data_1hvo_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 1hvo _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 . . . . . . . . . . . . . 1.1 ptpm? . . . . . 0 C--O 1.239 0.513 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -60.02 142.02 54.66 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.67 156.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -111.49 -10.23 14.17 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.464 -1.243 . . . . 0.0 111.676 177.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -61.85 -44.53 96.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.242 170.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 20.3 p -113.64 -39.04 4.14 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 114.946 -1.024 . . . . 0.0 110.722 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.5 16.27 25.07 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.92 172.14 8.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.359 -0.42 . . . . 0.0 110.381 172.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -99.39 137.23 38.18 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.32 -167.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.78 43.78 17.08 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.532 -1.027 . . . . 0.0 110.532 161.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -162.63 -176.65 5.12 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 122.349 -0.501 . . . . 0.0 110.077 156.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.448 ' CG2' ' ND2' ' E' ' 15' ' ' ASN . 1.7 tp -118.6 145.06 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 121.867 0.841 . . . . 0.0 109.698 -159.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.404 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -64.52 -37.34 87.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.003 -167.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -18.27 59.6 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.452 -168.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.462 ' N ' ' ND2' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -120.5 15.32 12.03 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.934 -163.836 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 36.0 t -80.43 126.66 31.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.578 -160.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.16 -47.81 69.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.254 162.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.59 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.307 -170.081 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.457 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.1 t -59.67 135.9 57.82 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.908 157.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -115.39 0.68 13.5 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.793 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -65.85 -55.59 16.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.194 0.521 . . . . 0.0 110.196 162.591 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 24.3 p -97.9 -44.69 6.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.732 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.9 -36.52 2.61 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.553 -172.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -64.02 166.85 7.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.36 -0.42 . . . . 0.0 110.244 -168.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.67 134.35 34.47 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.277 -164.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.58 -67.72 0.44 Allowed Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 163.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -92.01 -178.27 4.95 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 122.593 -0.357 . . . . 0.0 110.231 -160.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.522 HG23 ' HB3' ' E' ' 15' ' ' ASN . 3.1 tp -102.04 148.96 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.56 -160.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -57.37 -56.14 25.68 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.287 -1.324 . . . . 0.0 111.619 175.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -11.46 11.39 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.5 0.667 . . . . 0.0 110.47 -170.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.522 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -116.19 16.06 15.93 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.251 -172.765 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 33.6 t -85.44 156.64 20.74 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -163.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.33 -37.0 5.4 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.203 163.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.578 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.389 -173.516 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.2 ptpm? . . . . . 0 C--O 1.237 0.419 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -60.36 140.25 57.25 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.796 156.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.5 -13.61 14.81 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.825 -1.079 . . . . 0.0 111.424 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.401 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -62.09 -41.13 97.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.141 173.743 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . 0.493 ' HB3' ' HA ' ' E' ' 18' ' ' ALA . 18.4 p -113.87 -38.71 4.16 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.719 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 119.64 -22.19 8.84 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.75 170.87 15.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.296 -169.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.92 141.1 28.78 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.27 -167.154 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.33 -69.31 0.43 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.401 -1.08 . . . . 0.0 110.401 161.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -96.51 -179.34 4.58 Favored 'General case' 0 C--N 1.332 -0.196 0 O-C-N 122.472 -0.428 . . . . 0.0 110.201 -160.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.448 ' CG2' ' ND2' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -117.0 146.64 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 122.294 1.045 . . . . 0.0 110.474 -161.967 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.401 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -64.25 -36.12 83.05 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.514 0.673 . . . . 0.0 110.959 -158.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -16.11 47.87 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.538 -167.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.461 ' N ' ' ND2' ' E' ' 15' ' ' ASN . 0.1 OUTLIER -120.9 17.36 11.79 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.765 -165.003 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.6 t -80.97 159.91 24.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.654 -161.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -135.67 17.19 3.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.547 169.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . 0.493 ' HA ' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.241 0.613 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.39 -170.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.484 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.1 t -60.02 133.18 55.85 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.892 157.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.34 -10.63 16.89 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.657 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.479 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -61.87 -56.62 17.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.179 170.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 24.1 p -96.04 -45.71 6.79 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.685 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.91 -21.0 5.93 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.55 173.71 11.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.307 -0.447 . . . . 0.0 110.352 -169.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -100.84 128.67 46.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.339 -165.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.68 46.3 3.22 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 161.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 -172.76 -177.64 1.71 Allowed 'General case' 0 N--CA 1.465 0.29 0 O-C-N 122.511 -0.405 . . . . 0.0 110.229 158.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.528 HG21 ' HB3' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -104.74 146.14 12.35 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.844 -162.711 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.52 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -54.26 -54.1 44.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.075 172.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -10.52 10.68 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.559 0.695 . . . . 0.0 110.602 -168.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.528 ' HB3' HG21 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -116.37 15.53 15.78 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.085 -0.962 . . . . 0.0 110.38 -172.905 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 t -89.78 128.46 36.14 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.967 -0.458 . . . . 0.0 109.839 -160.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.78 -35.27 29.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.303 165.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.426 -171.501 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 pttp . . . . . 0 C--O 1.234 0.285 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 t -61.76 146.49 49.24 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.911 163.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -117.78 -12.34 10.24 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.274 -173.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -62.04 -50.64 71.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.234 0.54 . . . . 0.0 110.17 164.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 p -107.18 -36.48 6.55 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.082 -173.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 115.16 -28.54 7.89 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -74.5 153.1 39.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.278 -168.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -76.09 135.98 39.87 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.333 -165.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.12 -72.18 0.47 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.366 -1.094 . . . . 0.0 110.366 163.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -90.28 -174.81 4.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.245 0.545 . . . . 0.0 110.389 -158.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.506 HG23 ' ND2' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -109.72 145.09 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-O 121.815 0.817 . . . . 0.0 110.23 -166.291 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.25 -38.92 69.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.553 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -70.09 -33.05 71.39 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.186 -170.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.506 ' ND2' HG23 ' E' ' 12' ' ' ILE 0.258 0.0 OUTLIER -108.61 43.92 1.19 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 114.331 -1.304 . . . . 0.0 110.229 -177.715 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.6 t -87.73 157.1 19.14 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.557 -170.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -112.83 -38.92 4.41 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.125 163.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.646 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.297 -168.86 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.238 0.489 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -60.41 139.43 57.69 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.491 152.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -115.01 4.21 14.66 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.783 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.436 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -70.87 -46.16 63.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.29 164.209 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 21.9 p -112.88 -16.88 12.63 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.671 -177.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.8 17.54 79.76 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -98.17 172.25 7.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.44 -0.38 . . . . 0.0 110.342 170.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -91.09 130.48 36.98 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.285 -164.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.61 59.92 2.74 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 160.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -176.95 175.02 1.65 Allowed 'General case' 0 C--O 1.234 0.269 0 O-C-N 122.073 -0.663 . . . . 0.0 110.207 154.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.484 HG23 ' ND2' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -112.53 132.67 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-O 122.267 1.032 . . . . 0.0 109.225 -155.13 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.452 ' N ' ' CD1' ' E' ' 12' ' ' ILE . . . -60.33 -35.72 76.31 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.608 -160.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.42 -16.77 50.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.516 0.675 . . . . 0.0 110.564 -166.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.494 ' N ' ' ND2' ' E' ' 15' ' ' ASN . 0.1 OUTLIER -120.39 17.26 12.2 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.698 -165.349 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.1 t -80.9 134.0 35.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.622 -162.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.33 -30.24 11.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.294 169.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.616 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.378 -169.649 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.236 0.369 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.9 t -61.2 137.4 58.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.597 158.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.94 -5.13 14.91 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.871 177.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.468 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -62.53 -55.13 30.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.133 166.585 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.9 p -103.13 -39.49 6.84 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.645 -176.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.2 18.04 23.02 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -176.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.62 175.05 6.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.336 168.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -102.82 140.88 36.52 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.255 -167.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.31 44.7 7.86 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 161.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -172.04 177.84 3.11 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 122.482 -0.423 . . . . 0.0 110.142 158.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.448 ' CG2' ' HB3' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -108.09 149.68 11.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 122.122 0.963 . . . . 0.0 110.505 -163.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.468 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -60.74 -54.56 43.76 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.948 -169.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.05 -16.45 52.0 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.563 0.697 . . . . 0.0 110.497 -170.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.448 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.274 0.0 OUTLIER -101.96 18.24 21.14 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.235 -176.82 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 29.3 t -91.38 150.29 21.34 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.877 -0.514 . . . . 0.0 109.717 -163.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 mtm105 -103.49 -39.89 6.57 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.215 164.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.569 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.269 -168.003 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.479 0 N-CA-C 110.164 -0.309 . . . . 0.0 110.164 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.3 t -60.47 140.87 57.07 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.577 156.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -112.86 -10.99 13.51 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.595 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.443 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -60.61 -44.71 95.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.284 169.747 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.4 p -110.79 -45.18 3.52 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.832 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 122.74 -32.2 4.52 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.514 -1.035 . . . . 0.0 110.514 -174.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -63.27 153.59 34.27 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.115 -0.543 . . . . 0.0 110.325 -174.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.07 143.04 29.99 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.386 -163.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.72 52.65 6.34 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 162.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 27.1 p-80 -173.51 -177.48 1.47 Allowed 'General case' 0 C--O 1.237 0.426 0 O-C-N 122.316 -0.52 . . . . 0.0 109.914 155.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.448 ' CG2' ' ND2' ' E' ' 15' ' ' ASN . 1.5 tp -116.79 143.07 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 CA-C-O 122.264 1.03 . . . . 0.0 109.293 -154.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.443 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -63.77 -44.99 91.79 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.906 -164.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.41 -19.57 63.59 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 121.805 0.812 . . . . 0.0 110.352 -169.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.464 ' N ' ' ND2' ' E' ' 15' ' ' ASN . 0.1 OUTLIER -106.99 16.43 24.25 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.946 -170.117 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 t -87.53 132.01 34.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.634 -161.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.23 17.9 7.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.331 165.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.512 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.346 -168.136 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 121.778 0.799 . . . . 0.0 110.852 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.4 t -60.07 136.73 58.11 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.191 168.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -104.55 -15.62 15.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.419 174.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.464 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -60.75 -38.75 86.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.068 178.569 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 19.1 p -111.38 -50.69 2.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 113.76 -1.564 . . . . 0.0 110.895 171.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.89 13.54 9.23 Favored Glycine 0 CA--C 1.522 0.512 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.849 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -100.3 163.6 12.32 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.563 -0.319 . . . . 0.0 110.363 172.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -90.33 143.51 26.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.239 -166.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.51 -69.06 0.33 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 164.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 45.3 p-80 -89.15 -178.77 5.74 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.286 -0.457 . . . . 0.0 110.331 -165.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.478 HG21 ' HB3' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -109.5 151.64 11.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.961 0.886 . . . . 0.0 110.527 -166.479 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.464 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -59.95 -55.08 38.44 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.259 -172.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . 0.434 ' N ' HD11 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -62.19 -14.15 34.84 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.684 0.754 . . . . 0.0 110.546 -170.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.478 ' HB3' HG21 ' E' ' 12' ' ' ILE 0.264 0.0 OUTLIER -109.48 16.91 21.93 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.968 -174.11 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 37.0 t -77.63 132.74 38.38 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -162.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -84.6 -38.05 20.38 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.131 163.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.623 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.296 -168.951 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt . . . . . 0 C--O 1.235 0.331 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -60.57 148.57 37.62 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.953 163.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.5 -9.81 10.77 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.462 -175.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -64.48 -51.27 63.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.237 0.541 . . . . 0.0 110.193 164.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 p -109.02 -33.41 6.91 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.036 -172.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 105.55 -30.0 10.53 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -176.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -63.35 135.58 57.1 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.282 -0.459 . . . . 0.0 110.236 -172.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -67.25 139.79 57.36 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.311 -164.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.43 -69.5 0.43 Allowed Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 162.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 -87.53 169.67 11.99 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.423 -0.457 . . . . 0.0 110.45 -159.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.534 HG23 ' HB3' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -91.59 148.9 4.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.359 -172.791 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.511 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -57.76 -50.37 73.46 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.486 177.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -11.6 16.78 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.7 0.762 . . . . 0.0 110.473 -169.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.534 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -119.7 15.74 12.73 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.78 -169.821 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.93 -94.47 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.821 -0.55 . . . . 0.0 109.703 -157.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 61.29 74.83 0.43 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 121.832 -0.542 . . . . 0.0 109.916 -154.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.492 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.332 -170.068 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.205 0 CA-C-O 120.901 0.381 . . . . 0.0 110.645 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.0 t -60.76 148.79 37.73 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.172 167.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -116.58 -14.39 10.88 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.103 -172.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -62.28 -54.22 43.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.164 164.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.1 p -105.52 -22.35 13.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.013 -170.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.87 -31.27 7.42 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.8 mmtm -61.78 166.12 4.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.107 -0.547 . . . . 0.0 110.345 -174.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.95 139.61 32.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.324 -165.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.35 47.62 5.66 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 161.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 26.7 p-80 -169.56 169.57 8.67 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 122.29 -0.535 . . . . 0.0 110.281 155.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.448 ' CG2' ' ND2' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -104.69 141.75 19.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 122.066 0.936 . . . . 0.0 110.121 -167.122 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.86 -34.37 69.68 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.581 -169.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -15.87 54.45 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.562 -168.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.499 ' N ' ' ND2' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -128.54 21.01 6.09 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.364 -162.431 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 39.9 t -74.84 147.44 41.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.433 -161.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 2.9 tpt85 -90.48 -51.28 5.49 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.853 158.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.633 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.306 -169.519 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.98 0.419 . . . . 0.0 110.638 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.4 t -61.63 136.98 58.21 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.778 167.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -114.03 -3.67 13.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.185 -1.371 . . . . 0.0 111.844 175.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.466 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -62.53 -49.73 74.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.258 0.551 . . . . 0.0 110.247 166.182 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 25.2 p -106.18 -48.86 3.49 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.72 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.11 27.68 3.36 Favored Glycine 0 CA--C 1.525 0.673 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.483 -175.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -116.65 147.41 41.96 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.041 -0.579 . . . . 0.0 110.415 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -74.82 146.12 42.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.334 -164.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.85 45.73 56.35 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 160.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 23.5 p-80 -165.84 168.91 15.48 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 122.368 -0.489 . . . . 0.0 110.011 155.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.495 HG22 ' HB3' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -102.85 147.39 9.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 122.221 1.01 . . . . 0.0 110.464 -162.782 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.466 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -59.42 -52.78 64.15 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.027 -169.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.9 -16.88 54.18 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.38 -171.