 113.382 158.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.606 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.19 -8.06 2.27 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.466 0.65 . . . . 0.0 111.035 -166.086 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.438 ' H ' ' C ' ' E' ' 13' ' ' ALA 0.252 0.0 OUTLIER -132.41 12.61 4.56 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 119.28 -0.968 . . . . 0.0 110.014 -164.757 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.6 t -84.13 164.82 18.95 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -158.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.69 -39.87 2.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.364 167.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.501 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.325 -170.014 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.826 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.32 0 O4'-C1'-N19 109.33 1.912 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.833 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.587 1 P-O3'-C3' 107.782 -9.931 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.833 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.688 1 P-O3'-C3' 107.642 -10.048 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.827 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.668 1 P-O3'-C3' 107.774 -9.939 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.76 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.611 1.819 1 P-O3'-C3' 108.468 -9.36 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.76 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 9.5 p . . . . . 0 N--CA 1.475 0.809 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.51 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -94.29 127.1 39.95 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.272 162.743 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.7 t -61.59 146.48 48.75 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.518 157.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -121.64 -14.87 8.09 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.069 -175.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.531 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 24.9 t-20 -59.01 -42.57 90.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.314 165.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -110.81 -55.45 2.48 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.663 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 128.72 -35.94 2.54 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 -170.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.79 157.15 18.67 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.232 -0.484 . . . . 0.0 110.262 -173.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -91.21 123.08 34.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.38 -162.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.14 51.46 0.99 Allowed Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 160.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -178.44 175.69 1.12 Allowed 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.459 -0.436 . . . . 0.0 110.433 158.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.664 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -90.14 154.4 3.15 Favored 'Isoleucine or valine' 0 C--O 1.245 0.864 0 CA-C-O 118.064 -0.97 . . . . 0.0 109.316 -167.534 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.636 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.8 -47.16 64.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 113.674 -1.603 . . . . 0.0 113.053 158.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.664 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.37 -10.65 3.31 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.408 0.623 . . . . 0.0 111.41 -167.56 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.432 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.257 0.0 OUTLIER -130.29 14.43 5.6 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 119.01 -1.076 . . . . 0.0 110.468 -167.276 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.8 t -85.34 140.01 31.13 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.36 0.6 . . . . 0.0 109.849 -160.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -95.67 -34.88 11.79 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.389 171.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.591 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.251 -168.332 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.831 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.277 0 O4'-C1'-N19 109.297 1.872 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.831 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.646 1 P-O3'-C3' 107.808 -9.91 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.836 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.63 1 P-O3'-C3' 107.697 -10.003 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.836 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.661 1 P-O3'-C3' 107.812 -9.907 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.761 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.818 1 P-O3'-C3' 108.468 -9.36 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.687 HG21 ' O2 ' ' D' ' 4' ' ' ' DC' . 4.8 p . . . . . 0 N--CA 1.477 0.913 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.681 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -102.69 121.86 43.28 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.254 166.166 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.2 t -61.85 147.05 47.81 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.413 156.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -123.12 -13.44 7.75 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.144 -175.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 25.8 t-20 -59.31 -41.45 89.07 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.832 -0.542 . . . . 0.0 110.173 165.002 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -111.82 -55.52 2.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.423 -1.262 . . . . 0.0 111.766 177.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 129.15 -37.12 2.26 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.636 -0.985 . . . . 0.0 110.636 -170.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 9.8 mttm -61.79 150.78 36.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.277 -174.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.16 141.51 38.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.31 -166.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 125.9 -68.13 0.52 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 162.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -101.42 176.58 5.19 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 122.44 -0.447 . . . . 0.0 110.31 -158.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.599 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -88.93 154.13 3.19 Favored 'Isoleucine or valine' 0 C--O 1.243 0.719 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.672 -169.351 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.613 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -49.65 -48.63 49.23 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 113.971 -1.468 . . . . 0.0 113.44 158.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.599 ' H ' HG12 ' E' ' 12' ' ' ILE . 2.5 tpt85 -60.54 -8.03 2.54 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 121.526 0.679 . . . . 0.0 110.874 -166.127 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.444 ' H ' ' C ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -136.03 12.03 3.34 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 118.927 -1.109 . . . . 0.0 109.65 -163.237 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 37.5 t -72.58 -72.0 0.26 Allowed 'General case' 0 C--O 1.245 0.854 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -158.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 20.2 ttp85 78.3 -54.86 0.49 Allowed 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 120.673 -1.267 . . . . 0.0 111.362 -155.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.586 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.318 -168.258 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.807 " H2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.26 0 O4'-C1'-N19 109.279 1.849 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.84 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.598 1 P-O3'-C3' 107.808 -9.91 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.859 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.683 1 P-O3'-C3' 107.693 -10.006 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.859 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.667 1 P-O3'-C3' 107.789 -9.926 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.757 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.803 1 P-O3'-C3' 108.453 -9.373 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.516 HG12 ' O2 ' ' D' ' 4' ' ' ' DC' . 9.8 p . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.527 ' HA ' ' H ' ' E' ' 10' ' ' GLY . 1.3 ptpp? -156.48 132.54 9.79 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.69 158.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.4 t -61.76 136.68 58.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.907 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -113.5 -13.17 12.83 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 114.67 -1.15 . . . . 0.0 111.193 -177.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.525 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 22.6 t-20 -59.21 -49.51 77.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.455 166.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.6 p -102.72 -56.32 2.26 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.576 176.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 135.19 -29.6 2.91 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 -177.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.22 145.63 53.04 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.046 -0.577 . . . . 0.0 110.342 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.47 158.02 34.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.357 -166.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 10' ' ' GLY . . . . . 0.527 ' H ' ' HA ' ' E' ' 2' ' ' LYS . . . 60.93 48.81 84.39 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.619 -0.993 . . . . 0.0 110.619 161.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -171.25 170.6 5.95 Favored 'General case' 0 C--O 1.241 0.612 0 O-C-N 122.024 -0.692 . . . . 0.0 110.03 153.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.64 ' CG1' ' H ' ' E' ' 14' ' ' ARG . 0.5 OUTLIER -91.08 146.52 6.11 Favored 'Isoleucine or valine' 0 C--O 1.246 0.904 0 CA-C-O 117.724 -1.131 . . . . 0.0 109.125 -160.344 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.624 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.09 -51.12 56.53 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.726 -1.579 . . . . 0.0 113.257 158.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.64 ' H ' ' CG1' ' E' ' 12' ' ' ILE . 28.4 tpt85 -60.62 -8.54 2.94 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.274 0.559 . . . . 0.0 111.092 -167.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.443 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.1 OUTLIER -130.64 17.47 5.28 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.313 -170.542 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.2 t -89.33 145.62 25.24 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.464 0.65 . . . . 0.0 109.716 -166.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 -36.83 9.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.487 175.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.527 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.427 -173.663 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.829 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.342 0 O4'-C1'-N19 109.312 1.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.829 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.591 1 P-O3'-C3' 107.784 -9.93 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.829 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.641 1 P-O3'-C3' 107.663 -10.031 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.826 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.728 1 P-O3'-C3' 107.844 -9.88 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.757 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.846 1 P-O3'-C3' 108.497 -9.336 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.753 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 7.9 p . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.517 ' HG3' ' CE2' ' E' ' 4' ' ' PHE . 0.0 OUTLIER -85.05 118.64 24.74 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.159 162.812 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 t -61.78 145.11 53.53 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.519 156.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 4' ' ' PHE . . . . . 0.517 ' CE2' ' HG3' ' E' ' 2' ' ' LYS . 2.4 m-85 -120.77 -14.4 8.55 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.029 -175.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.529 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 23.7 t-20 -59.27 -42.94 92.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.345 166.046 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -110.09 -55.49 2.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.557 -1.202 . . . . 0.0 111.636 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 128.94 -36.12 2.48 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.565 -1.014 . . . . 0.0 110.565 -170.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -61.84 154.73 25.14 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.123 -0.538 . . . . 0.0 110.26 -173.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -90.33 123.61 34.23 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.323 -164.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.17 49.0 0.96 Allowed Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 160.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.0 p-80 -178.27 175.5 1.19 Allowed 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.481 -0.423 . . . . 0.0 110.348 158.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.632 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -89.93 153.89 3.19 Favored 'Isoleucine or valine' 0 C--O 1.246 0.873 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.273 -167.003 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.632 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.23 -48.13 62.16 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 113.735 -1.575 . . . . 0.0 113.153 158.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.632 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.75 -8.47 3.02 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.35 0.595 . . . . 0.0 110.961 -166.579 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.438 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -132.1 15.47 4.67 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.392 -167.774 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 t -86.3 164.56 17.04 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -161.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 17' ' ' ARG . . . . . 0.444 ' HG3' ' N ' ' E' ' 18' ' ' ALA . 1.3 ptt180 -129.2 -34.15 1.89 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.522 174.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 18' ' ' ALA . . . . . 0.444 ' N ' ' HG3' ' E' ' 17' ' ' ARG . . . . . . . . 0 C--O 1.239 0.551 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.365 -169.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.828 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.309 0 O4'-C1'-N19 109.363 1.954 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.835 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.603 1 P-O3'-C3' 107.817 -9.903 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.835 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.641 1 P-O3'-C3' 107.702 -9.999 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.825 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.745 1 P-O3'-C3' 107.859 -9.867 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.76 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.841 1 P-O3'-C3' 108.477 -9.352 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.636 HG22 ' H ' ' E' ' 2' ' ' LYS . 8.9 p . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.636 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -100.62 125.74 47.04 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.221 -162.015 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 25.2 t -62.33 140.97 58.51 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.479 156.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -115.61 -14.61 11.46 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.232 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.53 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 24.0 t-20 -58.85 -40.07 83.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.515 168.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -112.89 -56.38 2.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.328 -1.306 . . . . 0.0 111.685 175.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.77 14.93 12.77 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.048 -0.821 . . . . 0.0 111.048 -170.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.06 160.76 15.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.929 0.395 . . . . 0.0 110.241 166.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -92.07 130.47 37.8 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.341 -170.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 134.32 -57.1 0.7 Allowed Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 163.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -109.67 172.16 7.02 Favored 'General case' 0 C--O 1.24 0.554 0 O-C-N 122.556 -0.379 . . . . 0.0 110.323 -159.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.61 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -85.48 154.23 3.5 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-N 114.263 -1.335 . . . . 0.0 109.326 -170.163 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.611 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -50.13 -47.53 54.02 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.287 158.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.61 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.99 -8.19 2.17 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.397 0.618 . . . . 0.0 111.1 -166.366 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.441 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.255 0.0 OUTLIER -131.47 13.34 5.0 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 119.349 -0.941 . . . . 0.0 110.098 -165.377 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.8 t -84.4 134.87 34.46 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.121 0.486 . . . . 0.0 109.756 -159.233 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -107.6 17.43 22.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.518 170.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.573 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.385 -173.356 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.827 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.338 0 O4'-C1'-N19 109.314 1.893 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.836 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.603 1 P-O3'-C3' 107.798 -9.919 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.836 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.746 1 P-O3'-C3' 107.734 -9.972 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.835 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.794 1 P-O3'-C3' 107.824 -9.897 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.76 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.801 1 P-O3'-C3' 108.437 -9.386 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.538 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 8.0 p . . . . . 0 N--CA 1.473 0.691 0 CA-C-O 121.008 0.433 . . . . 0.0 109.868 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.505 ' HG3' ' CE2' ' E' ' 4' ' ' PHE . 0.0 OUTLIER -107.13 134.08 50.78 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.241 -164.896 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.0 t -62.36 142.05 58.0 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.496 158.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 4' ' ' PHE . . . . . 0.505 ' CE2' ' HG3' ' E' ' 2' ' ' LYS . 1.0 OUTLIER -118.35 -13.68 9.8 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.206 -177.476 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.53 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 23.1 t-20 -59.18 -43.64 92.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.465 166.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -108.91 -56.85 2.22 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.74 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.08 12.25 12.54 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -172.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.92 168.5 15.98 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 168.453 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -97.93 125.08 42.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.429 -171.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.42 50.16 3.04 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 162.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 45.9 p-80 -174.02 172.39 3.4 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 122.444 -0.445 . . . . 0.0 110.167 158.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.635 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -90.54 152.9 3.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.915 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.232 -165.277 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.634 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.43 -47.17 63.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 113.786 -1.552 . . . . 0.0 113.113 158.204 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.635 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.88 -10.0 3.54 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.398 0.618 . . . . 0.0 111.159 -167.244 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.439 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.257 0.0 OUTLIER -130.7 14.53 5.38 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 118.982 -1.087 . . . . 0.0 110.524 -167.949 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.0 t -86.68 155.77 20.26 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.307 0.575 . . . . 0.0 109.848 -162.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.09 -27.34 4.21 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.518 176.415 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.555 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.38 -170.304 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.825 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.394 0 O4'-C1'-N19 109.353 1.941 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.837 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.578 1 P-O3'-C3' 107.784 -9.93 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.844 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.704 1 P-O3'-C3' 107.701 -9.999 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.844 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.639 1 P-O3'-C3' 107.812 -9.907 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.762 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.804 1 P-O3'-C3' 108.494 -9.338 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.621 HG11 ' C2 ' ' D' ' 5' ' ' ' DC' . 87.5 t . . . . . 0 N--CA 1.474 0.752 0 CA-C-O 121.445 0.641 . . . . 0.0 109.858 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.52 138.9 53.04 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.459 -170.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 28.3 t -61.95 143.85 55.89 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.788 162.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -119.8 -13.42 9.09 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.189 -177.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.532 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 25.2 t-20 -59.23 -41.53 88.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.38 166.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -112.22 -56.82 2.35 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.775 177.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 111.59 19.39 7.45 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -171.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -96.12 139.28 32.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.089 0.471 . . . . 0.0 110.294 168.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -64.29 137.85 58.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.354 -174.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.94 -68.22 0.47 Allowed Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.396 -1.081 . . . . 0.0 110.396 162.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.9 p-80 -98.98 174.84 6.15 Favored 'General case' 0 C--O 1.239 0.533 0 O-C-N 122.42 -0.459 . . . . 0.0 110.398 -158.308 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.685 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.7 OUTLIER -89.75 153.17 3.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-N 114.695 -1.139 . . . . 0.0 109.197 -166.951 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.629 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.4 -47.63 62.87 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.89 -1.504 . . . . 0.0 113.152 158.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.685 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.61 -9.37 2.57 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.406 0.622 . . . . 0.0 111.224 -167.085 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.438 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.259 0.0 OUTLIER -130.85 13.82 5.3 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 118.914 -1.114 . . . . 0.0 110.451 -167.12 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.5 t -84.55 153.24 23.37 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.095 0.474 . . . . 0.0 109.802 -160.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.94 -49.95 6.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.393 170.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.664 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.312 -168.685 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.829 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.268 0 O4'-C1'-N19 109.355 1.944 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.829 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.608 1.533 1 P-O3'-C3' 107.763 -9.948 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.837 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.621 1 P-O3'-C3' 107.69 -10.008 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.837 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.642 1 P-O3'-C3' 107.792 -9.923 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.759 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.808 1 P-O3'-C3' 108.427 -9.394 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.689 HG11 ' H22' ' D' ' 3' ' ' ' DG' . 2.8 p . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.671 ' N ' HG13 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -86.14 135.05 33.75 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.737 -0.602 . . . . 0.0 110.838 155.92 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.3 t -59.24 150.9 24.39 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.91 159.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 4' ' ' PHE . . . . . 0.469 ' CE1' ' HG3' ' E' ' 2' ' ' LYS . 58.7 m-85 -129.94 -7.36 4.45 Favored 'General case' 0 C--O 1.246 0.87 0 O-C-N 120.552 -1.342 . . . . 0.0 111.61 -178.286 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.551 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 28.0 t-20 -58.4 -39.48 79.78 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 121.451 -0.781 . . . . 0.0 110.28 160.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 26.4 p -115.7 -53.19 2.6 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.685 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.0 -28.74 3.63 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.596 -1.002 . . . . 0.0 110.596 -173.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.51 147.82 47.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.316 -0.442 . . . . 0.0 110.277 -167.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -76.47 125.71 29.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.305 -166.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 138.86 -66.67 0.52 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.439 -1.065 . . . . 0.0 110.439 163.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -98.22 176.93 5.55 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.42 -0.459 . . . . 0.0 110.404 -158.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.655 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.8 OUTLIER -89.21 153.14 3.25 Favored 'Isoleucine or valine' 0 C--O 1.243 0.754 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.44 -170.042 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.61 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.82 -46.93 64.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 113.688 -1.596 . . . . 0.0 113.109 159.706 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.655 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.68 -8.27 1.95 Allowed 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.512 0.672 . . . . 0.0 111.201 -166.443 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' E' ' 13' ' ' ALA 0.253 0.0 OUTLIER -132.02 13.72 4.74 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.153 -164.834 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 28.0 t -84.44 126.57 33.37 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.159 0.504 . . . . 0.0 109.722 -157.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.24 -19.92 20.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.304 168.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.546 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.292 -168.697 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.82 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.355 0 O4'-C1'-N19 109.313 1.891 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.848 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.607 1 P-O3'-C3' 107.814 -9.905 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.848 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.696 1 P-O3'-C3' 107.721 -9.982 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.841 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.761 1 P-O3'-C3' 107.806 -9.911 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.757 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.837 1 P-O3'-C3' 108.466 -9.362 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.668 HG21 ' O2 ' ' D' ' 4' ' ' ' DC' . 34.7 m . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 121.117 0.484 . . . . 0.0 109.901 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.59 132.25 56.69 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.374 -165.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.6 t -62.08 142.46 57.54 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.593 162.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.52 -14.68 10.29 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.1 -177.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 23.2 t-20 -58.97 -43.95 91.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.435 167.564 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.6 p -110.75 -55.93 2.42 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.589 178.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.81 15.21 11.19 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 -172.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.9 mttt -92.0 161.57 14.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.183 167.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -90.94 135.86 33.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.347 -167.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.77 51.1 4.39 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 162.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -175.72 172.36 2.55 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 122.513 -0.404 . . . . 0.0 110.313 158.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.769 HG23 ' H ' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -86.63 155.97 3.32 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.569 -169.042 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.624 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.11 -49.93 59.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.278 -1.328 . . . . 0.0 112.391 156.