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.495 ' HB3' HG22 ' E' ' 12' ' ' ILE 0.274 0.0 OUTLIER -101.96 16.24 26.59 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.288 -175.912 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.1 t -86.37 149.9 24.7 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -162.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.56 17.57 6.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.454 164.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.579 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.351 -167.846 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.321 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.0 t -61.85 137.92 58.29 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.671 160.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.9 -9.96 14.76 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.708 177.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.469 ' CB ' ' HA ' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -61.68 -44.4 97.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.193 171.412 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 20.4 p -110.94 -47.54 3.21 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.649 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.17 22.99 5.38 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.687 -175.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.2 155.25 24.29 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.001 -0.599 . . . . 0.0 110.471 -179.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -87.34 138.1 31.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.391 -171.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.3 -63.48 0.61 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 167.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 49.4 p-80 -101.49 176.59 5.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.154 0.502 . . . . 0.0 110.399 -165.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.524 HG22 ' HB3' ' E' ' 15' ' ' ASN . 1.7 tt -97.82 155.46 3.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.251 -175.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.469 ' HA ' ' CB ' ' E' ' 5' ' ' ASN . . . -55.94 -46.43 78.52 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.709 171.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -10.25 8.04 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-O 121.557 0.694 . . . . 0.0 110.505 -169.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.524 ' HB3' HG22 ' E' ' 12' ' ' ILE 0.258 0.0 OUTLIER -125.21 15.31 8.39 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.949 -167.526 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.1 t -81.47 143.69 31.9 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.887 -0.508 . . . . 0.0 109.735 -158.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -115.0 10.04 16.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.438 166.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.556 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.42 -173.538 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . 0.447 ' NZ ' ' CB ' ' E' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.465 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -59.66 136.68 58.07 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.911 157.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.26 -0.61 17.67 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.862 177.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.509 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -67.17 -56.56 9.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.173 165.476 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.0 p -102.01 -38.13 7.9 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.73 -175.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.75 17.6 27.73 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.5 mttp -94.62 173.69 7.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.271 168.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.83 134.59 43.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.349 -166.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.97 50.13 5.03 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 163.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -172.43 -175.68 1.42 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 122.465 -0.432 . . . . 0.0 110.116 157.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.526 HG23 ' HB3' ' E' ' 15' ' ' ASN . 5.1 tp -108.6 144.87 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.82 -161.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.509 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -57.43 -54.66 44.25 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.519 -1.218 . . . . 0.0 111.557 175.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -11.65 12.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.576 0.703 . . . . 0.0 110.506 -169.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.526 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -115.91 16.8 16.16 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.218 -172.722 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.7 t -89.52 145.58 25.19 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.088 0.471 . . . . 0.0 109.831 -162.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.45 -24.54 12.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.314 167.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.623 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.341 -169.802 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.824 0.345 . . . . 0.0 110.477 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -61.5 142.49 57.01 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.739 160.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.6 -3.09 9.84 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.745 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 5' ' ' ASN . . . . . 0.468 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -61.4 -47.37 86.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.25 0.548 . . . . 0.0 110.077 162.74 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' E' E ' 6' ' ' CYS . . . . . 0.415 ' HB3' ' CB ' ' E' ' 18' ' ' ALA . 24.7 p -110.22 -46.1 3.48 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.906 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.66 -36.91 2.15 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -177.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.92 173.64 5.18 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.269 -168.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.71 145.04 25.13 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.326 -163.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.13 49.78 8.21 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 160.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 35.5 p-80 -175.0 175.23 2.35 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 122.361 -0.493 . . . . 0.0 110.063 156.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 12' ' ' ILE . . . . . 0.47 HD12 HG22 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -106.52 151.72 8.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.951 0.882 . . . . 0.0 110.518 -163.626 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' E' E ' 13' ' ' ALA . . . . . 0.468 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -61.9 -52.84 62.46 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.972 -169.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -62.2 -16.9 56.28 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.283 -171.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 15' ' ' ASN . . . . . 0.468 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -102.33 19.63 18.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.097 -176.137 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 23.9 t -94.66 164.93 12.75 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.289 0.566 . . . . 0.0 109.848 -163.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -142.1 21.11 2.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.357 -173.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 18' ' ' ALA . . . . . 0.415 ' CB ' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.241 0.651 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.217 -169.78 . . . . . . . . 1 1 . 1 . 001 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 . 001 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 . 001 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 . 001 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 . 001 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 . 001 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.523 HG13 ' C2 ' ' D' ' 5' ' ' ' DC' . 9.9 p . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.1 ptpm? -105.13 147.31 28.08 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.197 -162.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -60.02 142.02 54.66 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.67 156.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -111.49 -10.23 14.17 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.464 -1.243 . . . . 0.0 111.676 177.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -61.85 -44.53 96.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.242 170.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 20.3 p -113.64 -39.04 4.14 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 114.946 -1.024 . . . . 0.0 110.722 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.5 16.27 25.07 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.92 172.14 8.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.359 -0.42 . . . . 0.0 110.381 172.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -99.39 137.23 38.18 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.32 -167.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.78 43.78 17.08 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.532 -1.027 . . . . 0.0 110.532 161.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -162.63 -176.65 5.12 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 122.349 -0.501 . . . . 0.0 110.077 156.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.498 HD13 ' N4 ' ' D' ' 4' ' ' ' DC' . 1.7 tp -118.6 145.06 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 121.867 0.841 . . . . 0.0 109.698 -159.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.404 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -64.52 -37.34 87.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.003 -167.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -18.27 59.6 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.452 -168.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.462 ' ND2' ' N ' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -120.5 15.32 12.03 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.934 -163.836 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 36.0 t -80.43 126.66 31.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.578 -160.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.16 -47.81 69.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.254 162.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.59 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.307 -170.081 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.825 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.392 0 O4'-C1'-N19 109.33 1.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.825 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.608 1.514 1 P-O3'-C3' 107.769 -9.942 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.807 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.629 1 P-O3'-C3' 107.693 -10.006 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.807 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.739 1 P-O3'-C3' 107.86 -9.866 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.726 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.861 1 P-O3'-C3' 108.429 -9.393 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.517 HG13 ' C2 ' ' D' ' 5' ' ' ' DC' . 4.3 p . . . . . 0 N--CA 1.476 0.874 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.41 144.83 29.73 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.208 161.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.1 t -59.67 135.9 57.82 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.908 157.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -115.39 0.68 13.5 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.793 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -65.85 -55.59 16.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.194 0.521 . . . . 0.0 110.196 162.591 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 24.3 p -97.9 -44.69 6.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.732 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.9 -36.52 2.61 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.553 -172.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -64.02 166.85 7.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.36 -0.42 . . . . 0.0 110.244 -168.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.67 134.35 34.47 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.277 -164.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.58 -67.72 0.44 Allowed Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 163.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -92.01 -178.27 4.95 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 122.593 -0.357 . . . . 0.0 110.231 -160.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.522 HG23 ' HB3' ' E' ' 15' ' ' ASN . 3.1 tp -102.04 148.96 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.56 -160.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -57.37 -56.14 25.68 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.287 -1.324 . . . . 0.0 111.619 175.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -11.46 11.39 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.5 0.667 . . . . 0.0 110.47 -170.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.522 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -116.19 16.06 15.93 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.251 -172.765 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 33.6 t -85.44 156.64 20.74 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -163.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.33 -37.0 5.4 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.203 163.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.578 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.389 -173.516 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.826 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.366 0 O4'-C1'-N19 109.333 1.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.826 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.56 1 P-O3'-C3' 107.776 -9.937 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.799 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.727 1 P-O3'-C3' 107.677 -10.02 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.799 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.675 1 P-O3'-C3' 107.815 -9.904 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.729 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.793 1 P-O3'-C3' 108.449 -9.376 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.434 ' CG1' ' C2 ' ' D' ' 5' ' ' ' DC' . 7.8 p . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 121.466 0.651 . . . . 0.0 109.665 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.2 ptpm? -104.5 141.15 36.88 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.325 -173.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -60.36 140.25 57.25 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.796 156.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.5 -13.61 14.81 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.825 -1.079 . . . . 0.0 111.424 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.401 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -62.09 -41.13 97.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.141 173.743 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . 0.493 ' HB3' ' HA ' ' E' ' 18' ' ' ALA . 18.4 p -113.87 -38.71 4.16 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.719 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 119.64 -22.19 8.84 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.75 170.87 15.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.296 -169.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.92 141.1 28.78 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.27 -167.154 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.33 -69.31 0.43 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.401 -1.08 . . . . 0.0 110.401 161.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -96.51 -179.34 4.58 Favored 'General case' 0 C--N 1.332 -0.196 0 O-C-N 122.472 -0.428 . . . . 0.0 110.201 -160.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.455 HG12 ' N4 ' ' D' ' 4' ' ' ' DC' . 0.0 OUTLIER -117.0 146.64 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 122.294 1.045 . . . . 0.0 110.474 -161.967 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.401 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -64.25 -36.12 83.05 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.514 0.673 . . . . 0.0 110.959 -158.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -16.11 47.87 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.538 -167.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.461 ' ND2' ' N ' ' E' ' 15' ' ' ASN . 0.1 OUTLIER -120.9 17.36 11.79 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.765 -165.003 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.6 t -80.97 159.91 24.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.654 -161.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -135.67 17.19 3.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.547 169.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . 0.493 ' HA ' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.241 0.613 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.39 -170.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.811 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.39 0 O4'-C1'-N19 109.336 1.92 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.811 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.57 1 P-O3'-C3' 107.756 -9.953 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.826 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.694 1 P-O3'-C3' 107.706 -9.995 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.826 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.675 1 P-O3'-C3' 107.874 -9.855 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.731 " O5'" " C2'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.749 1 P-O3'-C3' 108.413 -9.406 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.507 HG13 ' C2 ' ' D' ' 5' ' ' ' DC' . 5.1 p . . . . . 0 N--CA 1.471 0.61 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.97 137.22 40.55 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.251 163.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.1 t -60.02 133.18 55.85 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.892 157.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.34 -10.63 16.89 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.657 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.479 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -61.87 -56.62 17.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.179 170.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 24.1 p -96.04 -45.71 6.79 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.685 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.91 -21.0 5.93 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.55 173.71 11.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.307 -0.447 . . . . 0.0 110.352 -169.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -100.84 128.67 46.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.339 -165.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.68 46.3 3.22 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 161.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 -172.76 -177.64 1.71 Allowed 'General case' 0 N--CA 1.465 0.29 0 O-C-N 122.511 -0.405 . . . . 0.0 110.229 158.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.528 HG21 ' HB3' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -104.74 146.14 12.35 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.844 -162.711 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.52 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -54.26 -54.1 44.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.075 172.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -10.52 10.68 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.559 0.695 . . . . 0.0 110.602 -168.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.528 ' HB3' HG21 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -116.37 15.53 15.78 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.085 -0.962 . . . . 0.0 110.38 -172.905 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 t -89.78 128.46 36.14 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.967 -0.458 . . . . 0.0 109.839 -160.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.78 -35.27 29.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.303 165.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.426 -171.501 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.823 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.317 0 O4'-C1'-N19 109.346 1.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.823 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.586 1 P-O3'-C3' 107.766 -9.945 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.828 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.642 1 P-O3'-C3' 107.691 -10.007 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.828 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.719 1 P-O3'-C3' 107.8 -9.917 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.729 " O5'" " C2'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.788 1 P-O3'-C3' 108.435 -9.387 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.494 HG13 ' C2 ' ' D' ' 5' ' ' ' DC' . 8.2 p . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 pttp -109.59 145.42 36.42 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.487 -167.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 t -61.76 146.49 49.24 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.911 163.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -117.78 -12.34 10.24 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.274 -173.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -62.04 -50.64 71.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.234 0.54 . . . . 0.0 110.17 164.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 p -107.18 -36.48 6.55 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.082 -173.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 115.16 -28.54 7.89 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -74.5 153.1 39.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.278 -168.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -76.09 135.98 39.87 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.333 -165.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.12 -72.18 0.47 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.366 -1.094 . . . . 0.0 110.366 163.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -90.28 -174.81 4.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.245 0.545 . . . . 0.0 110.389 -158.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.506 HG23 ' ND2' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -109.72 145.09 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-O 121.815 0.817 . . . . 0.0 110.23 -166.291 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.25 -38.92 69.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.553 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -70.09 -33.05 71.39 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.186 -170.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.506 ' ND2' HG23 ' E' ' 12' ' ' ILE 0.258 0.0 OUTLIER -108.61 43.92 1.19 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 114.331 -1.304 . . . . 0.0 110.229 -177.715 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.6 t -87.73 157.1 19.14 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.557 -170.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -112.83 -38.92 4.41 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.125 163.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.646 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.297 -168.86 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.832 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.369 0 O4'-C1'-N19 109.37 1.963 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.832 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.589 1 P-O3'-C3' 107.776 -9.937 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.809 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.681 1 P-O3'-C3' 107.638 -10.052 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.796 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.65 1 P-O3'-C3' 107.789 -9.926 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.728 " O5'" " C2'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.859 1 P-O3'-C3' 108.457 -9.37 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.53 HG11 " H1'" ' D' ' 5' ' ' ' DC' . 4.3 p . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.09 153.53 31.58 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 116.213 -0.449 . . . . 0.0 109.825 -159.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -60.41 139.43 57.69 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.491 152.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -115.01 4.21 14.66 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.783 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.436 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -70.87 -46.16 63.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.29 164.209 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 21.9 p -112.88 -16.88 12.63 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.671 -177.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.8 17.54 79.76 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -98.17 172.25 7.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.44 -0.38 . . . . 0.0 110.342 170.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -91.09 130.48 36.98 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.285 -164.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.61 59.92 2.74 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 160.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -176.95 175.02 1.65 Allowed 'General case' 0 C--O 1.234 0.269 0 O-C-N 122.073 -0.663 . . . . 0.0 110.207 154.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.484 HG23 ' ND2' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -112.53 132.67 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-O 122.267 1.032 . . . . 0.0 109.225 -155.13 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.452 ' N ' ' CD1' ' E' ' 12' ' ' ILE . . . -60.33 -35.72 76.31 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.608 -160.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.42 -16.77 50.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.516 0.675 . . . . 0.0 110.564 -166.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.494 ' ND2' ' N ' ' E' ' 15' ' ' ASN . 0.1 OUTLIER -120.39 17.26 12.2 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.698 -165.349 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.1 t -80.9 134.0 35.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.622 -162.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.33 -30.24 11.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.294 169.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.616 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.378 -169.649 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.822 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.359 0 O4'-C1'-N19 109.326 1.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.822 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.633 1 P-O3'-C3' 107.746 -9.962 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.809 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.627 1 P-O3'-C3' 107.666 -10.028 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.809 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.694 1 P-O3'-C3' 107.818 -9.901 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.727 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.792 1 P-O3'-C3' 108.479 -9.351 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.487 HG11 " H1'" ' D' ' 5' ' ' ' DC' . 9.9 p . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.26 142.36 33.61 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.265 -163.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.9 t -61.2 137.4 58.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.597 158.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.94 -5.13 14.91 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.871 177.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.468 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -62.53 -55.13 30.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.133 166.585 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.9 p -103.13 -39.49 6.84 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.645 -176.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.2 18.04 23.02 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -176.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.62 175.05 6.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.336 168.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -102.82 140.88 36.52 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.255 -167.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.31 44.7 7.86 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 161.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -172.04 177.84 3.11 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 122.482 -0.423 . . . . 0.0 110.142 158.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.52 HG12 ' N4 ' ' D' ' 4' ' ' ' DC' . 0.0 OUTLIER -108.09 149.68 11.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 122.122 0.963 . . . . 0.0 110.505 -163.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.468 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -60.74 -54.56 43.76 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.948 -169.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.05 -16.45 52.0 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.563 0.697 . . . . 0.0 110.497 -170.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.448 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.274 0.0 OUTLIER -101.96 18.24 21.14 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.235 -176.82 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 29.3 t -91.38 150.29 21.34 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.877 -0.514 . . . . 0.0 109.717 -163.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 mtm105 -103.49 -39.89 6.57 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.215 164.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.569 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.269 -168.003 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.821 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.347 0 O4'-C1'-N19 109.366 1.958 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.821 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.551 1 P-O3'-C3' 107.779 -9.934 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.819 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.658 1 P-O3'-C3' 107.71 -9.992 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.819 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.647 1 P-O3'-C3' 107.816 -9.903 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.735 " O5'" " C2'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.828 1 P-O3'-C3' 108.477 -9.353 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.515 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 5.7 p . . . . . 0 N--CA 1.474 0.728 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.45 147.47 25.83 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.164 160.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.3 t -60.47 140.87 57.07 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.577 156.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -112.86 -10.99 13.51 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.595 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.443 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -60.61 -44.71 95.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.284 169.747 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.4 p -110.79 -45.18 3.52 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.832 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 122.74 -32.2 4.52 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.514 -1.035 . . . . 0.0 110.514 -174.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -63.27 153.59 34.27 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.115 -0.543 . . . . 0.0 110.325 -174.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.07 143.04 29.99 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.386 -163.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.72 52.65 6.34 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 162.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 27.1 p-80 -173.51 -177.48 1.47 Allowed 'General case' 0 C--O 1.237 0.426 0 O-C-N 122.316 -0.52 . . . . 0.0 109.914 155.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.507 HD13 ' N4 ' ' D' ' 4' ' ' ' DC' . 1.5 tp -116.79 143.07 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 CA-C-O 122.264 1.03 . . . . 0.0 109.293 -154.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.443 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -63.77 -44.99 91.79 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.906 -164.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.41 -19.57 63.59 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 121.805 0.812 . . . . 0.0 110.352 -169.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.464 ' ND2' ' N ' ' E' ' 15' ' ' ASN . 0.1 OUTLIER -106.99 16.43 24.25 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.946 -170.117 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 t -87.53 132.01 34.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.634 -161.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.23 17.9 7.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.331 165.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.512 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.346 -168.136 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.818 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.302 0 O4'-C1'-N19 109.377 1.972 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.819 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.603 1 P-O3'-C3' 107.818 -9.902 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.819 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.632 1 P-O3'-C3' 107.655 -10.037 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.815 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.78 1 P-O3'-C3' 107.851 -9.874 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.729 " O5'" " C2'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.855 1 P-O3'-C3' 108.494 -9.339 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.443 HG21 ' C2 ' ' D' ' 5' ' ' ' DC' . 27.2 m . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 121.261 0.553 . . . . 0.0 109.897 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.2 136.61 54.94 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.852 -177.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.4 t -60.07 136.73 58.11 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.191 168.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . 0.5 ' CE2' ' N1 ' ' D' ' 3' ' ' ' DG' . 0.7 OUTLIER -104.55 -15.62 15.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.419 174.636 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.464 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -60.75 -38.75 86.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.068 178.569 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 19.1 p -111.38 -50.69 2.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 113.76 -1.564 . . . . 0.0 110.895 171.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.89 13.54 9.23 Favored Glycine 0 CA--C 1.522 0.512 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.849 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -100.3 163.6 12.32 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.563 -0.319 . . . . 0.0 110.363 172.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -90.33 143.51 26.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.239 -166.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.51 -69.06 0.33 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 164.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 45.3 p-80 -89.15 -178.77 5.74 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.286 -0.457 . . . . 0.0 110.331 -165.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.519 HG12 ' N4 ' ' D' ' 4' ' ' ' DC' . 0.0 OUTLIER -109.5 151.64 11.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.961 0.886 . . . . 0.0 110.527 -166.479 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.464 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -59.95 -55.08 38.44 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.259 -172.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . 0.434 ' N ' HD11 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -62.19 -14.15 34.84 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.684 0.754 . . . . 0.0 110.546 -170.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.478 ' HB3' HG21 ' E' ' 12' ' ' ILE 0.264 0.0 OUTLIER -109.48 16.91 21.93 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.968 -174.11 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 37.0 t -77.63 132.74 38.38 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -162.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -84.6 -38.05 20.38 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.131 163.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.623 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.296 -168.951 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.823 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.32 0 O4'-C1'-N19 109.312 1.889 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.823 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.59 1 P-O3'-C3' 107.79 -9.925 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.823 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.67 1 P-O3'-C3' 107.669 -10.026 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.823 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.709 1 P-O3'-C3' 107.837 -9.885 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.72 " O5'" " C2'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.775 1 P-O3'-C3' 108.497 -9.336 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . . . . . . . . . 90.3 t . . . . . 0 N--CA 1.473 0.718 0 CA-C-O 121.437 0.637 . . . . 0.0 109.858 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -122.88 148.96 44.82 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.485 -167.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -60.57 148.57 37.62 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.953 163.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.5 -9.81 10.77 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.462 -175.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -64.48 -51.27 63.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.237 0.541 . . . . 0.0 110.193 164.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 p -109.02 -33.41 6.91 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.036 -172.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 105.55 -30.0 10.53 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -176.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -63.35 135.58 57.1 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.282 -0.459 . . . . 0.0 110.236 -172.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -67.25 139.79 57.36 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.311 -164.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.43 -69.5 0.43 Allowed Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 162.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 -87.53 169.67 11.99 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.423 -0.457 . . . . 0.0 110.45 -159.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.534 HG23 ' HB3' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -91.59 148.9 4.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.359 -172.791 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.511 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -57.76 -50.37 73.46 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.486 177.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -11.6 16.78 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.7 0.762 . . . . 0.0 110.473 -169.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.534 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -119.7 15.74 12.73 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.78 -169.821 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.93 -94.47 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.821 -0.55 . . . . 0.0 109.703 -157.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 61.29 74.83 0.43 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 121.832 -0.542 . . . . 0.0 109.916 -154.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.492 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.332 -170.068 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.816 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.374 0 O4'-C1'-N19 109.263 1.829 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.816 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.608 1.537 1 P-O3'-C3' 107.754 -9.955 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.817 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.739 1 P-O3'-C3' 107.665 -10.029 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.817 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.699 1 P-O3'-C3' 107.834 -9.888 . . . . 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 1.792 1 P-O3'-C3' 108.482 -9.349 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.527 HG22 " H1'" ' D' ' 5' ' ' ' DC' . 42.4 t . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 121.035 0.445 . . . . 0.0 109.855 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.03 143.36 41.85 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.645 -170.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.0 t -60.76 148.79 37.73 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.172 167.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -116.58 -14.39 10.88 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.103 -172.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -62.28 -54.22 43.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.164 164.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.1 p -105.52 -22.35 13.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.013 -170.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.87 -31.27 7.42 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.8 mmtm -61.78 166.12 4.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.107 -0.547 . . . . 0.0 110.345 -174.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.95 139.61 32.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.324 -165.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.35 47.62 5.66 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 161.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 26.7 p-80 -169.56 169.57 8.67 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 122.29 -0.535 . . . . 0.0 110.281 155.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.52 ' HB ' ' N4 ' ' D' ' 5' ' ' ' DC' . 0.7 OUTLIER -104.69 141.75 19.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 122.066 0.936 . . . . 0.0 110.121 -167.122 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.86 -34.37 69.68 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.581 -169.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -15.87 54.45 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.562 -168.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.499 ' ND2' ' N ' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -128.54 21.01 6.09 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.364 -162.431 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 39.9 t -74.84 147.44 41.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.433 -161.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 2.9 tpt85 -90.48 -51.28 5.49 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.853 158.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.633 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.306 -169.519 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.804 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.264 0 O4'-C1'-N19 109.36 1.95 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.804 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.608 1.547 1 P-O3'-C3' 107.814 -9.905 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.805 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.598 1 P-O3'-C3' 107.626 -10.061 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.805 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.693 1 P-O3'-C3' 107.798 -9.919 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.73 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.798 1 P-O3'-C3' 108.422 -9.398 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.41 ' CG1' ' N ' ' E' ' 2' ' ' LYS . 69.6 t . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 121.544 0.688 . . . . 0.0 109.887 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . 0.41 ' N ' ' CG1' ' E' ' 1' ' ' VAL . 0.3 OUTLIER -114.4 149.48 36.11 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.638 -173.418 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.4 t -61.63 136.98 58.21 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.778 167.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -114.03 -3.67 13.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.185 -1.371 . . . . 0.0 111.844 175.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.466 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -62.53 -49.73 74.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.258 0.551 . . . . 0.0 110.247 166.182 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 25.2 p -106.18 -48.86 3.49 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.72 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.11 27.68 3.36 Favored Glycine 0 CA--C 1.525 0.673 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.483 -175.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -116.65 147.41 41.96 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.041 -0.579 . . . . 0.0 110.415 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -74.82 146.12 42.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.334 -164.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.85 45.73 56.35 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 160.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 23.5 p-80 -165.84 168.91 15.48 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 122.368 -0.489 . . . . 0.0 110.011 155.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.495 HG22 ' HB3' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -102.85 147.39 9.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 122.221 1.01 . . . . 0.0 110.464 -162.782 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.466 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -59.42 -52.78 64.15 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.027 -169.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.9 -16.88 54.18 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.38 -171.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.495 ' HB3' HG22 ' E' ' 12' ' ' ILE 0.274 0.0 OUTLIER -101.96 16.24 26.59 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.288 -175.912 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.1 t -86.37 149.9 24.7 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -162.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.56 17.57 6.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.454 164.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.579 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.351 -167.846 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.816 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.323 0 O4'-C1'-N19 109.323 1.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.816 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.643 1 P-O3'-C3' 107.79 -9.925 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.824 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.634 1 P-O3'-C3' 107.645 -10.046 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.824 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.698 1 P-O3'-C3' 107.805 -9.913 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.731 " O5'" " C2'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.785 1 P-O3'-C3' 108.432 -9.39 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.505 HG13 ' C2 ' ' D' ' 5' ' ' ' DC' . 10.0 p . . . . . 0 N--CA 1.475 0.781 0 CA-C-O 121.317 0.58 . . . . 0.0 109.765 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.4 133.77 41.56 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.389 -167.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.0 t -61.85 137.92 58.29 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.671 160.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.9 -9.96 14.76 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.708 177.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.469 ' CB ' ' HA ' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -61.68 -44.4 97.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.193 171.412 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 20.4 p -110.94 -47.54 3.21 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.649 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.17 22.99 5.38 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.687 -175.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.2 155.25 24.29 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.001 -0.599 . . . . 0.0 110.471 -179.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -87.34 138.1 31.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.391 -171.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.3 -63.48 0.61 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 167.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 49.4 p-80 -101.49 176.59 5.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.154 0.502 . . . . 0.0 110.399 -165.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.524 HG22 ' HB3' ' E' ' 15' ' ' ASN . 1.7 tt -97.82 155.46 3.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.251 -175.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.469 ' HA ' ' CB ' ' E' ' 5' ' ' ASN . . . -55.94 -46.43 78.52 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.709 171.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -10.25 8.04 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-O 121.557 0.694 . . . . 0.0 110.505 -169.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.524 ' HB3' HG22 ' E' ' 12' ' ' ILE 0.258 0.0 OUTLIER -125.21 15.31 8.39 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.949 -167.526 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.1 t -81.47 143.69 31.9 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.887 -0.508 . . . . 0.0 109.735 -158.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -115.0 10.04 16.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.438 166.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.556 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.42 -173.538 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.823 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.29 0 O4'-C1'-N19 109.329 1.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.823 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.608 1.536 1 P-O3'-C3' 107.821 -9.899 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.803 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.64 1 P-O3'-C3' 107.638 -10.052 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.803 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.732 1 P-O3'-C3' 107.825 -9.896 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.729 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.856 1 P-O3'-C3' 108.484 -9.346 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.514 HG11 ' C2 ' ' D' ' 5' ' ' ' DC' . 6.8 p . . . . . 0 N--CA 1.477 0.922 0 CA-C-O 121.442 0.639 . . . . 0.0 109.662 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . 0.447 ' CB ' ' NZ ' ' E' ' 2' ' ' LYS . 0.0 OUTLIER -105.31 147.18 28.41 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.332 -170.121 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -59.66 136.68 58.07 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.911 157.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.26 -0.61 17.67 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.862 177.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.509 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -67.17 -56.56 9.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.173 165.476 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.0 p -102.01 -38.13 7.9 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.73 -175.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.75 17.6 27.73 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.5 mttp -94.62 173.69 7.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.271 168.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.83 134.59 43.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.349 -166.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.97 50.13 5.03 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 163.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -172.43 -175.68 1.42 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 122.465 -0.432 . . . . 0.0 110.116 157.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.526 HG23 ' HB3' ' E' ' 15' ' ' ASN . 5.1 tp -108.6 144.87 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.82 -161.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.509 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -57.43 -54.66 44.25 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.519 -1.218 . . . . 0.0 111.557 175.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -11.65 12.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.576 0.703 . . . . 0.0 110.506 -169.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.526 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -115.91 16.8 16.16 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.218 -172.722 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.7 t -89.52 145.58 25.19 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.088 0.471 . . . . 0.0 109.831 -162.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.45 -24.54 12.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.314 167.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.623 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.341 -169.802 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 1' ' ' ' DA' . . . . . 0.818 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.353 0 O4'-C1'-N19 109.299 1.873 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.818 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.571 1 P-O3'-C3' 107.785 -9.929 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.817 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.67 1 P-O3'-C3' 107.641 -10.05 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 4' ' ' ' DC' . . . . . 0.817 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.698 1 P-O3'-C3' 107.83 -9.892 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 5' ' ' ' DC' . . . . . 0.73 " O5'" " C2'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.92 1 P-O3'-C3' 108.47 -9.358 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 1' ' ' VAL . . . . . 0.527 HG13 " H1'" ' D' ' 5' ' ' ' DC' . 14.5 p . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt -105.94 144.23 32.96 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.477 -163.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -61.5 142.49 57.01 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.739 160.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.6 -3.09 9.84 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.745 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 5' ' ' ASN . . . . . 0.468 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -61.4 -47.37 86.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.25 0.548 . . . . 0.0 110.077 162.74 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' E' E ' 6' ' ' CYS . . . . . 0.415 ' HB3' ' CB ' ' E' ' 18' ' ' ALA . 24.7 p -110.22 -46.1 3.48 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.906 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.66 -36.91 2.15 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -177.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.92 173.64 5.18 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.269 -168.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.71 145.04 25.13 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.326 -163.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.13 49.78 8.21 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 160.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 35.5 p-80 -175.0 175.23 2.35 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 122.361 -0.493 . . . . 0.0 110.063 156.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 12' ' ' ILE . . . . . 0.518 HG12 ' N4 ' ' D' ' 4' ' ' ' DC' . 0.0 OUTLIER -106.52 151.72 8.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.951 0.882 . . . . 0.0 110.518 -163.626 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . 0.468 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -61.9 -52.84 62.46 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.972 -169.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -62.2 -16.9 56.28 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.283 -171.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 15' ' ' ASN . . . . . 0.468 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -102.33 19.63 18.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.097 -176.137 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 23.9 t -94.66 164.93 12.75 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.289 0.566 . . . . 0.0 109.848 -163.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -142.1 21.11 2.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.357 -173.