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.657 ' H ' HG12 ' E' ' 12' ' ' ILE . 16.4 tpt85 -61.21 -22.79 65.09 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.938 -168.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.769 ' H ' HG23 ' E' ' 12' ' ' ILE 0.287 0.2 OUTLIER -115.78 27.07 9.54 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.538 -171.24 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.1 t -93.9 159.44 15.18 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.718 -165.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 17' ' ' ARG . . . . . 0.43 ' O ' ' HB3' ' E' ' 18' ' ' ALA . 0.0 OUTLIER -145.75 28.26 1.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.401 168.851 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' E' E ' 18' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' E' ' 17' ' ' ARG . . . . . . . . 0 C--O 1.238 0.464 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.414 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.827 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.329 0 O4'-C1'-N19 109.331 1.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.836 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.59 1 P-O3'-C3' 107.78 -9.933 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.836 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.658 1 P-O3'-C3' 107.676 -10.02 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.828 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.71 1 P-O3'-C3' 107.817 -9.902 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.759 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.799 1 P-O3'-C3' 108.457 -9.369 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.567 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 12.3 p . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.508 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.1 OUTLIER -113.62 135.64 53.7 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.42 -165.123 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 t -61.69 142.69 57.05 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.728 161.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -119.59 -11.86 9.38 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.436 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.53 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 24.2 t-20 -58.82 -42.44 89.17 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.862 -0.524 . . . . 0.0 110.4 166.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.5 p -110.39 -55.97 2.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.684 175.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 118.41 7.28 11.15 Favored Glycine 0 CA--C 1.52 0.405 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.206 -173.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.06 171.23 10.0 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.521 -0.339 . . . . 0.0 110.219 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -95.95 137.63 34.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.355 -167.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.73 48.59 10.04 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 162.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.8 p-80 -171.98 169.59 5.62 Favored 'General case' 0 C--O 1.239 0.524 0 O-C-N 122.431 -0.452 . . . . 0.0 110.289 156.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.656 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -88.98 154.44 3.17 Favored 'Isoleucine or valine' 0 C--O 1.246 0.89 0 CA-C-N 114.616 -1.174 . . . . 0.0 109.089 -167.599 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.631 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -52.02 -46.06 64.84 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 113.79 -1.55 . . . . 0.0 113.009 158.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.656 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.37 -11.77 4.81 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.392 0.615 . . . . 0.0 111.404 -167.559 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.435 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.259 0.0 OUTLIER -127.53 13.85 7.04 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.557 -167.367 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.0 t -87.08 165.55 15.7 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 -160.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.06 28.4 0.92 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.26 167.397 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.557 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.369 169.961 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? . . . . . 0 C--O 1.234 0.248 0 CA-C-O 120.634 0.254 . . . . 0.0 110.502 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.9 t -61.34 148.32 41.81 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.764 164.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -125.88 -11.24 6.6 Favored 'General case' 0 C--O 1.245 0.863 0 O-C-N 120.534 -1.354 . . . . 0.0 111.302 -175.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.26 -44.14 92.42 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.507 -0.746 . . . . 0.0 110.261 162.647 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.4 p -112.31 -50.98 2.87 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.679 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 118.01 7.8 11.2 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 -178.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -90.22 169.16 11.37 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.258 -0.471 . . . . 0.0 110.411 178.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.4 138.6 31.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.415 -172.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.85 -65.29 0.37 Allowed Glycine 0 CA--C 1.528 0.868 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 164.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -100.62 172.32 7.17 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 122.485 -0.421 . . . . 0.0 110.513 -158.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.703 HG23 ' H ' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -87.2 155.84 3.26 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.714 -169.882 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -48.33 -52.52 21.21 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.31 -1.314 . . . . 0.0 113.13 156.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.649 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.35 -24.21 66.31 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.846 -167.378 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.703 ' H ' HG23 ' E' ' 12' ' ' ILE 0.275 0.0 OUTLIER -115.88 11.84 15.63 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.467 -171.386 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -65.21 -147.94 0.01 OUTLIER 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.757 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.65 -38.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.95 -0.469 . . . . 0.0 110.353 -173.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.581 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.435 171.435 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.307 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.8 t -62.17 143.69 56.42 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.57 160.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -119.1 -13.56 9.37 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 114.316 -1.311 . . . . 0.0 111.255 -177.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.15 -41.71 88.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.289 166.61 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -111.79 -56.4 2.39 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.471 -1.241 . . . . 0.0 111.707 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 106.92 22.97 7.31 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -169.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -93.24 173.71 7.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.45 -0.375 . . . . 0.0 110.299 167.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.15 119.65 38.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.291 -168.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.84 57.16 2.08 Favored Glycine 0 CA--C 1.529 0.925 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 163.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -175.3 171.82 2.83 Favored 'General case' 0 C--O 1.238 0.479 0 O-C-N 122.426 -0.455 . . . . 0.0 110.015 157.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.591 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -89.2 151.77 3.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.748 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.343 -166.009 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -50.68 -47.03 58.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.973 -1.467 . . . . 0.0 113.258 159.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.591 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.39 -7.9 2.33 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.547 0.689 . . . . 0.0 110.983 -165.87 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -133.48 13.98 4.11 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.009 -164.218 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 44.8 t -78.86 -117.7 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -156.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 170.71 -73.09 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 120.824 -1.172 . . . . 0.0 109.853 -165.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . 0.403 ' HB2' ' ND2' ' E' ' 5' ' ' ASN . . . . . . . . 0 C--O 1.24 0.564 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.774 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.312 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.4 t -62.1 148.47 44.18 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.562 159.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -125.01 -13.42 6.84 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.177 -175.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.54 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -58.7 -40.34 83.36 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 121.611 -0.68 . . . . 0.0 110.364 164.321 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.8 p -114.15 -55.06 2.54 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.665 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 133.87 -39.89 1.66 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.556 -1.017 . . . . 0.0 110.556 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -62.26 165.57 5.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.237 -0.482 . . . . 0.0 110.38 -170.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.07 129.98 44.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.355 -166.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.75 45.24 2.13 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 110.393 -1.083 . . . . 0.0 110.393 161.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.2 p-80 -177.1 166.75 2.42 Favored 'General case' 0 C--O 1.242 0.669 0 O-C-N 122.486 -0.42 . . . . 0.0 110.063 158.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.676 HD13 ' CB ' ' E' ' 14' ' ' ARG . 2.6 tt -86.14 155.75 3.38 Favored 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-N 114.434 -1.257 . . . . 0.0 109.214 -167.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.34 -47.1 62.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.123 -1.399 . . . . 0.0 113.023 160.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.676 ' CB ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.76 -11.22 6.91 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.452 0.644 . . . . 0.0 110.904 -167.593 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.439 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.26 0.0 OUTLIER -128.54 11.78 6.32 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 119.176 -1.01 . . . . 0.0 110.547 -167.731 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 33.4 t -81.64 163.72 22.34 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -162.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.41 29.48 0.2 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.266 164.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.592 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.312 172.653 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.328 0 CA-C-O 120.493 0.187 . . . . 0.0 110.548 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.8 t -60.92 151.24 30.81 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.986 163.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -129.23 -12.0 4.59 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 120.851 -1.156 . . . . 0.0 111.028 -172.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.76 -41.88 92.04 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 121.751 -0.593 . . . . 0.0 110.178 160.604 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 30.0 p -114.85 -55.67 2.46 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.837 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 135.07 -39.63 1.66 Allowed Glycine 0 CA--C 1.525 0.694 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.626 -169.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -61.65 155.48 22.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.161 0.505 . . . . 0.0 110.425 -166.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -75.53 142.45 42.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.306 -171.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 119.27 -66.43 0.4 Allowed Glycine 0 CA--C 1.527 0.828 0 N-CA-C 110.391 -1.083 . . . . 0.0 110.391 162.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.0 p-80 -102.03 173.65 6.29 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 122.459 -0.436 . . . . 0.0 110.432 -158.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.686 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.7 OUTLIER -90.79 155.14 3.09 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.637 -168.15 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.527 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -47.13 -51.76 17.18 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.373 -1.285 . . . . 0.0 113.775 156.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.686 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.89 -8.73 2.38 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.401 0.619 . . . . 0.0 111.117 -166.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.431 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -130.97 11.03 5.07 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 119.039 -1.064 . . . . 0.0 110.225 -167.175 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.9 t -79.84 163.51 24.33 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -161.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.68 -24.65 8.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.448 167.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.711 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.276 -167.987 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . 0.51 ' HG3' ' CE1' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.433 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.7 t -61.39 145.76 50.55 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.484 155.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . 0.51 ' CE1' ' HG3' ' E' ' 2' ' ' LYS . 1.5 m-85 -120.63 -14.49 8.6 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.133 -176.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.531 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.21 -41.55 88.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.333 166.464 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.4 p -111.83 -54.94 2.56 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.475 -1.239 . . . . 0.0 111.628 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.9 -35.76 2.33 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 -171.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -61.84 164.46 6.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.35 -0.425 . . . . 0.0 110.343 -170.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.63 131.96 34.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.308 -166.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 127.7 -63.2 0.61 Allowed Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 162.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -101.96 174.94 5.71 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.278 -0.543 . . . . 