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 18' ' ' ALA . . . . . 0.415 ' CB ' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.241 0.651 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.217 -169.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.1 ptpm? . . . . . 0 C--O 1.239 0.513 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -60.02 142.02 54.66 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.67 156.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -111.49 -10.23 14.17 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.464 -1.243 . . . . 0.0 111.676 177.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -61.85 -44.53 96.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.242 170.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 20.3 p -113.64 -39.04 4.14 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 114.946 -1.024 . . . . 0.0 110.722 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.5 16.27 25.07 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.92 172.14 8.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.359 -0.42 . . . . 0.0 110.381 172.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -99.39 137.23 38.18 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.32 -167.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.78 43.78 17.08 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.532 -1.027 . . . . 0.0 110.532 161.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -162.63 -176.65 5.12 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 122.349 -0.501 . . . . 0.0 110.077 156.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.675 HG23 ' OD1' ' E' ' 15' ' ' ASN . 1.7 tp -118.6 145.06 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 121.867 0.841 . . . . 0.0 109.698 -159.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.52 -37.34 87.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.003 -167.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -18.27 59.6 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.452 -168.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.675 ' OD1' HG23 ' E' ' 12' ' ' ILE . 0.3 OUTLIER -120.5 15.32 12.03 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.934 -163.836 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 36.0 t -80.43 126.66 31.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.578 -160.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.16 -47.81 69.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.254 162.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.59 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.307 -170.081 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.457 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.1 t -59.67 135.9 57.82 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.908 157.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -115.39 0.68 13.5 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.793 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 25.9 t-20 -65.85 -55.59 16.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.194 0.521 . . . . 0.0 110.196 162.591 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 24.3 p -97.9 -44.69 6.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.732 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.9 -36.52 2.61 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.553 -172.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -64.02 166.85 7.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.36 -0.42 . . . . 0.0 110.244 -168.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.67 134.35 34.47 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.277 -164.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.58 -67.72 0.44 Allowed Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 163.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -92.01 -178.27 4.95 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 122.593 -0.357 . . . . 0.0 110.231 -160.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.741 HG23 ' HB3' ' E' ' 15' ' ' ASN . 3.1 tp -102.04 148.96 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.56 -160.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.557 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -57.37 -56.14 25.68 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.287 -1.324 . . . . 0.0 111.619 175.131 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.409 ' H ' HG13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.58 -11.46 11.39 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.5 0.667 . . . . 0.0 110.47 -170.035 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.741 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.1 OUTLIER -116.19 16.06 15.93 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.251 -172.765 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 33.6 t -85.44 156.64 20.74 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -163.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.33 -37.0 5.4 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.203 163.569 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.578 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.389 -173.516 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.2 ptpm? . . . . . 0 C--O 1.237 0.419 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -60.36 140.25 57.25 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.796 156.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.5 -13.61 14.81 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.825 -1.079 . . . . 0.0 111.424 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.534 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 27.7 t-20 -62.09 -41.13 97.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.141 173.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 6' ' ' CYS . . . . . 0.501 ' HB3' ' HA ' ' E' ' 18' ' ' ALA . 18.4 p -113.87 -38.71 4.16 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.719 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 119.64 -22.19 8.84 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.75 170.87 15.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.296 -169.138 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.92 141.1 28.78 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.27 -167.154 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.33 -69.31 0.43 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.401 -1.08 . . . . 0.0 110.401 161.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -96.51 -179.34 4.58 Favored 'General case' 0 C--N 1.332 -0.196 0 O-C-N 122.472 -0.428 . . . . 0.0 110.201 -160.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.773 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -117.0 146.64 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 122.294 1.045 . . . . 0.0 110.474 -161.967 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.773 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -64.25 -36.12 83.05 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.514 0.673 . . . . 0.0 110.959 -158.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.658 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.87 -16.11 47.87 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.538 -167.536 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.703 ' OD1' HG23 ' E' ' 12' ' ' ILE . 0.4 OUTLIER -120.9 17.36 11.79 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.765 -165.003 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.6 t -80.97 159.91 24.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.654 -161.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -135.67 17.19 3.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.547 169.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 18' ' ' ALA . . . . . 0.501 ' HA ' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.241 0.613 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.39 -170.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.484 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.1 t -60.02 133.18 55.85 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.892 157.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.34 -10.63 16.89 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.657 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.461 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 21.4 t-20 -61.87 -56.62 17.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.179 170.316 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 24.1 p -96.04 -45.71 6.79 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.685 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.91 -21.0 5.93 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.55 173.71 11.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.307 -0.447 . . . . 0.0 110.352 -169.433 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -100.84 128.67 46.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.339 -165.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.68 46.3 3.22 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 161.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 -172.76 -177.64 1.71 Allowed 'General case' 0 N--CA 1.465 0.29 0 O-C-N 122.511 -0.405 . . . . 0.0 110.229 158.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.722 HG23 ' HB3' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -104.74 146.14 12.35 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.844 -162.711 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.512 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -54.26 -54.1 44.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.075 172.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -10.52 10.68 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.559 0.695 . . . . 0.0 110.602 -168.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.722 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -116.37 15.53 15.78 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.085 -0.962 . . . . 0.0 110.38 -172.905 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 t -89.78 128.46 36.14 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.967 -0.458 . . . . 0.0 109.839 -160.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.78 -35.27 29.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.303 165.085 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.426 -171.501 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 pttp . . . . . 0 C--O 1.234 0.285 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 t -61.76 146.49 49.24 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.911 163.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -117.78 -12.34 10.24 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.274 -173.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.04 -50.64 71.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.234 0.54 . . . . 0.0 110.17 164.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 p -107.18 -36.48 6.55 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.082 -173.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 115.16 -28.54 7.89 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -74.5 153.1 39.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.278 -168.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -76.09 135.98 39.87 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.333 -165.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.12 -72.18 0.47 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.366 -1.094 . . . . 0.0 110.366 163.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -90.28 -174.81 4.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.245 0.545 . . . . 0.0 110.389 -158.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.716 HD13 ' H ' ' E' ' 14' ' ' ARG . 0.0 OUTLIER -109.72 145.09 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-O 121.815 0.817 . . . . 0.0 110.23 -166.291 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.25 -38.92 69.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.553 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.716 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.9 OUTLIER -70.09 -33.05 71.39 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.186 -170.106 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.537 ' H ' HG23 ' E' ' 12' ' ' ILE 0.258 0.8 OUTLIER -108.61 43.92 1.19 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 114.331 -1.304 . . . . 0.0 110.229 -177.715 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.6 t -87.73 157.1 19.14 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.557 -170.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -112.83 -38.92 4.41 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.125 163.271 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.646 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.297 -168.86 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.238 0.489 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -60.41 139.43 57.69 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.491 152.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -115.01 4.21 14.66 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.783 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.652 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 20.6 t-20 -70.87 -46.16 63.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.29 164.209 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 21.9 p -112.88 -16.88 12.63 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.671 -177.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.8 17.54 79.76 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -98.17 172.25 7.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.44 -0.38 . . . . 0.0 110.342 170.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -91.09 130.48 36.98 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.285 -164.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.61 59.92 2.74 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 160.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -176.95 175.02 1.65 Allowed 'General case' 0 C--O 1.234 0.269 0 O-C-N 122.073 -0.663 . . . . 0.0 110.207 154.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.785 HD13 ' H ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -112.53 132.67 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-O 122.267 1.032 . . . . 0.0 109.225 -155.13 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.785 ' H ' HD13 ' E' ' 12' ' ' ILE . . . -60.33 -35.72 76.31 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.608 -160.026 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.434 ' H ' HD12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.42 -16.77 50.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.516 0.675 . . . . 0.0 110.564 -166.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.717 ' OD1' HG23 ' E' ' 12' ' ' ILE . 0.5 OUTLIER -120.39 17.26 12.2 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.698 -165.349 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.1 t -80.9 134.0 35.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.622 -162.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.33 -30.24 11.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.294 169.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.616 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.378 -169.649 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.236 0.369 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.9 t -61.2 137.4 58.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.597 158.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.94 -5.13 14.91 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.871 177.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.486 ' HB2' ' CA ' ' E' ' 13' ' ' ALA . 24.8 t-20 -62.53 -55.13 30.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.133 166.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.9 p -103.13 -39.49 6.84 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.645 -176.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.2 18.04 23.02 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -176.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.62 175.05 6.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.336 168.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -102.82 140.88 36.52 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.255 -167.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.31 44.7 7.86 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 161.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -172.04 177.84 3.11 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 122.482 -0.423 . . . . 0.0 110.142 158.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.895 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -108.09 149.68 11.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 122.122 0.963 . . . . 0.0 110.505 -163.698 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.895 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -60.74 -54.56 43.76 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.948 -169.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.566 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -62.05 -16.45 52.0 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.563 0.697 . . . . 0.0 110.497 -170.875 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.485 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.274 0.0 OUTLIER -101.96 18.24 21.14 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.235 -176.82 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 29.3 t -91.38 150.29 21.34 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.877 -0.514 . . . . 0.0 109.717 -163.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 mtm105 -103.49 -39.89 6.57 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.215 164.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.569 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.269 -168.003 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.479 0 N-CA-C 110.164 -0.309 . . . . 0.0 110.164 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.3 t -60.47 140.87 57.07 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.577 156.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -112.86 -10.99 13.51 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.595 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.476 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 27.2 t-20 -60.61 -44.71 95.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.284 169.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.4 p -110.79 -45.18 3.52 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.832 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 122.74 -32.2 4.52 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.514 -1.035 . . . . 0.0 110.514 -174.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -63.27 153.59 34.27 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.115 -0.543 . . . . 0.0 110.325 -174.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.07 143.04 29.99 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.386 -163.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.72 52.65 6.34 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 162.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 27.1 p-80 -173.51 -177.48 1.47 Allowed 'General case' 0 C--O 1.237 0.426 0 O-C-N 122.316 -0.52 . . . . 0.0 109.914 155.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.92 HD12 ' H ' ' E' ' 13' ' ' ALA . 1.5 tp -116.79 143.07 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 CA-C-O 122.264 1.03 . . . . 0.0 109.293 -154.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.92 ' H ' HD12 ' E' ' 12' ' ' ILE . . . -63.77 -44.99 91.79 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.906 -164.053 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.41 -19.57 63.59 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 121.805 0.812 . . . . 0.0 110.352 -169.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.625 ' OD1' HG23 ' E' ' 12' ' ' ILE . 0.4 OUTLIER -106.99 16.43 24.25 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.946 -170.117 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 t -87.53 132.01 34.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.634 -161.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.23 17.9 7.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.331 165.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.512 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.346 -168.136 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' E' E ' 2' ' ' LYS . . . . . 0.438 ' HD3' ' HD1' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 121.778 0.799 . . . . 0.0 110.852 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.4 t -60.07 136.73 58.11 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.191 168.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 4' ' ' PHE . . . . . 0.438 ' HD1' ' HD3' ' E' ' 2' ' ' LYS . 0.7 OUTLIER -104.55 -15.62 15.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.419 174.636 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.485 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 24.6 t-20 -60.75 -38.75 86.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.068 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 19.1 p -111.38 -50.69 2.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 113.76 -1.564 . . . . 0.0 110.895 171.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.89 13.54 9.23 Favored Glycine 0 CA--C 1.522 0.512 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.849 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -100.3 163.6 12.32 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.563 -0.319 . . . . 0.0 110.363 172.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -90.33 143.51 26.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.239 -166.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.51 -69.06 0.33 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 164.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 45.3 p-80 -89.15 -178.77 5.74 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.286 -0.457 . . . . 0.0 110.331 -165.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.895 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -109.5 151.64 11.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.961 0.886 . . . . 0.0 110.527 -166.479 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.895 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -59.95 -55.08 38.44 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.259 -172.494 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.638 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -62.19 -14.15 34.84 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.684 0.754 . . . . 0.0 110.546 -170.815 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.46 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.264 0.1 OUTLIER -109.48 16.91 21.93 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.968 -174.11 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 37.0 t -77.63 132.74 38.38 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -162.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -84.6 -38.05 20.38 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.131 163.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.623 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.296 -168.951 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt . . . . . 0 C--O 1.235 0.331 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -60.57 148.57 37.62 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.953 163.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.5 -9.81 10.77 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.462 -175.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.48 -51.27 63.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.237 0.541 . . . . 0.0 110.193 164.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 6' ' ' CYS . . . . . 0.422 ' HB3' ' HB2' ' E' ' 18' ' ' ALA . 25.7 p -109.02 -33.41 6.91 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.036 -172.018 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 105.55 -30.0 10.53 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -176.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -63.35 135.58 57.1 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.282 -0.459 . . . . 0.0 110.236 -172.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -67.25 139.79 57.36 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.311 -164.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.43 -69.5 0.43 Allowed Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 162.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 -87.53 169.67 11.99 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.423 -0.457 . . . . 0.0 110.45 -159.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.687 HG23 ' HB3' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -91.59 148.9 4.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.359 -172.791 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.509 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -57.76 -50.37 73.46 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.486 177.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -11.6 16.78 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.7 0.762 . . . . 0.0 110.473 -169.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.687 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -119.7 15.74 12.73 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.78 -169.821 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.93 -94.47 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.821 -0.55 . . . . 0.0 109.703 -157.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 61.29 74.83 0.43 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 121.832 -0.542 . . . . 0.0 109.916 -154.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 18' ' ' ALA . . . . . 0.422 ' HB2' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.238 0.492 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.332 -170.068 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.205 0 CA-C-O 120.901 0.381 . . . . 0.0 110.645 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.0 t -60.76 148.79 37.73 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.172 167.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -116.58 -14.39 10.88 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.103 -172.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.28 -54.22 43.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.164 164.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.1 p -105.52 -22.35 13.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.013 -170.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.87 -31.27 7.42 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.8 mmtm -61.78 166.12 4.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.107 -0.547 . . . . 0.0 110.345 -174.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.95 139.61 32.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.324 -165.632 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.35 47.62 5.66 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 161.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 26.7 p-80 -169.56 169.57 8.67 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 122.29 -0.535 . . . . 0.0 110.281 155.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.749 HG23 ' OD1' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -104.69 141.75 19.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 122.066 0.936 . . . . 0.0 110.121 -167.122 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.86 -34.37 69.68 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.581 -169.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -15.87 54.45 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.562 -168.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.749 ' OD1' HG23 ' E' ' 12' ' ' ILE . 0.4 OUTLIER -128.54 21.01 6.09 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.364 -162.431 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 39.9 t -74.84 147.44 41.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.433 -161.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 2.9 tpt85 -90.48 -51.28 5.49 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.853 158.217 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.633 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.306 -169.519 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.98 0.419 . . . . 0.0 110.638 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.4 t -61.63 136.98 58.21 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.778 167.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -114.03 -3.67 13.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.185 -1.371 . . . . 0.0 111.844 175.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.511 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 25.9 t-20 -62.53 -49.73 74.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.258 0.551 . . . . 0.0 110.247 166.182 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 25.2 p -106.18 -48.86 3.49 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.72 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.11 27.68 3.36 Favored Glycine 0 CA--C 1.525 0.673 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.483 -175.341 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -116.65 147.41 41.96 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.041 -0.579 . . . . 0.0 110.415 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -74.82 146.12 42.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.334 -164.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.85 45.73 56.35 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 160.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 23.5 p-80 -165.84 168.91 15.48 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 122.368 -0.489 . . . . 0.0 110.011 155.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.769 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -102.85 147.39 9.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 122.221 1.01 . . . . 0.0 110.464 -162.782 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.769 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -59.42 -52.78 64.15 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.027 -169.394 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.669 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.3 OUTLIER -61.9 -16.88 54.18 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.38 -171.217 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.495 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.274 0.0 OUTLIER -101.96 16.24 26.59 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.288 -175.912 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.1 t -86.37 149.9 24.7 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -162.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.56 17.57 6.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.454 164.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.579 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.351 -167.846 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.321 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.0 t -61.85 137.92 58.29 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.671 160.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.9 -9.96 14.76 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.708 177.146 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.468 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 23.0 t-20 -61.68 -44.4 97.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.193 171.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 20.4 p -110.94 -47.54 3.21 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.649 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.17 22.99 5.38 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.687 -175.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.2 155.25 24.29 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.001 -0.599 . . . . 0.0 110.471 -179.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -87.34 138.1 31.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.391 -171.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.3 -63.48 0.61 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 167.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 49.4 p-80 -101.49 176.59 5.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.154 0.502 . . . . 0.0 110.399 -165.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.58 HG12 ' H ' ' E' ' 14' ' ' ARG . 1.7 tt -97.82 155.46 3.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.251 -175.032 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.468 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -55.94 -46.43 78.52 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.709 171.342 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.58 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.66 -10.25 8.04 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-O 121.557 0.694 . . . . 0.0 110.505 -169.955 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.573 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.258 0.1 OUTLIER -125.21 15.31 8.39 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.949 -167.526 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.1 t -81.47 143.69 31.9 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.887 -0.508 . . . . 0.0 109.735 -158.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -115.0 10.04 16.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.438 166.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.556 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.42 -173.538 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' E' E ' 2' ' ' LYS . . . . . 0.447 ' NZ ' ' CB ' ' E' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.465 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -59.66 136.68 58.07 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.911 157.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.26 -0.61 17.67 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.862 177.606 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.505 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 22.2 t-20 -67.17 -56.56 9.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.173 165.476 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.0 p -102.01 -38.13 7.9 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.73 -175.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.75 17.6 27.73 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.5 mttp -94.62 173.69 7.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.271 168.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.83 134.59 43.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.349 -166.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.97 50.13 5.03 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 163.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -172.43 -175.68 1.42 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 122.465 -0.432 . . . . 0.0 110.116 157.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.701 HG23 ' HB3' ' E' ' 15' ' ' ASN . 5.1 tp -108.6 144.87 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.82 -161.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.505 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -57.43 -54.66 44.25 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.519 -1.218 . . . . 0.0 111.557 175.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.411 ' H ' HG13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.6 -11.65 12.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.576 0.703 . . . . 0.0 110.506 -169.538 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.701 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.1 OUTLIER -115.91 16.8 16.16 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.218 -172.722 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.7 t -89.52 145.58 25.19 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.088 0.471 . . . . 0.0 109.831 -162.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.45 -24.54 12.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.314 167.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.623 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.341 -169.802 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.824 0.345 . . . . 0.0 110.477 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -61.5 142.49 57.01 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.739 160.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.6 -3.09 9.84 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.745 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 5' ' ' ASN . . . . . 0.479 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 26.2 t-20 -61.4 -47.37 86.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.25 0.548 . . . . 0.0 110.077 162.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 6' ' ' CYS . . . . . 0.76 ' HB3' ' HB2' ' E' ' 18' ' ' ALA . 24.7 p -110.22 -46.1 3.48 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.906 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.66 -36.91 2.15 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -177.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.92 173.64 5.18 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.269 -168.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.71 145.04 25.13 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.326 -163.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.13 49.78 8.21 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 160.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 35.5 p-80 -175.0 175.23 2.35 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 122.361 -0.493 . . . . 0.0 110.063 156.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 12' ' ' ILE . . . . . 0.908 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -106.52 151.72 8.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.951 0.882 . . . . 0.0 110.518 -163.626 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' E' E ' 13' ' ' ALA . . . . . 0.908 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -61.9 -52.84 62.46 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.972 -169.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 14' ' ' ARG . . . . . 0.514 ' H ' HD13 ' E' ' 12' ' ' ILE . 14.1 tpt180 -62.2 -16.9 56.28 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.283 -171.273 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 15' ' ' ASN . . . . . 0.446 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -102.33 19.63 18.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.097 -176.137 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 23.9 t -94.66 164.93 12.75 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.289 0.566 . . . . 0.0 109.848 -163.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -142.1 21.11 2.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.357 -173.573 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 18' ' ' ALA . . . . . 0.76 ' HB2' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.241 0.651 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.217 -169.78 . . . . . . . . 1 1 . 1 . 001 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 . 001 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 . 001 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 . 001 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 . 001 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 . 001 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.65 HG22 ' H ' ' E' ' 2' ' ' LYS . 9.9 p . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.65 ' H ' HG22 ' E' ' 1' ' ' VAL . 1.1 ptpm? -105.13 147.31 28.08 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.197 -162.105 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -60.02 142.02 54.66 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.67 156.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -111.49 -10.23 14.17 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.464 -1.243 . . . . 0.0 111.676 177.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -61.85 -44.53 96.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.242 170.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 20.3 p -113.64 -39.04 4.14 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 114.946 -1.024 . . . . 0.0 110.722 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.5 16.27 25.07 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.92 172.14 8.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.359 -0.42 . . . . 0.0 110.381 172.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -99.39 137.23 38.18 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.32 -167.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.78 43.78 17.08 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.532 -1.027 . . . . 0.0 110.532 161.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -162.63 -176.65 5.12 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 122.349 -0.501 . . . . 0.0 110.077 156.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.675 HG23 ' OD1' ' E' ' 15' ' ' ASN . 1.7 tp -118.6 145.06 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 121.867 0.841 . . . . 0.0 109.698 -159.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.52 -37.34 87.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.003 -167.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -18.27 59.6 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.452 -168.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.675 ' OD1' HG23 ' E' ' 12' ' ' ILE . 0.3 OUTLIER -120.5 15.32 12.03 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.934 -163.836 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 36.0 t -80.43 126.66 31.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.578 -160.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.16 -47.81 69.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.254 162.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.59 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.307 -170.081 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.825 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.392 0 O4'-C1'-N19 109.33 1.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.84 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.514 1 P-O3'-C3' 107.769 -9.942 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.842 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.629 1 P-O3'-C3' 107.693 -10.006 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.842 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.739 1 P-O3'-C3' 107.86 -9.866 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.918 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.612 1.861 1 P-O3'-C3' 108.429 -9.393 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.918 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 4.3 p . . . . . 0 N--CA 1.476 0.874 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.591 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -101.41 144.83 29.73 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.208 161.196 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.1 t -59.67 135.9 57.82 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.908 157.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -115.39 0.68 13.5 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.793 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 25.9 t-20 -65.85 -55.59 16.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.194 0.521 . . . . 0.0 110.196 162.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 24.3 p -97.9 -44.69 6.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.732 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.9 -36.52 2.61 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.553 -172.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -64.02 166.85 7.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.36 -0.42 . . . . 0.0 110.244 -168.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.67 134.35 34.47 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.277 -164.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.58 -67.72 0.44 Allowed Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 163.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -92.01 -178.27 4.95 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 122.593 -0.357 . . . . 0.0 110.231 -160.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.741 HG23 ' HB3' ' E' ' 15' ' ' ASN . 3.1 tp -102.04 148.96 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.56 -160.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.557 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -57.37 -56.14 25.68 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.287 -1.324 . . . . 0.0 111.619 175.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.409 ' H ' HG13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.58 -11.46 11.39 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.5 0.667 . . . . 0.0 110.47 -170.035 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.741 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.1 OUTLIER -116.19 16.06 15.93 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.251 -172.765 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 33.6 t -85.44 156.64 20.74 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -163.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.33 -37.0 5.4 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.203 163.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.578 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.389 -173.516 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.826 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.366 0 O4'-C1'-N19 109.333 1.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.839 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.56 1 P-O3'-C3' 107.776 -9.937 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.839 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.727 1 P-O3'-C3' 107.677 -10.02 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.832 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.675 1 P-O3'-C3' 107.815 -9.904 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.825 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.611 1.793 1 P-O3'-C3' 108.449 -9.376 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.825 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 7.8 p . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 121.466 0.651 . . . . 0.0 109.665 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.744 ' H ' HG22 ' E' ' 1' ' ' VAL . 1.2 ptpm? -104.5 141.15 36.88 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.325 -173.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -60.36 140.25 57.25 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.796 156.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.5 -13.61 14.81 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.825 -1.079 . . . . 0.0 111.424 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.534 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 27.7 t-20 -62.09 -41.13 97.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.141 173.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 6' ' ' CYS . . . . . 0.501 ' HB3' ' HA ' ' E' ' 18' ' ' ALA . 18.4 p -113.87 -38.71 4.16 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.719 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 119.64 -22.19 8.84 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.75 170.87 15.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.296 -169.138 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.92 141.1 28.78 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.27 -167.154 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.33 -69.31 0.43 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.401 -1.08 . . . . 0.0 110.401 161.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -96.51 -179.34 4.58 Favored 'General case' 0 C--N 1.332 -0.196 0 O-C-N 122.472 -0.428 . . . . 0.0 110.201 -160.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.773 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -117.0 146.64 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 122.294 1.045 . . . . 0.0 110.474 -161.967 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.773 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -64.25 -36.12 83.05 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.514 0.673 . . . . 0.0 110.959 -158.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.658 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.87 -16.11 47.87 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.538 -167.536 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.703 ' OD1' HG23 ' E' ' 12' ' ' ILE . 0.4 OUTLIER -120.9 17.36 11.79 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.765 -165.003 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.6 t -80.97 159.91 24.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.654 -161.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -135.67 17.19 3.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.547 169.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 18' ' ' ALA . . . . . 0.501 ' HA ' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.241 0.613 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.39 -170.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.811 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.39 0 O4'-C1'-N19 109.336 1.92 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.858 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.57 1 P-O3'-C3' 107.756 -9.953 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.863 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.694 1 P-O3'-C3' 107.706 -9.995 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.863 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.675 1 P-O3'-C3' 107.874 -9.855 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.85 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.61 1.749 1 P-O3'-C3' 108.413 -9.406 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.85 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 5.1 p . . . . . 0 N--CA 1.471 0.61 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.607 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -101.97 137.22 40.55 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.251 163.085 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.1 t -60.02 133.18 55.85 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.892 157.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.34 -10.63 16.89 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.657 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.461 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 21.4 t-20 -61.87 -56.62 17.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.179 170.316 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 24.1 p -96.04 -45.71 6.79 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.685 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.91 -21.0 5.93 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.55 173.71 11.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.307 -0.447 . . . . 0.0 110.352 -169.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -100.84 128.67 46.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.339 -165.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.68 46.3 3.22 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 161.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 -172.76 -177.64 1.71 Allowed 'General case' 0 N--CA 1.465 0.29 0 O-C-N 122.511 -0.405 . . . . 0.0 110.229 158.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.722 HG23 ' HB3' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -104.74 146.14 12.35 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.844 -162.711 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.512 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -54.26 -54.1 44.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.075 172.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -10.52 10.68 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.559 0.695 . . . . 0.0 110.602 -168.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.722 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -116.37 15.53 15.78 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.085 -0.962 . . . . 0.0 110.38 -172.905 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 t -89.78 128.46 36.14 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.967 -0.458 . . . . 0.0 109.839 -160.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.78 -35.27 29.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.303 165.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.426 -171.501 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.823 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.317 0 O4'-C1'-N19 109.346 1.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.869 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.586 1 P-O3'-C3' 107.766 -9.945 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.869 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.642 1 P-O3'-C3' 107.691 -10.007 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.86 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.719 1 P-O3'-C3' 107.8 -9.917 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.743 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.788 1 P-O3'-C3' 108.435 -9.387 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.793 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 8.2 p . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.631 ' H ' HG22 ' E' ' 1' ' ' VAL . 2.9 pttp -109.59 145.42 36.42 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.487 -167.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 t -61.76 146.49 49.24 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.911 163.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -117.78 -12.34 10.24 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.274 -173.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.04 -50.64 71.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.234 0.54 . . . . 0.0 110.17 164.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 p -107.18 -36.48 6.55 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.082 -173.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 115.16 -28.54 7.89 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -74.5 153.1 39.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.278 -168.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -76.09 135.98 39.87 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.333 -165.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.12 -72.18 0.47 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.366 -1.094 . . . . 0.0 110.366 163.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -90.28 -174.81 4.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.245 0.545 . . . . 0.0 110.389 -158.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.716 HD13 ' H ' ' E' ' 14' ' ' ARG . 0.0 OUTLIER -109.72 145.09 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-O 121.815 0.817 . . . . 0.0 110.23 -166.291 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.25 -38.92 69.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.553 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.716 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.9 OUTLIER -70.09 -33.05 71.39 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.186 -170.106 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.537 ' H ' HG23 ' E' ' 12' ' ' ILE 0.258 0.8 OUTLIER -108.61 43.92 1.19 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 114.331 -1.304 . . . . 0.0 110.229 -177.715 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.6 t -87.73 157.1 19.14 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.557 -170.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -112.83 -38.92 4.41 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.125 163.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.646 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.297 -168.86 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.832 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.369 0 O4'-C1'-N19 109.37 1.963 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.832 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.589 1 P-O3'-C3' 107.776 -9.937 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.833 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.681 1 P-O3'-C3' 107.638 -10.052 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.833 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.65 1 P-O3'-C3' 107.789 -9.926 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.814 " H1'" HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.612 1.859 1 P-O3'-C3' 108.457 -9.37 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.814 HG12 " H1'" ' D' ' 5' ' ' ' DC' . 4.3 p . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.637 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.1 OUTLIER -116.09 153.53 31.58 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 116.213 -0.449 . . . . 0.0 109.825 -159.758 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -60.41 139.43 57.69 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.491 152.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -115.01 4.21 14.66 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.783 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.652 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 20.6 t-20 -70.87 -46.16 63.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.29 164.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 21.9 p -112.88 -16.88 12.63 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.671 -177.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.8 17.54 79.76 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -98.17 172.25 7.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.44 -0.38 . . . . 0.0 110.342 170.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -91.09 130.48 36.98 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.285 -164.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.61 59.92 2.74 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 160.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -176.95 175.02 1.65 Allowed 'General case' 0 C--O 1.234 0.269 0 O-C-N 122.073 -0.663 . . . . 0.0 110.207 154.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.785 HD13 ' H ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -112.53 132.67 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-O 122.267 1.032 . . . . 0.0 109.225 -155.13 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.785 ' H ' HD13 ' E' ' 12' ' ' ILE . . . -60.33 -35.72 76.31 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.608 -160.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.434 ' H ' HD12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.42 -16.77 50.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.516 0.675 . . . . 0.0 110.564 -166.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.717 ' OD1' HG23 ' E' ' 12' ' ' ILE . 0.5 OUTLIER -120.39 17.26 12.2 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.698 -165.349 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.1 t -80.9 134.0 35.