0.0 110.523 -157.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.606 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -88.84 153.27 3.25 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.478 -168.67 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.531 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -50.17 -47.29 54.51 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.073 -1.421 . . . . 0.0 113.382 158.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.606 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.19 -8.06 2.27 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.466 0.65 . . . . 0.0 111.035 -166.086 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.438 ' H ' ' C ' ' E' ' 13' ' ' ALA 0.252 0.0 OUTLIER -132.41 12.61 4.56 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 119.28 -0.968 . . . . 0.0 110.014 -164.757 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.6 t -84.13 164.82 18.95 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -158.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.69 -39.87 2.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.364 167.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.501 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.325 -170.014 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.44 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.7 t -61.59 146.48 48.75 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.518 157.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -121.64 -14.87 8.09 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.069 -175.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.531 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.01 -42.57 90.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.314 165.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -110.81 -55.45 2.48 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.663 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 128.72 -35.94 2.54 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 -170.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.79 157.15 18.67 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.232 -0.484 . . . . 0.0 110.262 -173.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -91.21 123.08 34.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.38 -162.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.14 51.46 0.99 Allowed Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 160.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -178.44 175.69 1.12 Allowed 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.459 -0.436 . . . . 0.0 110.433 158.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.664 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -90.14 154.4 3.15 Favored 'Isoleucine or valine' 0 C--O 1.245 0.864 0 CA-C-O 118.064 -0.97 . . . . 0.0 109.316 -167.534 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.531 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.8 -47.16 64.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 113.674 -1.603 . . . . 0.0 113.053 158.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.664 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.37 -10.65 3.31 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.408 0.623 . . . . 0.0 111.41 -167.56 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.432 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.257 0.0 OUTLIER -130.29 14.43 5.6 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 119.01 -1.076 . . . . 0.0 110.468 -167.276 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.8 t -85.34 140.01 31.13 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.36 0.6 . . . . 0.0 109.849 -160.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -95.67 -34.88 11.79 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.389 171.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.591 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.251 -168.332 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.365 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.2 t -61.85 147.05 47.81 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.413 156.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -123.12 -13.44 7.75 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.144 -175.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.31 -41.45 89.07 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.832 -0.542 . . . . 0.0 110.173 165.002 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -111.82 -55.52 2.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.423 -1.262 . . . . 0.0 111.766 177.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 129.15 -37.12 2.26 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.636 -0.985 . . . . 0.0 110.636 -170.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 9.8 mttm -61.79 150.78 36.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.277 -174.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.16 141.51 38.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.31 -166.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 125.9 -68.13 0.52 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 162.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -101.42 176.58 5.19 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 122.44 -0.447 . . . . 0.0 110.31 -158.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.599 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -88.93 154.13 3.19 Favored 'Isoleucine or valine' 0 C--O 1.243 0.719 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.672 -169.351 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -49.65 -48.63 49.23 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 113.971 -1.468 . . . . 0.0 113.44 158.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.599 ' H ' HG12 ' E' ' 12' ' ' ILE . 2.5 tpt85 -60.54 -8.03 2.54 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 121.526 0.679 . . . . 0.0 110.874 -166.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.444 ' H ' ' C ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -136.03 12.03 3.34 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 118.927 -1.109 . . . . 0.0 109.65 -163.237 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 37.5 t -72.58 -72.0 0.26 Allowed 'General case' 0 C--O 1.245 0.854 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -158.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 20.2 ttp85 78.3 -54.86 0.49 Allowed 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 120.673 -1.267 . . . . 0.0 111.362 -155.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.586 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.318 -168.258 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . 0.527 ' HA ' ' H ' ' E' ' 10' ' ' GLY . 1.3 ptpp? . . . . . 0 N--CA 1.465 0.287 0 CA-C-O 121.441 0.639 . . . . 0.0 109.69 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.4 t -61.76 136.68 58.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.907 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -113.5 -13.17 12.83 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 114.67 -1.15 . . . . 0.0 111.193 -177.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.525 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.21 -49.51 77.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.455 166.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.6 p -102.72 -56.32 2.26 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.576 176.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 135.19 -29.6 2.91 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 -177.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.22 145.63 53.04 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.046 -0.577 . . . . 0.0 110.342 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.47 158.02 34.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.357 -166.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . 0.527 ' H ' ' HA ' ' E' ' 2' ' ' LYS . . . 60.93 48.81 84.39 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.619 -0.993 . . . . 0.0 110.619 161.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -171.25 170.6 5.95 Favored 'General case' 0 C--O 1.241 0.612 0 O-C-N 122.024 -0.692 . . . . 0.0 110.03 153.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.64 ' CG1' ' H ' ' E' ' 14' ' ' ARG . 0.5 OUTLIER -91.08 146.52 6.11 Favored 'Isoleucine or valine' 0 C--O 1.246 0.904 0 CA-C-O 117.724 -1.131 . . . . 0.0 109.125 -160.344 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.525 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.09 -51.12 56.53 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.726 -1.579 . . . . 0.0 113.257 158.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.64 ' H ' ' CG1' ' E' ' 12' ' ' ILE . 28.4 tpt85 -60.62 -8.54 2.94 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.274 0.559 . . . . 0.0 111.092 -167.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.443 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -130.64 17.47 5.28 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.313 -170.542 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.2 t -89.33 145.62 25.24 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.464 0.65 . . . . 0.0 109.716 -166.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 -36.83 9.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.487 175.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.527 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.427 -173.663 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . 0.517 ' HG3' ' CE2' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.418 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 t -61.78 145.11 53.53 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.519 156.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . 0.517 ' CE2' ' HG3' ' E' ' 2' ' ' LYS . 2.4 m-85 -120.77 -14.4 8.55 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.029 -175.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.529 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.27 -42.94 92.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.345 166.046 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -110.09 -55.49 2.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.557 -1.202 . . . . 0.0 111.636 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 128.94 -36.12 2.48 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.565 -1.014 . . . . 0.0 110.565 -170.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -61.84 154.73 25.14 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.123 -0.538 . . . . 0.0 110.26 -173.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -90.33 123.61 34.23 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.323 -164.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.17 49.0 0.96 Allowed Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 160.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.0 p-80 -178.27 175.5 1.19 Allowed 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.481 -0.423 . . . . 0.0 110.348 158.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.632 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -89.93 153.89 3.19 Favored 'Isoleucine or valine' 0 C--O 1.246 0.873 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.273 -167.003 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.529 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.23 -48.13 62.16 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 113.735 -1.575 . . . . 0.0 113.153 158.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.632 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.75 -8.47 3.02 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.35 0.595 . . . . 0.0 110.961 -166.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.438 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -132.1 15.47 4.67 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.392 -167.774 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 t -86.3 164.56 17.04 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -161.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . 0.444 ' HG3' ' N ' ' E' ' 18' ' ' ALA . 1.3 ptt180 -129.2 -34.15 1.89 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.522 174.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . 0.444 ' N ' ' HG3' ' E' ' 17' ' ' ARG . . . . . . . . 0 C--O 1.239 0.551 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.365 -169.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.39 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 25.2 t -62.33 140.97 58.51 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.479 156.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -115.61 -14.61 11.46 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.232 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.53 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -58.85 -40.07 83.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.515 168.706 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -112.89 -56.38 2.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.328 -1.306 . . . . 0.0 111.685 175.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.77 14.93 12.77 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.048 -0.821 . . . . 0.0 111.048 -170.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.06 160.76 15.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.929 0.395 . . . . 0.0 110.241 166.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -92.07 130.47 37.8 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.341 -170.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 134.32 -57.1 0.7 Allowed Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 163.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -109.67 172.16 7.02 Favored 'General case' 0 C--O 1.24 0.554 0 O-C-N 122.556 -0.379 . . . . 0.0 110.323 -159.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.61 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -85.48 154.23 3.5 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-N 114.263 -1.335 . . . . 0.0 109.326 -170.163 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.53 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -50.13 -47.53 54.02 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.287 158.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.61 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.99 -8.19 2.17 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.397 0.618 . . . . 0.0 111.1 -166.366 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.441 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.255 0.0 OUTLIER -131.47 13.34 5.0 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 119.349 -0.941 . . . . 0.0 110.098 -165.377 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.8 t -84.4 134.87 34.46 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.121 0.486 . . . . 0.0 109.756 -159.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -107.6 17.43 22.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.518 170.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.573 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.385 -173.356 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . 0.505 ' HG3' ' CE2' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.326 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.0 t -62.36 142.05 58.0 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.496 158.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . 0.505 ' CE2' ' HG3' ' E' ' 2' ' ' LYS . 1.0 OUTLIER -118.35 -13.68 9.8 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.206 -177.476 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.53 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.18 -43.64 92.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.465 166.758 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -108.91 -56.85 2.22 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.74 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.08 12.25 12.54 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -172.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.92 168.5 15.98 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 168.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -97.93 125.08 42.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.429 -171.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.42 50.16 3.04 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 162.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 45.9 p-80 -174.02 172.39 3.4 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 122.444 -0.445 . . . . 0.0 110.167 158.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.635 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -90.54 152.9 3.