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.622 -162.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.33 -30.24 11.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.294 169.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.616 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.378 -169.649 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.822 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.359 0 O4'-C1'-N19 109.326 1.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.847 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.633 1 P-O3'-C3' 107.746 -9.962 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.847 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.627 1 P-O3'-C3' 107.666 -10.028 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.843 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.694 1 P-O3'-C3' 107.818 -9.901 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.759 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.792 1 P-O3'-C3' 108.479 -9.351 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.678 HG22 ' H ' ' E' ' 2' ' ' LYS . 9.9 p . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.678 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.6 OUTLIER -102.26 142.36 33.61 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.265 -163.232 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.9 t -61.2 137.4 58.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.597 158.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.94 -5.13 14.91 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.871 177.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.486 ' HB2' ' CA ' ' E' ' 13' ' ' ALA . 24.8 t-20 -62.53 -55.13 30.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.133 166.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.9 p -103.13 -39.49 6.84 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.645 -176.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.2 18.04 23.02 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -176.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.62 175.05 6.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.336 168.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -102.82 140.88 36.52 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.255 -167.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.31 44.7 7.86 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 161.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -172.04 177.84 3.11 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 122.482 -0.423 . . . . 0.0 110.142 158.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.895 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -108.09 149.68 11.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 122.122 0.963 . . . . 0.0 110.505 -163.698 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.895 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -60.74 -54.56 43.76 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.948 -169.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.566 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -62.05 -16.45 52.0 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.563 0.697 . . . . 0.0 110.497 -170.875 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.485 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.274 0.0 OUTLIER -101.96 18.24 21.14 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.235 -176.82 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 29.3 t -91.38 150.29 21.34 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.877 -0.514 . . . . 0.0 109.717 -163.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 mtm105 -103.49 -39.89 6.57 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.215 164.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.569 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.269 -168.003 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.821 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.347 0 O4'-C1'-N19 109.366 1.958 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.845 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.551 1 P-O3'-C3' 107.779 -9.934 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.848 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.658 1 P-O3'-C3' 107.71 -9.992 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.848 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.647 1 P-O3'-C3' 107.816 -9.903 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.879 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.611 1.828 1 P-O3'-C3' 108.477 -9.353 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.879 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 5.7 p . . . . . 0 N--CA 1.474 0.728 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.518 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -100.45 147.47 25.83 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.164 160.032 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.3 t -60.47 140.87 57.07 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.577 156.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -112.86 -10.99 13.51 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.595 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.476 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 27.2 t-20 -60.61 -44.71 95.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.284 169.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.4 p -110.79 -45.18 3.52 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.832 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 122.74 -32.2 4.52 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.514 -1.035 . . . . 0.0 110.514 -174.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -63.27 153.59 34.27 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.115 -0.543 . . . . 0.0 110.325 -174.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.07 143.04 29.99 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.386 -163.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.72 52.65 6.34 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 162.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 27.1 p-80 -173.51 -177.48 1.47 Allowed 'General case' 0 C--O 1.237 0.426 0 O-C-N 122.316 -0.52 . . . . 0.0 109.914 155.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.92 HD12 ' H ' ' E' ' 13' ' ' ALA . 1.5 tp -116.79 143.07 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 CA-C-O 122.264 1.03 . . . . 0.0 109.293 -154.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.92 ' H ' HD12 ' E' ' 12' ' ' ILE . . . -63.77 -44.99 91.79 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.906 -164.053 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.41 -19.57 63.59 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 121.805 0.812 . . . . 0.0 110.352 -169.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.625 ' OD1' HG23 ' E' ' 12' ' ' ILE . 0.4 OUTLIER -106.99 16.43 24.25 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.946 -170.117 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 t -87.53 132.01 34.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.634 -161.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.23 17.9 7.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.331 165.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.512 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.346 -168.136 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.818 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.302 0 O4'-C1'-N19 109.377 1.972 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.862 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.603 1 P-O3'-C3' 107.818 -9.902 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.862 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.632 1 P-O3'-C3' 107.655 -10.037 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.844 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.78 1 P-O3'-C3' 107.851 -9.874 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.925 ' C2 ' HG22 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.612 1.855 1 P-O3'-C3' 108.494 -9.339 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.925 HG22 ' C2 ' ' D' ' 5' ' ' ' DC' . 27.2 m . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 121.261 0.553 . . . . 0.0 109.897 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.438 ' HD3' ' HD1' ' E' ' 4' ' ' PHE . 0.0 OUTLIER -121.2 136.61 54.94 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.852 -177.749 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.4 t -60.07 136.73 58.11 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.191 168.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 4' ' ' PHE . . . . . 0.5 ' CE2' ' N1 ' ' D' ' 3' ' ' ' DG' . 0.7 OUTLIER -104.55 -15.62 15.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.419 174.636 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.485 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 24.6 t-20 -60.75 -38.75 86.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.068 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 19.1 p -111.38 -50.69 2.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 113.76 -1.564 . . . . 0.0 110.895 171.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.89 13.54 9.23 Favored Glycine 0 CA--C 1.522 0.512 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.849 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -100.3 163.6 12.32 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.563 -0.319 . . . . 0.0 110.363 172.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -90.33 143.51 26.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.239 -166.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.51 -69.06 0.33 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 164.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 45.3 p-80 -89.15 -178.77 5.74 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.286 -0.457 . . . . 0.0 110.331 -165.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.895 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -109.5 151.64 11.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.961 0.886 . . . . 0.0 110.527 -166.479 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.895 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -59.95 -55.08 38.44 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.259 -172.494 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.638 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -62.19 -14.15 34.84 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.684 0.754 . . . . 0.0 110.546 -170.815 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.46 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.264 0.1 OUTLIER -109.48 16.91 21.93 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.968 -174.11 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 37.0 t -77.63 132.74 38.38 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -162.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -84.6 -38.05 20.38 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.131 163.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.623 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.296 -168.951 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.823 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.32 0 O4'-C1'-N19 109.312 1.889 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.861 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.59 1 P-O3'-C3' 107.79 -9.925 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.866 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.67 1 P-O3'-C3' 107.669 -10.026 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.866 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.709 1 P-O3'-C3' 107.837 -9.885 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.758 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.775 1 P-O3'-C3' 108.497 -9.336 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.736 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 90.3 t . . . . . 0 N--CA 1.473 0.718 0 CA-C-O 121.437 0.637 . . . . 0.0 109.858 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -122.88 148.96 44.82 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.485 -167.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -60.57 148.57 37.62 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.953 163.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.5 -9.81 10.77 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.462 -175.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.48 -51.27 63.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.237 0.541 . . . . 0.0 110.193 164.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 6' ' ' CYS . . . . . 0.422 ' HB3' ' HB2' ' E' ' 18' ' ' ALA . 25.7 p -109.02 -33.41 6.91 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.036 -172.018 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 105.55 -30.0 10.53 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -176.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -63.35 135.58 57.1 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.282 -0.459 . . . . 0.0 110.236 -172.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -67.25 139.79 57.36 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.311 -164.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.43 -69.5 0.43 Allowed Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 162.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 -87.53 169.67 11.99 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.423 -0.457 . . . . 0.0 110.45 -159.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.687 HG23 ' HB3' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -91.59 148.9 4.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.359 -172.791 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.509 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -57.76 -50.37 73.46 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.486 177.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -11.6 16.78 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.7 0.762 . . . . 0.0 110.473 -169.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.687 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -119.7 15.74 12.73 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.78 -169.821 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.93 -94.47 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.821 -0.55 . . . . 0.0 109.703 -157.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 61.29 74.83 0.43 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 121.832 -0.542 . . . . 0.0 109.916 -154.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 18' ' ' ALA . . . . . 0.422 ' HB2' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.238 0.492 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.332 -170.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.816 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.374 0 O4'-C1'-N19 109.263 1.829 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.861 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.537 1 P-O3'-C3' 107.754 -9.955 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.861 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.739 1 P-O3'-C3' 107.665 -10.029 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.853 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.699 1 P-O3'-C3' 107.834 -9.888 . . . . 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 1.792 1 P-O3'-C3' 108.482 -9.349 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.589 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 42.4 t . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 121.035 0.445 . . . . 0.0 109.855 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.455 ' N ' HG12 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -111.03 143.36 41.85 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.645 -170.196 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.0 t -60.76 148.79 37.73 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.172 167.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -116.58 -14.39 10.88 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.103 -172.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.28 -54.22 43.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.164 164.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.1 p -105.52 -22.35 13.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.013 -170.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.87 -31.27 7.42 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.8 mmtm -61.78 166.12 4.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.107 -0.547 . . . . 0.0 110.345 -174.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.95 139.61 32.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.324 -165.632 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.35 47.62 5.66 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 161.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 26.7 p-80 -169.56 169.57 8.67 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 122.29 -0.535 . . . . 0.0 110.281 155.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.749 HG23 ' OD1' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -104.69 141.75 19.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 122.066 0.936 . . . . 0.0 110.121 -167.122 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.86 -34.37 69.68 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.581 -169.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -15.87 54.45 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.562 -168.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.749 ' OD1' HG23 ' E' ' 12' ' ' ILE . 0.4 OUTLIER -128.54 21.01 6.09 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.364 -162.431 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 39.9 t -74.84 147.44 41.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.433 -161.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 2.9 tpt85 -90.48 -51.28 5.49 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.853 158.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.633 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.306 -169.519 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.805 " H2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.264 0 O4'-C1'-N19 109.36 1.95 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.851 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.547 1 P-O3'-C3' 107.814 -9.905 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.851 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.598 1 P-O3'-C3' 107.626 -10.061 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.84 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.693 1 P-O3'-C3' 107.798 -9.919 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.764 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.798 1 P-O3'-C3' 108.422 -9.398 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.642 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 69.6 t . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 121.544 0.688 . . . . 0.0 109.887 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.535 ' N ' HG12 ' E' ' 1' ' ' VAL . 0.3 OUTLIER -114.4 149.48 36.11 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.638 -173.418 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.4 t -61.63 136.98 58.21 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.778 167.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -114.03 -3.67 13.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.185 -1.371 . . . . 0.0 111.844 175.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.511 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 25.9 t-20 -62.53 -49.73 74.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.258 0.551 . . . . 0.0 110.247 166.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 25.2 p -106.18 -48.86 3.49 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.72 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.11 27.68 3.36 Favored Glycine 0 CA--C 1.525 0.673 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.483 -175.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -116.65 147.41 41.96 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.041 -0.579 . . . . 0.0 110.415 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -74.82 146.12 42.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.334 -164.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.85 45.73 56.35 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 160.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 23.5 p-80 -165.84 168.91 15.48 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 122.368 -0.489 . . . . 0.0 110.011 155.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.769 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -102.85 147.39 9.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 122.221 1.01 . . . . 0.0 110.464 -162.782 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.769 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -59.42 -52.78 64.15 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.027 -169.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.669 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.3 OUTLIER -61.9 -16.88 54.18 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.38 -171.217 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.495 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.274 0.0 OUTLIER -101.96 16.24 26.59 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.288 -175.912 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.1 t -86.37 149.9 24.7 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -162.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.56 17.57 6.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.454 164.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.579 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.351 -167.846 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.816 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.323 0 O4'-C1'-N19 109.323 1.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.864 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.643 1 P-O3'-C3' 107.79 -9.925 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.864 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.634 1 P-O3'-C3' 107.645 -10.046 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.854 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.698 1 P-O3'-C3' 107.805 -9.913 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.817 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.611 1.785 1 P-O3'-C3' 108.432 -9.39 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.817 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 10.0 p . . . . . 0 N--CA 1.475 0.781 0 CA-C-O 121.317 0.58 . . . . 0.0 109.765 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.668 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -97.4 133.77 41.56 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.389 -167.242 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.0 t -61.85 137.92 58.29 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.671 160.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.9 -9.96 14.76 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.708 177.146 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.468 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 23.0 t-20 -61.68 -44.4 97.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.193 171.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 20.4 p -110.94 -47.54 3.21 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.649 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.17 22.99 5.38 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.687 -175.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.2 155.25 24.29 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.001 -0.599 . . . . 0.0 110.471 -179.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -87.34 138.1 31.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.391 -171.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.3 -63.48 0.61 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 167.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 49.4 p-80 -101.49 176.59 5.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.154 0.502 . . . . 0.0 110.399 -165.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.587 HD12 ' H41' ' D' ' 5' ' ' ' DC' . 1.7 tt -97.82 155.46 3.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.251 -175.032 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.468 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -55.94 -46.43 78.52 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.709 171.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.58 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.66 -10.25 8.04 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-O 121.557 0.694 . . . . 0.0 110.505 -169.955 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.573 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.258 0.1 OUTLIER -125.21 15.31 8.39 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.949 -167.526 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.1 t -81.47 143.69 31.9 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.887 -0.508 . . . . 0.0 109.735 -158.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -115.0 10.04 16.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.438 166.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.556 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.42 -173.538 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.823 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.29 0 O4'-C1'-N19 109.329 1.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.842 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.536 1 P-O3'-C3' 107.821 -9.899 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.842 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.64 1 P-O3'-C3' 107.638 -10.052 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.834 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.732 1 P-O3'-C3' 107.825 -9.896 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.754 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.612 1.856 1 P-O3'-C3' 108.484 -9.346 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.754 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 6.8 p . . . . . 0 N--CA 1.477 0.922 0 CA-C-O 121.442 0.639 . . . . 0.0 109.662 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.705 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -105.31 147.18 28.41 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.332 -170.121 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -59.66 136.68 58.07 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.911 157.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.26 -0.61 17.67 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.862 177.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.505 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 22.2 t-20 -67.17 -56.56 9.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.173 165.476 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.0 p -102.01 -38.13 7.9 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.73 -175.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.75 17.6 27.73 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.5 mttp -94.62 173.69 7.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.271 168.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.83 134.59 43.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.349 -166.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.97 50.13 5.03 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 163.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -172.43 -175.68 1.42 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 122.465 -0.432 . . . . 0.0 110.116 157.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.701 HG23 ' HB3' ' E' ' 15' ' ' ASN . 5.1 tp -108.6 144.87 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.82 -161.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.505 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -57.43 -54.66 44.25 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.519 -1.218 . . . . 0.0 111.557 175.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.411 ' H ' HG13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.6 -11.65 12.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.576 0.703 . . . . 0.0 110.506 -169.538 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.701 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.1 OUTLIER -115.91 16.8 16.16 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.218 -172.722 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.7 t -89.52 145.58 25.19 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.088 0.471 . . . . 0.0 109.831 -162.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.45 -24.54 12.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.314 167.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.623 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.341 -169.802 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D ' 1' ' ' ' DA' . . . . . 0.818 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.353 0 O4'-C1'-N19 109.299 1.873 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.849 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.571 1 P-O3'-C3' 107.785 -9.929 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.853 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.67 1 P-O3'-C3' 107.641 -10.05 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 4' ' ' ' DC' . . . . . 0.853 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.698 1 P-O3'-C3' 107.83 -9.892 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 5' ' ' ' DC' . . . . . 