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.915 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.232 -165.277 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.53 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.43 -47.17 63.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 113.786 -1.552 . . . . 0.0 113.113 158.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.635 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.88 -10.0 3.54 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.398 0.618 . . . . 0.0 111.159 -167.244 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.439 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.257 0.0 OUTLIER -130.7 14.53 5.38 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 118.982 -1.087 . . . . 0.0 110.524 -167.949 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.0 t -86.68 155.77 20.26 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.307 0.575 . . . . 0.0 109.848 -162.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.09 -27.34 4.21 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.518 176.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.555 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.38 -170.304 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.236 0 N-CA-C 110.459 -0.2 . . . . 0.0 110.459 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 28.3 t -61.95 143.85 55.89 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.788 162.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -119.8 -13.42 9.09 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.189 -177.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.532 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.23 -41.53 88.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.38 166.421 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -112.22 -56.82 2.35 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.775 177.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 111.59 19.39 7.45 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -171.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -96.12 139.28 32.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.089 0.471 . . . . 0.0 110.294 168.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -64.29 137.85 58.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.354 -174.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.94 -68.22 0.47 Allowed Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.396 -1.081 . . . . 0.0 110.396 162.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.9 p-80 -98.98 174.84 6.15 Favored 'General case' 0 C--O 1.239 0.533 0 O-C-N 122.42 -0.459 . . . . 0.0 110.398 -158.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.685 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.7 OUTLIER -89.75 153.17 3.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-N 114.695 -1.139 . . . . 0.0 109.197 -166.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.532 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.4 -47.63 62.87 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.89 -1.504 . . . . 0.0 113.152 158.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.685 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.61 -9.37 2.57 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.406 0.622 . . . . 0.0 111.224 -167.085 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.438 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.259 0.0 OUTLIER -130.85 13.82 5.3 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 118.914 -1.114 . . . . 0.0 110.451 -167.12 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.5 t -84.55 153.24 23.37 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.095 0.474 . . . . 0.0 109.802 -160.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.94 -49.95 6.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.393 170.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.664 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.312 -168.685 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . 0.469 ' HG3' ' CE1' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.215 0 CA-C-O 121.248 0.546 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.3 t -59.24 150.9 24.39 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.91 159.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . 0.469 ' CE1' ' HG3' ' E' ' 2' ' ' LYS . 58.7 m-85 -129.94 -7.36 4.45 Favored 'General case' 0 C--O 1.246 0.87 0 O-C-N 120.552 -1.342 . . . . 0.0 111.61 -178.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.551 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -58.4 -39.48 79.78 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 121.451 -0.781 . . . . 0.0 110.28 160.85 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 26.4 p -115.7 -53.19 2.6 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.685 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.0 -28.74 3.63 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.596 -1.002 . . . . 0.0 110.596 -173.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.51 147.82 47.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.316 -0.442 . . . . 0.0 110.277 -167.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -76.47 125.71 29.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.305 -166.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 138.86 -66.67 0.52 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.439 -1.065 . . . . 0.0 110.439 163.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -98.22 176.93 5.55 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.42 -0.459 . . . . 0.0 110.404 -158.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.655 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.8 OUTLIER -89.21 153.14 3.25 Favored 'Isoleucine or valine' 0 C--O 1.243 0.754 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.44 -170.042 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.551 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.82 -46.93 64.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 113.688 -1.596 . . . . 0.0 113.109 159.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.655 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.68 -8.27 1.95 Allowed 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.512 0.672 . . . . 0.0 111.201 -166.443 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' E' ' 13' ' ' ALA 0.253 0.0 OUTLIER -132.02 13.72 4.74 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.153 -164.834 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 28.0 t -84.44 126.57 33.37 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.159 0.504 . . . . 0.0 109.722 -157.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.24 -19.92 20.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.304 168.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.546 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.292 -168.697 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.22 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.6 t -62.08 142.46 57.54 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.593 162.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.52 -14.68 10.29 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.1 -177.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -58.97 -43.95 91.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.435 167.564 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.6 p -110.75 -55.93 2.42 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.589 178.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.81 15.21 11.19 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 -172.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.9 mttt -92.0 161.57 14.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.183 167.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -90.94 135.86 33.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.347 -167.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.77 51.1 4.39 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 162.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -175.72 172.36 2.55 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 122.513 -0.404 . . . . 0.0 110.313 158.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.769 HG23 ' H ' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -86.63 155.97 3.32 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.569 -169.042 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.527 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -51.11 -49.93 59.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.278 -1.328 . . . . 0.0 112.391 156.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.657 ' H ' HG12 ' E' ' 12' ' ' ILE . 16.4 tpt85 -61.21 -22.79 65.09 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.938 -168.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.769 ' H ' HG23 ' E' ' 12' ' ' ILE 0.287 0.0 OUTLIER -115.78 27.07 9.54 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.538 -171.24 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.1 t -93.9 159.44 15.18 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.718 -165.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . 0.43 ' O ' ' HB3' ' E' ' 18' ' ' ALA . 0.0 OUTLIER -145.75 28.26 1.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.401 168.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' E' ' 17' ' ' ARG . . . . . . . . 0 C--O 1.238 0.464 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.414 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.324 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 t -61.69 142.69 57.05 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.728 161.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -119.59 -11.86 9.38 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.436 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.53 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -58.82 -42.44 89.17 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.862 -0.524 . . . . 0.0 110.4 166.024 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.5 p -110.39 -55.97 2.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.684 175.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 118.41 7.28 11.15 Favored Glycine 0 CA--C 1.52 0.405 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.206 -173.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.06 171.23 10.0 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.521 -0.339 . . . . 0.0 110.219 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -95.95 137.63 34.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.355 -167.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.73 48.59 10.04 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 162.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.8 p-80 -171.98 169.59 5.62 Favored 'General case' 0 C--O 1.239 0.524 0 O-C-N 122.431 -0.452 . . . . 0.0 110.289 156.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.656 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -88.98 154.44 3.17 Favored 'Isoleucine or valine' 0 C--O 1.246 0.89 0 CA-C-N 114.616 -1.174 . . . . 0.0 109.089 -167.599 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.53 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -52.02 -46.06 64.84 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 113.79 -1.55 . . . . 0.0 113.009 158.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.656 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.37 -11.77 4.81 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.392 0.615 . . . . 0.0 111.404 -167.559 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.435 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.259 0.0 OUTLIER -127.53 13.85 7.04 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.557 -167.367 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.0 t -87.08 165.55 15.7 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 -160.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.06 28.4 0.92 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.26 167.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.557 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.369 169.961 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.83 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.301 0 O4'-C1'-N19 109.329 1.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.842 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.62 1 P-O3'-C3' 107.798 -9.918 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.845 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.649 1 P-O3'-C3' 107.666 -10.029 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.845 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.648 1 P-O3'-C3' 107.855 -9.871 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.761 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.801 1 P-O3'-C3' 108.471 -9.358 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.448 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 11.1 p . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -116.84 142.25 47.17 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.502 -162.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.9 t -61.34 148.32 41.81 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.764 164.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . 0.409 ' HB2' ' H42' ' D' ' 2' ' ' ' DC' . 13.0 m-85 -125.88 -11.24 6.6 Favored 'General case' 0 C--O 1.245 0.863 0 O-C-N 120.534 -1.354 . . . . 0.0 111.302 -175.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.26 -44.14 92.42 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.507 -0.746 . . . . 0.0 110.261 162.647 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.4 p -112.31 -50.98 2.87 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.679 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 118.01 7.8 11.2 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 -178.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -90.22 169.16 11.37 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.258 -0.471 . . . . 0.0 110.411 178.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.4 138.6 31.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.415 -172.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.85 -65.29 0.37 Allowed Glycine 0 CA--C 1.528 0.868 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 164.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -100.62 172.32 7.17 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 122.485 -0.421 . . . . 0.0 110.513 -158.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.703 HG23 ' H ' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -87.2 155.84 3.26 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.714 -169.882 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.606 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -48.33 -52.52 21.21 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.31 -1.314 . . . . 0.0 113.13 156.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.649 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.35 -24.21 66.31 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.846 -167.378 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.703 ' H ' HG23 ' E' ' 12' ' ' ILE 0.275 0.0 OUTLIER -115.88 11.84 15.63 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.467 -171.386 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -65.21 -147.94 0.01 OUTLIER 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.757 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.65 -38.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.95 -0.469 . . . . 0.0 110.353 -173.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.581 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.435 171.435 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.828 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.307 0 O4'-C1'-N19 109.321 1.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.832 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.539 1 P-O3'-C3' 107.796 -9.92 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.832 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.681 1 P-O3'-C3' 107.701 -9.999 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.832 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.682 1 P-O3'-C3' 107.811 -9.908 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.759 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.756 1 P-O3'-C3' 108.411 -9.407 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.577 HG21 ' O2 ' ' D' ' 4' ' ' ' DC' . 26.8 m . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.74 131.55 54.83 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.354 -165.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.8 t -62.17 143.69 56.42 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.57 160.