0.751 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.92 1 P-O3'-C3' 108.47 -9.358 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 1' ' ' VAL . . . . . 0.604 HG12 " H1'" ' D' ' 5' ' ' ' DC' . 14.5 p . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 2' ' ' LYS . . . . . 0.561 ' H ' HG22 ' E' ' 1' ' ' VAL . 8.9 ptpt -105.94 144.23 32.96 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.477 -163.16 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -61.5 142.49 57.01 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.739 160.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.6 -3.09 9.84 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.745 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 5' ' ' ASN . . . . . 0.479 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 26.2 t-20 -61.4 -47.37 86.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.25 0.548 . . . . 0.0 110.077 162.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 6' ' ' CYS . . . . . 0.76 ' HB3' ' HB2' ' E' ' 18' ' ' ALA . 24.7 p -110.22 -46.1 3.48 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.906 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.66 -36.91 2.15 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -177.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.92 173.64 5.18 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.269 -168.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.71 145.04 25.13 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.326 -163.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.13 49.78 8.21 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 160.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 35.5 p-80 -175.0 175.23 2.35 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 122.361 -0.493 . . . . 0.0 110.063 156.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 12' ' ' ILE . . . . . 0.908 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -106.52 151.72 8.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.951 0.882 . . . . 0.0 110.518 -163.626 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' E' E ' 13' ' ' ALA . . . . . 0.908 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -61.9 -52.84 62.46 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.972 -169.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 14' ' ' ARG . . . . . 0.514 ' H ' HD13 ' E' ' 12' ' ' ILE . 14.1 tpt180 -62.2 -16.9 56.28 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.283 -171.273 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 15' ' ' ASN . . . . . 0.446 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -102.33 19.63 18.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.097 -176.137 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 23.9 t -94.66 164.93 12.75 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.289 0.566 . . . . 0.0 109.848 -163.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -142.1 21.11 2.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.357 -173.573 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 18' ' ' ALA . . . . . 0.76 ' HB2' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.241 0.651 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.217 -169.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.1 ptpm? . . . . . 0 C--O 1.239 0.513 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -60.02 142.02 54.66 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.67 156.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -111.49 -10.23 14.17 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.464 -1.243 . . . . 0.0 111.676 177.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -61.85 -44.53 96.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.242 170.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 20.3 p -113.64 -39.04 4.14 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 114.946 -1.024 . . . . 0.0 110.722 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.5 16.27 25.07 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.92 172.14 8.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.359 -0.42 . . . . 0.0 110.381 172.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -99.39 137.23 38.18 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.32 -167.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.78 43.78 17.08 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.532 -1.027 . . . . 0.0 110.532 161.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -162.63 -176.65 5.12 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 122.349 -0.501 . . . . 0.0 110.077 156.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.815 HG23 ' ND2' ' E' ' 15' ' ' ASN . 1.7 tp -118.6 145.06 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 121.867 0.841 . . . . 0.0 109.698 -159.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.52 -37.34 87.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.003 -167.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -18.27 59.6 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.452 -168.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.815 ' ND2' HG23 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -120.5 15.32 12.03 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.934 -163.836 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 36.0 t -80.43 126.66 31.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.578 -160.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.16 -47.81 69.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.254 162.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.59 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.307 -170.081 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.457 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.1 t -59.67 135.9 57.82 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.908 157.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -115.39 0.68 13.5 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.793 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -65.85 -55.59 16.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.194 0.521 . . . . 0.0 110.196 162.591 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 24.3 p -97.9 -44.69 6.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.732 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.9 -36.52 2.61 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.553 -172.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -64.02 166.85 7.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.36 -0.42 . . . . 0.0 110.244 -168.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.67 134.35 34.47 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.277 -164.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.58 -67.72 0.44 Allowed Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 163.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -92.01 -178.27 4.95 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 122.593 -0.357 . . . . 0.0 110.231 -160.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.741 HG23 ' HB3' ' E' ' 15' ' ' ASN . 3.1 tp -102.04 148.96 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.56 -160.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.557 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -57.37 -56.14 25.68 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.287 -1.324 . . . . 0.0 111.619 175.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.409 ' H ' HG13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.58 -11.46 11.39 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.5 0.667 . . . . 0.0 110.47 -170.035 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.741 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -116.19 16.06 15.93 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.251 -172.765 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 33.6 t -85.44 156.64 20.74 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -163.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.33 -37.0 5.4 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.203 163.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.578 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.389 -173.516 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.2 ptpm? . . . . . 0 C--O 1.237 0.419 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -60.36 140.25 57.25 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.796 156.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.5 -13.61 14.81 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.825 -1.079 . . . . 0.0 111.424 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.534 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -62.09 -41.13 97.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.141 173.743 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . 0.501 ' HB3' ' HA ' ' E' ' 18' ' ' ALA . 18.4 p -113.87 -38.71 4.16 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.719 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 119.64 -22.19 8.84 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.75 170.87 15.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.296 -169.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.92 141.1 28.78 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.27 -167.154 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.33 -69.31 0.43 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.401 -1.08 . . . . 0.0 110.401 161.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -96.51 -179.34 4.58 Favored 'General case' 0 C--N 1.332 -0.196 0 O-C-N 122.472 -0.428 . . . . 0.0 110.201 -160.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.857 HG23 ' ND2' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -117.0 146.64 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 122.294 1.045 . . . . 0.0 110.474 -161.967 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.773 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -64.25 -36.12 83.05 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.514 0.673 . . . . 0.0 110.959 -158.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.658 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.87 -16.11 47.87 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.538 -167.536 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.857 ' ND2' HG23 ' E' ' 12' ' ' ILE . 0.1 OUTLIER -120.9 17.36 11.79 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.765 -165.003 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.6 t -80.97 159.91 24.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.654 -161.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -135.67 17.19 3.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.547 169.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . 0.501 ' HA ' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.241 0.613 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.39 -170.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.484 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.1 t -60.02 133.18 55.85 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.892 157.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.34 -10.63 16.89 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.657 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.461 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -61.87 -56.62 17.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.179 170.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 24.1 p -96.04 -45.71 6.79 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.685 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.91 -21.0 5.93 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.55 173.71 11.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.307 -0.447 . . . . 0.0 110.352 -169.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -100.84 128.67 46.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.339 -165.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.68 46.3 3.22 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 161.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 -172.76 -177.64 1.71 Allowed 'General case' 0 N--CA 1.465 0.29 0 O-C-N 122.511 -0.405 . . . . 0.0 110.229 158.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.722 HG23 ' HB3' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -104.74 146.14 12.35 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.844 -162.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.512 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -54.26 -54.1 44.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.075 172.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -10.52 10.68 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.559 0.695 . . . . 0.0 110.602 -168.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.722 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -116.37 15.53 15.78 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.085 -0.962 . . . . 0.0 110.38 -172.905 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 t -89.78 128.46 36.14 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.967 -0.458 . . . . 0.0 109.839 -160.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.78 -35.27 29.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.303 165.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.426 -171.501 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 pttp . . . . . 0 C--O 1.234 0.285 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 t -61.76 146.49 49.24 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.911 163.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -117.78 -12.34 10.24 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.274 -173.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.458 HD22 ' HB3' ' E' ' 16' ' ' CYS . 47.9 t30 -62.04 -50.64 71.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.234 0.54 . . . . 0.0 110.17 164.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 p -107.18 -36.48 6.55 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.082 -173.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 115.16 -28.54 7.89 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -74.5 153.1 39.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.278 -168.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -76.09 135.98 39.87 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.333 -165.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.12 -72.18 0.47 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.366 -1.094 . . . . 0.0 110.366 163.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -90.28 -174.81 4.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.245 0.545 . . . . 0.0 110.389 -158.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.716 HD13 ' H ' ' E' ' 14' ' ' ARG . 0.0 OUTLIER -109.72 145.09 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-O 121.815 0.817 . . . . 0.0 110.23 -166.291 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.25 -38.92 69.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.553 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.716 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.9 OUTLIER -70.09 -33.05 71.39 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.186 -170.106 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.685 ' ND2' HG22 ' E' ' 12' ' ' ILE 0.258 0.0 OUTLIER -108.61 43.92 1.19 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 114.331 -1.304 . . . . 0.0 110.229 -177.715 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . 0.458 ' HB3' HD22 ' E' ' 5' ' ' ASN . 35.6 t -87.73 157.1 19.14 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.557 -170.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -112.83 -38.92 4.41 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.125 163.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.646 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.297 -168.86 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.238 0.489 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -60.41 139.43 57.69 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.491 152.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -115.01 4.21 14.66 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.783 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.652 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -70.87 -46.16 63.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.29 164.209 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 21.9 p -112.88 -16.88 12.63 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.671 -177.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.8 17.54 79.76 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -98.17 172.25 7.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.44 -0.38 . . . . 0.0 110.342 170.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -91.09 130.48 36.98 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.285 -164.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.61 59.92 2.74 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 160.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -176.95 175.02 1.65 Allowed 'General case' 0 C--O 1.234 0.269 0 O-C-N 122.073 -0.663 . . . . 0.0 110.207 154.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.867 HG23 ' ND2' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -112.53 132.67 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-O 122.267 1.032 . . . . 0.0 109.225 -155.13 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.785 ' H ' HD13 ' E' ' 12' ' ' ILE . . . -60.33 -35.72 76.31 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.608 -160.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.434 ' H ' HD12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.42 -16.77 50.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.516 0.675 . . . . 0.0 110.564 -166.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.867 ' ND2' HG23 ' E' ' 12' ' ' ILE . 0.1 OUTLIER -120.39 17.26 12.2 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.698 -165.349 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.1 t -80.9 134.0 35.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.622 -162.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.33 -30.24 11.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.294 169.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.616 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.378 -169.649 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.236 0.369 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.9 t -61.2 137.4 58.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.597 158.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.94 -5.13 14.91 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.871 177.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.486 ' HB2' ' CA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -62.53 -55.13 30.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.133 166.585 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.9 p -103.13 -39.49 6.84 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.645 -176.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.2 18.04 23.02 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -176.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.62 175.05 6.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.336 168.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -102.82 140.88 36.52 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.255 -167.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.31 44.7 7.86 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 161.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -172.04 177.84 3.11 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 122.482 -0.423 . . . . 0.0 110.142 158.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.895 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -108.09 149.68 11.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 122.122 0.963 . . . . 0.0 110.505 -163.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.895 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -60.74 -54.56 43.76 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.948 -169.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.566 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -62.05 -16.45 52.0 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.563 0.697 . . . . 0.0 110.497 -170.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.485 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.274 0.0 OUTLIER -101.96 18.24 21.14 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.235 -176.82 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 29.3 t -91.38 150.29 21.34 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.877 -0.514 . . . . 0.0 109.717 -163.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 mtm105 -103.49 -39.89 6.57 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.215 164.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.569 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.269 -168.003 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.479 0 N-CA-C 110.164 -0.309 . . . . 0.0 110.164 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.3 t -60.47 140.87 57.07 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.577 156.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -112.86 -10.99 13.51 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.595 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.476 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -60.61 -44.71 95.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.284 169.747 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.4 p -110.79 -45.18 3.52 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.832 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 122.74 -32.2 4.52 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.514 -1.035 . . . . 0.0 110.514 -174.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -63.27 153.59 34.27 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.115 -0.543 . . . . 0.0 110.325 -174.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.07 143.04 29.99 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.386 -163.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.72 52.65 6.34 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 162.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 27.1 p-80 -173.51 -177.48 1.47 Allowed 'General case' 0 C--O 1.237 0.426 0 O-C-N 122.316 -0.52 . . . . 0.0 109.914 155.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.92 HD12 ' H ' ' E' ' 13' ' ' ALA . 1.5 tp -116.79 143.07 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 CA-C-O 122.264 1.03 . . . . 0.0 109.293 -154.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.92 ' H ' HD12 ' E' ' 12' ' ' ILE . . . -63.77 -44.99 91.79 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.906 -164.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.41 -19.57 63.59 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 121.805 0.812 . . . . 0.0 110.352 -169.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.775 ' ND2' HG23 ' E' ' 12' ' ' ILE . 0.1 OUTLIER -106.99 16.43 24.25 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.946 -170.117 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 t -87.53 132.01 34.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.634 -161.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.23 17.9 7.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.331 165.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.512 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.346 -168.136 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . 0.438 ' HD3' ' HD1' ' E' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 121.778 0.799 . . . . 0.0 110.852 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.4 t -60.07 136.73 58.11 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.191 168.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . 0.438 ' HD1' ' HD3' ' E' ' 2' ' ' LYS . 0.7 OUTLIER -104.55 -15.62 15.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.419 174.636 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.485 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -60.75 -38.75 86.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.068 178.569 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 19.1 p -111.38 -50.69 2.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 113.76 -1.564 . . . . 0.0 110.895 171.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.89 13.54 9.23 Favored Glycine 0 CA--C 1.522 0.512 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.849 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -100.3 163.6 12.32 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.563 -0.319 . . . . 0.0 110.363 172.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -90.33 143.51 26.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.239 -166.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.51 -69.06 0.33 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 164.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 45.3 p-80 -89.15 -178.77 5.74 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.286 -0.457 . . . . 0.0 110.331 -165.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.895 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -109.5 151.64 11.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.961 0.886 . . . . 0.0 110.527 -166.479 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.895 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -59.95 -55.08 38.44 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.259 -172.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.638 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -62.19 -14.15 34.84 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.684 0.754 . . . . 0.0 110.546 -170.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.46 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.264 0.0 OUTLIER -109.48 16.91 21.93 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.968 -174.11 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 37.0 t -77.63 132.74 38.38 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -162.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -84.6 -38.05 20.38 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.131 163.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.623 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.296 -168.951 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt . . . . . 0 C--O 1.235 0.331 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -60.57 148.57 37.62 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.953 163.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.5 -9.81 10.77 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.462 -175.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -64.48 -51.27 63.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.237 0.541 . . . . 0.0 110.193 164.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . 0.422 ' HB3' ' HB2' ' E' ' 18' ' ' ALA . 25.7 p -109.02 -33.41 6.91 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.036 -172.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 105.55 -30.0 10.53 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -176.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -63.35 135.58 57.1 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.282 -0.459 . . . . 0.0 110.236 -172.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -67.25 139.79 57.36 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.311 -164.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.43 -69.5 0.43 Allowed Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 162.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 -87.53 169.67 11.99 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.423 -0.457 . . . . 0.0 110.45 -159.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.687 HG23 ' HB3' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -91.59 148.9 4.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.359 -172.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.509 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -57.76 -50.37 73.46 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.486 177.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -11.6 16.78 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.7 0.762 . . . . 0.0 110.473 -169.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.687 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -119.7 15.74 12.73 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.78 -169.821 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.93 -94.47 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.821 -0.55 . . . . 0.0 109.703 -157.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 61.29 74.83 0.43 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 121.832 -0.542 . . . . 0.0 109.916 -154.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . 0.422 ' HB2' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.238 0.492 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.332 -170.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.205 0 CA-C-O 120.901 0.381 . . . . 0.0 110.645 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.0 t -60.76 148.79 37.73 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.172 167.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -116.58 -14.39 10.88 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.103 -172.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.471 HD22 ' HB3' ' E' ' 16' ' ' CYS . 47.3 t30 -62.28 -54.22 43.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.164 164.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.1 p -105.52 -22.35 13.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.013 -170.