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -119.1 -13.56 9.37 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 114.316 -1.311 . . . . 0.0 111.255 -177.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.15 -41.71 88.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.289 166.61 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -111.79 -56.4 2.39 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.471 -1.241 . . . . 0.0 111.707 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 106.92 22.97 7.31 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -169.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -93.24 173.71 7.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.45 -0.375 . . . . 0.0 110.299 167.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.15 119.65 38.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.291 -168.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.84 57.16 2.08 Favored Glycine 0 CA--C 1.529 0.925 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 163.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -175.3 171.82 2.83 Favored 'General case' 0 C--O 1.238 0.479 0 O-C-N 122.426 -0.455 . . . . 0.0 110.015 157.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.591 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -89.2 151.77 3.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.748 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.343 -166.009 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.624 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -50.68 -47.03 58.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.973 -1.467 . . . . 0.0 113.258 159.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.591 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.39 -7.9 2.33 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.547 0.689 . . . . 0.0 110.983 -165.87 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -133.48 13.98 4.11 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.009 -164.218 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 44.8 t -78.86 -117.7 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -156.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 170.71 -73.09 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 120.824 -1.172 . . . . 0.0 109.853 -165.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . 0.403 ' HB2' ' ND2' ' E' ' 5' ' ' ASN . . . . . . . . 0 C--O 1.24 0.564 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.774 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.831 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.312 0 O4'-C1'-N19 109.335 1.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.831 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.636 1 P-O3'-C3' 107.791 -9.924 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.83 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.695 1 P-O3'-C3' 107.71 -9.991 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.83 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.758 1 P-O3'-C3' 107.794 -9.922 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.757 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.801 1 P-O3'-C3' 108.479 -9.351 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.623 HG22 ' H ' ' E' ' 2' ' ' LYS . 9.9 p . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.623 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -97.85 129.09 44.83 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.409 -161.528 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.4 t -62.1 148.47 44.18 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.562 159.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -125.01 -13.42 6.84 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.177 -175.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.54 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -58.7 -40.34 83.36 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 121.611 -0.68 . . . . 0.0 110.364 164.321 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.8 p -114.15 -55.06 2.54 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.665 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 133.87 -39.89 1.66 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.556 -1.017 . . . . 0.0 110.556 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -62.26 165.57 5.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.237 -0.482 . . . . 0.0 110.38 -170.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.07 129.98 44.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.355 -166.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.75 45.24 2.13 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 110.393 -1.083 . . . . 0.0 110.393 161.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.2 p-80 -177.1 166.75 2.42 Favored 'General case' 0 C--O 1.242 0.669 0 O-C-N 122.486 -0.42 . . . . 0.0 110.063 158.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.676 HD13 ' CB ' ' E' ' 14' ' ' ARG . 2.6 tt -86.14 155.75 3.38 Favored 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-N 114.434 -1.257 . . . . 0.0 109.214 -167.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.62 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.34 -47.1 62.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.123 -1.399 . . . . 0.0 113.023 160.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.676 ' CB ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.76 -11.22 6.91 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.452 0.644 . . . . 0.0 110.904 -167.593 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.439 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.26 0.0 OUTLIER -128.54 11.78 6.32 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 119.176 -1.01 . . . . 0.0 110.547 -167.731 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 33.4 t -81.64 163.72 22.34 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -162.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.41 29.48 0.2 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.266 164.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.592 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.312 172.653 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.833 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.389 0 O4'-C1'-N19 109.321 1.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.848 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.619 1 P-O3'-C3' 107.792 -9.924 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.855 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.693 1 P-O3'-C3' 107.661 -10.033 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.855 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.782 1 P-O3'-C3' 107.823 -9.898 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.765 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.882 1 P-O3'-C3' 108.455 -9.371 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.582 HG12 " H1'" ' D' ' 5' ' ' ' DC' . 14.2 p . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.11 137.33 50.32 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.548 -161.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.8 t -60.92 151.24 30.81 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.986 163.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -129.23 -12.0 4.59 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 120.851 -1.156 . . . . 0.0 111.028 -172.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.76 -41.88 92.04 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 121.751 -0.593 . . . . 0.0 110.178 160.604 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 30.0 p -114.85 -55.67 2.46 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.837 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 135.07 -39.63 1.66 Allowed Glycine 0 CA--C 1.525 0.694 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.626 -169.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -61.65 155.48 22.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.161 0.505 . . . . 0.0 110.425 -166.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -75.53 142.45 42.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.306 -171.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 119.27 -66.43 0.4 Allowed Glycine 0 CA--C 1.527 0.828 0 N-CA-C 110.391 -1.083 . . . . 0.0 110.391 162.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.0 p-80 -102.03 173.65 6.29 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 122.459 -0.436 . . . . 0.0 110.432 -158.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.686 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.7 OUTLIER -90.79 155.14 3.09 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.637 -168.15 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.596 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -47.13 -51.76 17.18 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.373 -1.285 . . . . 0.0 113.775 156.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.686 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.89 -8.73 2.38 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.401 0.619 . . . . 0.0 111.117 -166.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.431 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -130.97 11.03 5.07 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 119.039 -1.064 . . . . 0.0 110.225 -167.175 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.9 t -79.84 163.51 24.33 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -161.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.68 -24.65 8.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.448 167.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.711 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.276 -167.987 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.829 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.38 0 O4'-C1'-N19 109.331 1.914 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.829 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.596 1 P-O3'-C3' 107.786 -9.929 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.836 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.626 1 P-O3'-C3' 107.667 -10.028 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.836 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.74 1 P-O3'-C3' 107.823 -9.898 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.762 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.776 1 P-O3'-C3' 108.494 -9.339 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.73 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 8.6 p . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.576 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -98.21 127.39 44.12 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.186 163.222 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.7 t -61.39 145.76 50.55 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.484 155.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . 0.51 ' CE1' ' HG3' ' E' ' 2' ' ' LYS . 1.5 m-85 -120.63 -14.49 8.6 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.133 -176.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.531 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.21 -41.55 88.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.333 166.464 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.4 p -111.83 -54.94 2.56 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.475 -1.239 . . . . 0.0 111.628 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.9 -35.76 2.33 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 -171.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -61.84 164.46 6.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.35 -0.425 . . . . 0.0 110.343 -170.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.63 131.96 34.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.308 -166.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 127.7 -63.2 0.61 Allowed Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 162.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -101.96 174.94 5.71 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.278 -0.543 . . . . 0.0 110.523 -157.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.606 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -88.84 153.27 3.25 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.478 -168.67 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.62 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -50.17 -47.29 54.51 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.073 -1.421 . . . . 0.0 113.382 158.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.606 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.19 -8.06 2.27 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.466 0.65 . . . . 0.0 111.035 -166.086 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.438 ' H ' ' C ' ' E' ' 13' ' ' ALA 0.252 0.0 OUTLIER -132.41 12.61 4.56 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 119.28 -0.968 . . . . 0.0 110.014 -164.757 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.6 t -84.13 164.82 18.95 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -158.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.69 -39.87 2.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.364 167.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.501 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.325 -170.014 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.826 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.32 0 O4'-C1'-N19 109.33 1.912 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.833 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.587 1 P-O3'-C3' 107.782 -9.931 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.833 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.688 1 P-O3'-C3' 107.642 -10.048 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.827 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.668 1 P-O3'-C3' 107.774 -9.939 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.76 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.611 1.819 1 P-O3'-C3' 108.468 -9.36 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.76 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 9.5 p . . . . . 0 N--CA 1.475 0.809 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.51 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -94.29 127.1 39.95 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.272 162.743 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.7 t -61.59 146.48 48.75 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.518 157.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -121.64 -14.87 8.09 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.069 -175.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.531 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.01 -42.57 90.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.314 165.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -110.81 -55.45 2.48 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.663 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 128.72 -35.94 2.54 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 -170.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.79 157.15 18.67 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.232 -0.484 . . . . 0.0 110.262 -173.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -91.21 123.08 34.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.38 -162.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.14 51.46 0.99 Allowed Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 160.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -178.44 175.69 1.12 Allowed 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.459 -0.436 . . . . 0.0 110.433 158.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.664 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -90.14 154.4 3.15 Favored 'Isoleucine or valine' 0 C--O 1.245 0.864 0 CA-C-O 118.064 -0.97 . . . . 0.0 109.316 -167.534 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.636 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.8 -47.16 64.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 113.674 -1.603 . . . . 0.0 113.053 158.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.664 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.37 -10.65 3.31 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.408 0.623 . . . . 0.0 111.41 -167.56 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.432 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.257 0.0 OUTLIER -130.29 14.43 5.6 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 119.01 -1.076 . . . . 0.0 110.468 -167.276 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.8 t -85.34 140.01 31.13 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.36 0.6 . . . . 0.0 109.849 -160.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -95.67 -34.88 11.79 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.389 171.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.591 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.251 -168.332 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.831 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.277 0 O4'-C1'-N19 109.297 1.872 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.831 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.646 1 P-O3'-C3' 107.808 -9.91 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.836 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.63 1 P-O3'-C3' 107.697 -10.003 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.836 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.661 1 P-O3'-C3' 107.812 -9.907 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.761 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.818 1 P-O3'-C3' 108.468 -9.36 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.687 HG21 ' O2 ' ' D' ' 4' ' ' ' DC' . 4.8 p . . . . . 0 N--CA 1.477 0.913 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.681 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -102.69 121.86 43.28 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.254 166.166 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.2 t -61.85 147.05 47.81 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.413 156.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -123.12 -13.44 7.75 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.144 -175.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.31 -41.45 89.07 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.832 -0.542 . . . . 0.0 110.173 165.002 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -111.82 -55.52 2.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.423 -1.262 . . . . 0.0 111.766 177.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 129.15 -37.12 2.26 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.636 -0.985 . . . . 0.0 110.636 -170.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 9.8 mttm -61.79 150.78 36.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.277 -174.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.16 141.51 38.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.31 -166.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 125.9 -68.13 0.52 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 162.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -101.42 176.58 5.19 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 122.44 -0.447 . . . . 0.0 110.31 -158.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.599 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -88.93 154.13 3.19 Favored 'Isoleucine or valine' 0 C--O 1.243 0.719 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.672 -169.351 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.613 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -49.65 -48.63 49.23 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 113.971 -1.468 . . . . 0.0 113.44 158.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.599 ' H ' HG12 ' E' ' 12' ' ' ILE . 2.5 tpt85 -60.54 -8.03 2.54 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 121.526 0.679 . . . . 0.0 110.874 -166.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.444 ' H ' ' C ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -136.03 12.03 3.34 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 118.927 -1.109 . . . . 0.0 109.65 -163.237 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 37.5 t -72.58 -72.0 0.26 Allowed 'General case' 0 C--O 1.245 0.854 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -158.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 20.2 ttp85 78.3 -54.86 0.49 Allowed 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 120.673 -1.267 . . . . 0.0 111.362 -155.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.586 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.318 -168.258 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.807 " H2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.26 0 O4'-C1'-N19 109.279 1.849 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.84 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.598 1 P-O3'-C3' 107.808 -9.91 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.859 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.683 1 P-O3'-C3' 107.693 -10.006 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.859 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.667 1 P-O3'-C3' 107.789 -9.926 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.757 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.803 1 P-O3'-C3' 108.453 -9.373 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.516 HG12 ' O2 ' ' D' ' 4' ' ' ' DC' . 9.8 p . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.527 ' HA ' ' H ' ' E' ' 10' ' ' GLY . 1.3 ptpp? -156.48 132.54 9.79 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.69 158.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.4 t -61.76 136.68 58.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.907 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -113.5 -13.17 12.83 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 114.67 -1.15 . . . . 0.0 111.193 -177.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.525 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.21 -49.51 77.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.455 166.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.6 p -102.72 -56.32 2.26 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.576 176.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 135.19 -29.6 2.91 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 -177.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.22 145.63 53.04 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.046 -0.577 . . . . 0.0 110.342 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.47 158.02 34.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.357 -166.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . 0.527 ' H ' ' HA ' ' E' ' 2' ' ' LYS . . . 60.93 48.81 84.39 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.619 -0.993 . . . . 0.0 110.619 161.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -171.25 170.6 5.95 Favored 'General case' 0 C--O 1.241 0.612 0 O-C-N 122.024 -0.692 . . . . 0.0 110.03 153.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.64 ' CG1' ' H ' ' E' ' 14' ' ' ARG . 0.5 OUTLIER -91.08 146.52 6.11 Favored 'Isoleucine or valine' 0 C--O 1.246 0.904 0 CA-C-O 117.724 -1.131 . . . . 0.0 109.125 -160.344 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.624 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.09 -51.12 56.53 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.726 -1.579 . . . . 0.0 113.257 158.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.64 ' H ' ' CG1' ' E' ' 12' ' ' ILE . 28.4 tpt85 -60.62 -8.54 2.94 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.274 0.559 . . . . 0.0 111.092 -167.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.443 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -130.64 17.47 5.28 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.313 -170.542 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.2 t -89.33 145.62 25.24 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.464 0.65 . . . . 0.0 109.716 -166.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 -36.83 9.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.487 175.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.527 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.427 -173.663 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.829 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.342 0 O4'-C1'-N19 109.312 1.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.829 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.591 1 P-O3'-C3' 107.784 -9.93 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.829 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.641 1 P-O3'-C3' 107.663 -10.031 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.826 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.728 1 P-O3'-C3' 107.844 -9.88 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.757 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.846 1 P-O3'-C3' 108.497 -9.336 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.753 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 7.9 p . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.517 ' HG3' ' CE2' ' E' ' 4' ' ' PHE . 0.0 OUTLIER -85.05 118.64 24.74 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.159 162.812 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 t -61.78 145.11 53.53 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.519 156.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . 0.517 ' CE2' ' HG3' ' E' ' 2' ' ' LYS . 2.4 m-85 -120.77 -14.4 8.55 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.029 -175.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.529 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.27 -42.94 92.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.345 166.046 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -110.09 -55.49 2.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.557 -1.202 . . . . 0.0 111.636 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 128.94 -36.12 2.48 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.565 -1.014 . . . . 0.0 110.565 -170.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -61.84 154.73 25.14 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.123 -0.538 . . . . 0.0 110.26 -173.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -90.33 123.61 34.23 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.323 -164.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.17 49.0 0.96 Allowed Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 160.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 40.0 p-80 -178.27 175.5 1.19 Allowed 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.481 -0.423 . . . . 0.0 110.348 158.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.632 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -89.93 153.89 3.19 Favored 'Isoleucine or valine' 0 C--O 1.246 0.873 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.273 -167.003 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.632 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.23 -48.13 62.16 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 113.735 -1.575 . . . . 0.0 113.153 158.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.632 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -60.75 -8.47 3.02 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.35 0.595 . . . . 0.0 110.961 -166.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.438 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -132.1 15.47 4.67 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.392 -167.774 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 t -86.3 164.56 17.04 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -161.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . 0.444 ' HG3' ' N ' ' E' ' 18' ' ' ALA . 1.3 ptt180 -129.2 -34.15 1.89 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.522 174.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . 0.444 ' N ' ' HG3' ' E' ' 17' ' ' ARG . . . . . . . . 0 C--O 1.239 0.551 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.365 -169.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.828 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.309 0 O4'-C1'-N19 109.363 1.954 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.835 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.603 1 P-O3'-C3' 107.817 -9.903 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.835 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.641 1 P-O3'-C3' 107.702 -9.999 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.825 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.745 1 P-O3'-C3' 107.859 -9.867 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.76 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.841 1 P-O3'-C3' 108.477 -9.352 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.636 HG22 ' H ' ' E' ' 2' ' ' LYS . 8.9 p . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.636 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -100.62 125.74 47.04 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.221 -162.015 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 25.2 t -62.33 140.97 58.51 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.479 156.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -115.61 -14.61 11.46 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.232 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.53 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -58.85 -40.07 83.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.515 168.706 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -112.89 -56.38 2.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.328 -1.306 . . . . 0.0 111.685 175.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.77 14.93 12.77 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.048 -0.821 . . . . 0.0 111.048 -170.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.06 160.76 15.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.929 0.395 . . . . 0.0 110.241 166.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -92.07 130.47 37.8 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.341 -170.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 134.32 -57.1 0.7 Allowed Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 163.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -109.67 172.16 7.02 Favored 'General case' 0 C--O 1.24 0.554 0 O-C-N 122.556 -0.379 . . . . 0.0 110.323 -159.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.61 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -85.48 154.23 3.5 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-N 114.263 -1.335 . . . . 0.0 109.326 -170.163 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.611 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -50.13 -47.53 54.02 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.287 158.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.61 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.99 -8.19 2.17 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.397 0.618 . . . . 0.0 111.1 -166.366 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.441 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.255 0.0 OUTLIER -131.47 13.34 5.0 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 119.349 -0.941 . . . . 0.0 110.098 -165.377 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.8 t -84.4 134.87 34.46 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.121 0.486 . . . . 0.0 109.756 -159.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -107.6 17.43 22.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.518 170.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.573 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.385 -173.356 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.827 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.338 0 O4'-C1'-N19 109.314 1.893 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.836 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.603 1 P-O3'-C3' 107.798 -9.919 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.836 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.746 1 P-O3'-C3' 107.734 -9.972 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.835 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.794 1 P-O3'-C3' 107.824 -9.897 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.76 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.801 1 P-O3'-C3' 108.437 -9.386 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.538 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 8.0 p . . . . . 0 N--CA 1.473 0.691 0 CA-C-O 121.008 0.433 . . . . 0.0 109.868 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.505 ' HG3' ' CE2' ' E' ' 4' ' ' PHE . 0.0 OUTLIER -107.13 134.08 50.78 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.241 -164.896 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.0 t -62.36 142.05 58.0 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.496 158.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . 0.505 ' CE2' ' HG3' ' E' ' 2' ' ' LYS . 1.0 OUTLIER -118.35 -13.68 9.8 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.206 -177.476 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.53 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -59.18 -43.64 92.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.465 166.758 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -108.91 -56.85 2.22 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.74 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.08 12.25 12.54 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -172.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.92 168.5 15.98 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 168.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -97.93 125.08 42.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.429 -171.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.42 50.16 3.04 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 162.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 45.9 p-80 -174.02 172.39 3.4 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 122.444 -0.445 . . . . 0.0 110.167 158.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.635 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -90.54 152.9 3.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.915 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.232 -165.277 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.634 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.43 -47.17 63.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 113.786 -1.552 . . . . 0.0 113.113 158.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.635 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.88 -10.0 3.54 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.398 0.618 . . . . 0.0 111.159 -167.244 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.439 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.257 0.0 OUTLIER -130.7 14.53 5.38 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 118.982 -1.087 . . . . 0.0 110.524 -167.949 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.0 t -86.68 155.77 20.26 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.307 0.575 . . . . 0.0 109.848 -162.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.09 -27.34 4.21 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.518 176.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.555 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.38 -170.304 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.825 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.394 0 O4'-C1'-N19 109.353 1.941 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.837 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.578 1 P-O3'-C3' 107.784 -9.93 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.844 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.704 1 P-O3'-C3' 107.701 -9.999 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.844 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.639 1 P-O3'-C3' 107.812 -9.907 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.762 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.804 1 P-O3'-C3' 108.494 -9.338 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.621 HG11 ' C2 ' ' D' ' 5' ' ' ' DC' . 87.5 t . . . . . 0 N--CA 1.474 0.752 0 CA-C-O 121.445 0.641 . . . . 0.0 109.858 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.52 138.9 53.04 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.459 -170.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 28.3 t -61.95 143.85 55.89 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.788 162.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -119.8 -13.42 9.09 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.189 -177.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.532 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -59.23 -41.53 88.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.38 166.421 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -112.22 -56.82 2.35 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.775 177.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 111.59 19.39 7.45 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -171.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -96.12 139.28 32.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.089 0.471 . . . . 0.0 110.294 168.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -64.29 137.85 58.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.354 -174.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.94 -68.22 0.47 Allowed Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.396 -1.081 . . . . 0.0 110.396 162.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.9 p-80 -98.98 174.84 6.15 Favored 'General case' 0 C--O 1.239 0.533 0 O-C-N 122.42 -0.459 . . . . 0.0 110.398 -158.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.685 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.7 OUTLIER -89.75 153.17 3.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-N 114.695 -1.139 . . . . 0.0 109.197 -166.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.629 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.4 -47.63 62.87 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.89 -1.504 . . . . 0.0 113.152 158.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.685 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.61 -9.37 2.57 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.406 0.622 . . . . 0.0 111.224 -167.085 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.438 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.259 0.0 OUTLIER -130.85 13.82 5.3 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 118.914 -1.114 . . . . 0.0 110.451 -167.12 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 26.5 t -84.55 153.24 23.37 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.095 0.474 . . . . 0.0 109.802 -160.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.94 -49.95 6.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.393 170.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.664 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.312 -168.685 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.829 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.268 0 O4'-C1'-N19 109.355 1.944 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.829 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.608 1.533 1 P-O3'-C3' 107.763 -9.948 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.837 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.621 1 P-O3'-C3' 107.69 -10.008 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.837 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.642 1 P-O3'-C3' 107.792 -9.923 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.759 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.808 1 P-O3'-C3' 108.427 -9.394 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.689 HG11 ' H22' ' D' ' 3' ' ' ' DG' . 2.8 p . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.671 ' N ' HG13 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -86.14 135.05 33.75 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.737 -0.602 . . . . 0.0 110.838 155.92 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 31.3 t -59.24 150.9 24.39 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.91 159.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . 0.469 ' CE1' ' HG3' ' E' ' 2' ' ' LYS . 58.7 m-85 -129.94 -7.36 4.45 Favored 'General case' 0 C--O 1.246 0.87 0 O-C-N 120.552 -1.342 . . . . 0.0 111.61 -178.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.551 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -58.4 -39.48 79.78 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 121.451 -0.781 . . . . 0.0 110.28 160.85 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 26.4 p -115.7 -53.19 2.6 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.685 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.0 -28.74 3.63 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.596 -1.002 . . . . 0.0 110.596 -173.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.51 147.82 47.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.316 -0.442 . . . . 0.0 110.277 -167.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -76.47 125.71 29.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.305 -166.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 138.86 -66.67 0.52 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.439 -1.065 . . . . 0.0 110.439 163.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -98.22 176.93 5.55 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.42 -0.459 . . . . 0.0 110.404 -158.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.655 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.8 OUTLIER -89.21 153.14 3.25 Favored 'Isoleucine or valine' 0 C--O 1.243 0.754 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.44 -170.042 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.61 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.82 -46.93 64.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 113.688 -1.596 . . . . 0.0 113.109 159.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.655 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.68 -8.27 1.95 Allowed 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.512 0.672 . . . . 0.0 111.201 -166.443 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' E' ' 13' ' ' ALA 0.253 0.0 OUTLIER -132.02 13.72 4.74 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.153 -164.834 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 28.0 t -84.44 126.57 33.37 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.159 0.504 . . . . 0.0 109.722 -157.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.24 -19.92 20.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.304 168.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.546 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.292 -168.697 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.82 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.355 0 O4'-C1'-N19 109.313 1.891 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.848 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.607 1 P-O3'-C3' 107.814 -9.905 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.848 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.696 1 P-O3'-C3' 107.721 -9.982 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.841 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.761 1 P-O3'-C3' 107.806 -9.911 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.757 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.837 1 P-O3'-C3' 108.466 -9.362 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.668 HG21 ' O2 ' ' D' ' 4' ' ' ' DC' . 34.7 m . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 121.117 0.484 . . . . 0.0 109.901 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.59 132.25 56.69 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.374 -165.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.6 t -62.08 142.46 57.54 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.593 162.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.52 -14.68 10.29 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.1 -177.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -58.97 -43.95 91.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.435 167.564 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 29.6 p -110.75 -55.93 2.42 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.589 178.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.81 15.21 11.19 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 -172.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.9 mttt -92.0 161.57 14.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.183 167.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -90.94 135.86 33.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.347 -167.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.77 51.1 4.39 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 162.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -175.72 172.36 2.55 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 122.513 -0.404 . . . . 0.0 110.313 158.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.769 HG23 ' H ' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -86.63 155.97 3.32 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.569 -169.042 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.624 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -51.11 -49.93 59.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.278 -1.328 . . . . 0.0 112.391 156.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.657 ' H ' HG12 ' E' ' 12' ' ' ILE . 16.4 tpt85 -61.21 -22.79 65.09 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.938 -168.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.769 ' H ' HG23 ' E' ' 12' ' ' ILE 0.287 0.0 OUTLIER -115.78 27.07 9.54 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.538 -171.24 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.1 t -93.9 159.44 15.18 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.718 -165.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . 0.43 ' O ' ' HB3' ' E' ' 18' ' ' ALA . 0.0 OUTLIER -145.75 28.26 1.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.401 168.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' E' ' 17' ' ' ARG . . . . . . . . 0 C--O 1.238 0.464 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.414 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.827 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.329 0 O4'-C1'-N19 109.331 1.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.836 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.59 1 P-O3'-C3' 107.78 -9.933 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.836 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.658 1 P-O3'-C3' 107.676 -10.02 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.828 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.71 1 P-O3'-C3' 107.817 -9.902 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.759 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.799 1 P-O3'-C3' 108.457 -9.369 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.567 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 12.3 p . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.508 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.1 OUTLIER -113.62 135.64 53.7 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.42 -165.123 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 t -61.69 142.69 57.05 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.728 161.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -119.59 -11.86 9.38 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.436 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.53 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -58.82 -42.44 89.17 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.862 -0.524 . . . . 0.0 110.4 166.024 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.5 p -110.39 -55.97 2.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.684 175.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 118.41 7.28 11.15 Favored Glycine 0 CA--C 1.52 0.405 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.206 -173.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.06 171.23 10.0 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.521 -0.339 . . . . 0.0 110.219 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -95.95 137.63 34.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.355 -167.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.73 48.59 10.04 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 162.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.8 p-80 -171.98 169.59 5.62 Favored 'General case' 0 C--O 1.239 0.524 0 O-C-N 122.431 -0.452 . . . . 0.0 110.289 156.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.656 HG12 ' H ' ' E' ' 14' ' ' ARG . 0.6 OUTLIER -88.98 154.44 3.17 Favored 'Isoleucine or valine' 0 C--O 1.246 0.89 0 CA-C-N 114.616 -1.174 . . . . 0.0 109.089 -167.599 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.631 ' HB2' ' N4 ' ' D' ' 2' ' ' ' DC' . . . -52.02 -46.06 64.84 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 113.79 -1.55 . . . . 0.0 113.009 158.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.656 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -59.37 -11.77 4.81 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.392 0.615 . . . . 0.0 111.404 -167.559 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.435 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.259 0.0 OUTLIER -127.53 13.85 7.04 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.557 -167.367 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 24.0 t -87.08 165.55 15.7 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 -160.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.06 28.4 0.92 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.26 167.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.557 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.369 169.961 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_