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.87 -31.27 7.42 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.8 mmtm -61.78 166.12 4.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.107 -0.547 . . . . 0.0 110.345 -174.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.95 139.61 32.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.324 -165.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.35 47.62 5.66 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 161.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 26.7 p-80 -169.56 169.57 8.67 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 122.29 -0.535 . . . . 0.0 110.281 155.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.899 HG23 ' ND2' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -104.69 141.75 19.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 122.066 0.936 . . . . 0.0 110.121 -167.122 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.86 -34.37 69.68 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.581 -169.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -15.87 54.45 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.562 -168.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.899 ' ND2' HG23 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -128.54 21.01 6.09 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.364 -162.431 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . 0.471 ' HB3' HD22 ' E' ' 5' ' ' ASN . 39.9 t -74.84 147.44 41.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.433 -161.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 2.9 tpt85 -90.48 -51.28 5.49 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.853 158.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.633 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.306 -169.519 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.98 0.419 . . . . 0.0 110.638 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.4 t -61.63 136.98 58.21 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.778 167.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -114.03 -3.67 13.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.185 -1.371 . . . . 0.0 111.844 175.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.511 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -62.53 -49.73 74.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.258 0.551 . . . . 0.0 110.247 166.182 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 25.2 p -106.18 -48.86 3.49 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.72 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.11 27.68 3.36 Favored Glycine 0 CA--C 1.525 0.673 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.483 -175.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -116.65 147.41 41.96 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.041 -0.579 . . . . 0.0 110.415 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -74.82 146.12 42.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.334 -164.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.85 45.73 56.35 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 160.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 23.5 p-80 -165.84 168.91 15.48 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 122.368 -0.489 . . . . 0.0 110.011 155.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.769 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -102.85 147.39 9.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 122.221 1.01 . . . . 0.0 110.464 -162.782 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.769 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -59.42 -52.78 64.15 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.027 -169.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.669 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.3 OUTLIER -61.9 -16.88 54.18 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.38 -171.217 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.495 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.274 0.0 OUTLIER -101.96 16.24 26.59 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.288 -175.912 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.1 t -86.37 149.9 24.7 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -162.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.56 17.57 6.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.454 164.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.579 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.351 -167.846 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.321 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.0 t -61.85 137.92 58.29 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.671 160.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.9 -9.96 14.76 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.708 177.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.468 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -61.68 -44.4 97.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.193 171.412 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 20.4 p -110.94 -47.54 3.21 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.649 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.17 22.99 5.38 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.687 -175.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.2 155.25 24.29 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.001 -0.599 . . . . 0.0 110.471 -179.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -87.34 138.1 31.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.391 -171.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.3 -63.48 0.61 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 167.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 49.4 p-80 -101.49 176.59 5.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.154 0.502 . . . . 0.0 110.399 -165.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.58 HG12 ' H ' ' E' ' 14' ' ' ARG . 1.7 tt -97.82 155.46 3.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.251 -175.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.468 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -55.94 -46.43 78.52 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.709 171.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.58 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.66 -10.25 8.04 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-O 121.557 0.694 . . . . 0.0 110.505 -169.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.573 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.258 0.0 OUTLIER -125.21 15.31 8.39 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.949 -167.526 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.1 t -81.47 143.69 31.9 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.887 -0.508 . . . . 0.0 109.735 -158.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -115.0 10.04 16.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.438 166.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.556 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.42 -173.538 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . 0.447 ' NZ ' ' CB ' ' E' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.465 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -59.66 136.68 58.07 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.911 157.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.26 -0.61 17.67 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.862 177.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.505 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -67.17 -56.56 9.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.173 165.476 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.0 p -102.01 -38.13 7.9 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.73 -175.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.75 17.6 27.73 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.5 mttp -94.62 173.69 7.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.271 168.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.83 134.59 43.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.349 -166.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.97 50.13 5.03 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 163.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -172.43 -175.68 1.42 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 122.465 -0.432 . . . . 0.0 110.116 157.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.701 HG23 ' HB3' ' E' ' 15' ' ' ASN . 5.1 tp -108.6 144.87 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.82 -161.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.505 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -57.43 -54.66 44.25 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.519 -1.218 . . . . 0.0 111.557 175.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.411 ' H ' HG13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.6 -11.65 12.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.576 0.703 . . . . 0.0 110.506 -169.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.701 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -115.91 16.8 16.16 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.218 -172.722 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.7 t -89.52 145.58 25.19 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.088 0.471 . . . . 0.0 109.831 -162.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.45 -24.54 12.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.314 167.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.623 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.341 -169.802 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.824 0.345 . . . . 0.0 110.477 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -61.5 142.49 57.01 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.739 160.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.6 -3.09 9.84 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.745 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 5' ' ' ASN . . . . . 0.479 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -61.4 -47.37 86.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.25 0.548 . . . . 0.0 110.077 162.74 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' E' E ' 6' ' ' CYS . . . . . 0.76 ' HB3' ' HB2' ' E' ' 18' ' ' ALA . 24.7 p -110.22 -46.1 3.48 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.906 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.66 -36.91 2.15 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -177.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.92 173.64 5.18 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.269 -168.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.71 145.04 25.13 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.326 -163.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.13 49.78 8.21 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 160.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 35.5 p-80 -175.0 175.23 2.35 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 122.361 -0.493 . . . . 0.0 110.063 156.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 12' ' ' ILE . . . . . 0.908 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -106.52 151.72 8.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.951 0.882 . . . . 0.0 110.518 -163.626 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' E' E ' 13' ' ' ALA . . . . . 0.908 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -61.9 -52.84 62.46 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.972 -169.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 14' ' ' ARG . . . . . 0.514 ' H ' HD13 ' E' ' 12' ' ' ILE . 14.1 tpt180 -62.2 -16.9 56.28 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.283 -171.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 15' ' ' ASN . . . . . 0.446 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -102.33 19.63 18.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.097 -176.137 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 23.9 t -94.66 164.93 12.75 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.289 0.566 . . . . 0.0 109.848 -163.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -142.1 21.11 2.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.357 -173.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 18' ' ' ALA . . . . . 0.76 ' HB2' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.241 0.651 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.217 -169.78 . . . . . . . . 1 1 . 1 . 001 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 . 001 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 . 001 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 . 001 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 . 001 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 . 001 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.65 HG22 ' H ' ' E' ' 2' ' ' LYS . 9.9 p . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.65 ' H ' HG22 ' E' ' 1' ' ' VAL . 1.1 ptpm? -105.13 147.31 28.08 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.197 -162.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -60.02 142.02 54.66 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.67 156.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -111.49 -10.23 14.17 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.464 -1.243 . . . . 0.0 111.676 177.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -61.85 -44.53 96.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.242 170.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 20.3 p -113.64 -39.04 4.14 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 114.946 -1.024 . . . . 0.0 110.722 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.5 16.27 25.07 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.92 172.14 8.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.359 -0.42 . . . . 0.0 110.381 172.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -99.39 137.23 38.18 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.32 -167.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.78 43.78 17.08 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.532 -1.027 . . . . 0.0 110.532 161.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -162.63 -176.65 5.12 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 122.349 -0.501 . . . . 0.0 110.077 156.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.815 HG23 ' ND2' ' E' ' 15' ' ' ASN . 1.7 tp -118.6 145.06 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 121.867 0.841 . . . . 0.0 109.698 -159.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.52 -37.34 87.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.003 -167.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -18.27 59.6 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.452 -168.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.815 ' ND2' HG23 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -120.5 15.32 12.03 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.934 -163.836 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 36.0 t -80.43 126.66 31.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.578 -160.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.16 -47.81 69.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.254 162.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.59 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.307 -170.081 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.825 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.392 0 O4'-C1'-N19 109.33 1.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.84 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.514 1 P-O3'-C3' 107.769 -9.942 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.842 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.629 1 P-O3'-C3' 107.693 -10.006 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.842 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.739 1 P-O3'-C3' 107.86 -9.866 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.918 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.612 1.861 1 P-O3'-C3' 108.429 -9.393 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.918 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 4.3 p . . . . . 0 N--CA 1.476 0.874 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.591 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -101.41 144.83 29.73 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.208 161.196 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.1 t -59.67 135.9 57.82 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.908 157.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -115.39 0.68 13.5 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.793 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -65.85 -55.59 16.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.194 0.521 . . . . 0.0 110.196 162.591 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 24.3 p -97.9 -44.69 6.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.732 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.9 -36.52 2.61 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.553 -172.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -64.02 166.85 7.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.36 -0.42 . . . . 0.0 110.244 -168.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.67 134.35 34.47 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.277 -164.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.58 -67.72 0.44 Allowed Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 163.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -92.01 -178.27 4.95 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 122.593 -0.357 . . . . 0.0 110.231 -160.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.741 HG23 ' HB3' ' E' ' 15' ' ' ASN . 3.1 tp -102.04 148.96 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.56 -160.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.557 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -57.37 -56.14 25.68 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.287 -1.324 . . . . 0.0 111.619 175.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.409 ' H ' HG13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.58 -11.46 11.39 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.5 0.667 . . . . 0.0 110.47 -170.035 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.741 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -116.19 16.06 15.93 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.251 -172.765 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 33.6 t -85.44 156.64 20.74 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -163.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.33 -37.0 5.4 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.203 163.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.578 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.389 -173.516 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.826 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.366 0 O4'-C1'-N19 109.333 1.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.839 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.56 1 P-O3'-C3' 107.776 -9.937 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.839 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.727 1 P-O3'-C3' 107.677 -10.02 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.832 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.675 1 P-O3'-C3' 107.815 -9.904 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.825 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.611 1.793 1 P-O3'-C3' 108.449 -9.376 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.825 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 7.8 p . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 121.466 0.651 . . . . 0.0 109.665 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.744 ' H ' HG22 ' E' ' 1' ' ' VAL . 1.2 ptpm? -104.5 141.15 36.88 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.325 -173.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -60.36 140.25 57.25 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.796 156.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.5 -13.61 14.81 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.825 -1.079 . . . . 0.0 111.424 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.534 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -62.09 -41.13 97.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.141 173.743 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . 0.501 ' HB3' ' HA ' ' E' ' 18' ' ' ALA . 18.4 p -113.87 -38.71 4.16 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.719 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 119.64 -22.19 8.84 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.75 170.87 15.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.296 -169.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.92 141.1 28.78 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.27 -167.154 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.33 -69.31 0.43 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.401 -1.08 . . . . 0.0 110.401 161.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -96.51 -179.34 4.58 Favored 'General case' 0 C--N 1.332 -0.196 0 O-C-N 122.472 -0.428 . . . . 0.0 110.201 -160.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.857 HG23 ' ND2' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -117.0 146.64 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 122.294 1.045 . . . . 0.0 110.474 -161.967 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.773 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -64.25 -36.12 83.05 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.514 0.673 . . . . 0.0 110.959 -158.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.658 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.87 -16.11 47.87 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.538 -167.536 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.857 ' ND2' HG23 ' E' ' 12' ' ' ILE . 0.1 OUTLIER -120.9 17.36 11.79 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.765 -165.003 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.6 t -80.97 159.91 24.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.654 -161.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -135.67 17.19 3.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.547 169.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . 0.501 ' HA ' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.241 0.613 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.39 -170.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.811 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.39 0 O4'-C1'-N19 109.336 1.92 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.858 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.57 1 P-O3'-C3' 107.756 -9.953 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.863 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.694 1 P-O3'-C3' 107.706 -9.995 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.863 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.675 1 P-O3'-C3' 107.874 -9.855 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.85 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.61 1.749 1 P-O3'-C3' 108.413 -9.406 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.85 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 5.1 p . . . . . 0 N--CA 1.471 0.61 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.607 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -101.97 137.22 40.55 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.251 163.085 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 32.1 t -60.02 133.18 55.85 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.892 157.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.34 -10.63 16.89 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.657 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.461 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -61.87 -56.62 17.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.179 170.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 24.1 p -96.04 -45.71 6.79 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.685 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.91 -21.0 5.93 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.55 173.71 11.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.307 -0.447 . . . . 0.0 110.352 -169.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -100.84 128.67 46.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.339 -165.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.68 46.3 3.22 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 161.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 -172.76 -177.64 1.71 Allowed 'General case' 0 N--CA 1.465 0.29 0 O-C-N 122.511 -0.405 . . . . 0.0 110.229 158.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.722 HG23 ' HB3' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -104.74 146.14 12.35 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.844 -162.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.512 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -54.26 -54.1 44.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.075 172.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -10.52 10.68 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.559 0.695 . . . . 0.0 110.602 -168.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.722 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -116.37 15.53 15.78 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.085 -0.962 . . . . 0.0 110.38 -172.905 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 t -89.78 128.46 36.14 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.967 -0.458 . . . . 0.0 109.839 -160.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.78 -35.27 29.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.303 165.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.426 -171.501 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.823 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.317 0 O4'-C1'-N19 109.346 1.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.869 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.586 1 P-O3'-C3' 107.766 -9.945 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.869 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.642 1 P-O3'-C3' 107.691 -10.007 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.86 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.719 1 P-O3'-C3' 107.8 -9.917 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.743 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.788 1 P-O3'-C3' 108.435 -9.387 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.793 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 8.2 p . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.631 ' H ' HG22 ' E' ' 1' ' ' VAL . 2.9 pttp -109.59 145.42 36.42 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.487 -167.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 t -61.76 146.49 49.24 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.911 163.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -117.78 -12.34 10.24 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.274 -173.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.458 HD22 ' HB3' ' E' ' 16' ' ' CYS . 47.9 t30 -62.04 -50.64 71.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.234 0.54 . . . . 0.0 110.17 164.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 p -107.18 -36.48 6.55 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.082 -173.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 115.16 -28.54 7.89 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -74.5 153.1 39.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.278 -168.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -76.09 135.98 39.87 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.333 -165.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.12 -72.18 0.47 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.366 -1.094 . . . . 0.0 110.366 163.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -90.28 -174.81 4.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.245 0.545 . . . . 0.0 110.389 -158.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.716 HD13 ' H ' ' E' ' 14' ' ' ARG . 0.0 OUTLIER -109.72 145.09 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-O 121.815 0.817 . . . . 0.0 110.23 -166.291 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.25 -38.92 69.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.553 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.716 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.9 OUTLIER -70.09 -33.05 71.39 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.186 -170.106 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.685 ' ND2' HG22 ' E' ' 12' ' ' ILE 0.258 0.0 OUTLIER -108.61 43.92 1.19 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 114.331 -1.304 . . . . 0.0 110.229 -177.715 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . 0.458 ' HB3' HD22 ' E' ' 5' ' ' ASN . 35.6 t -87.73 157.1 19.14 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.557 -170.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -112.83 -38.92 4.41 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.125 163.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.646 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.297 -168.86 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.832 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.369 0 O4'-C1'-N19 109.37 1.963 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.832 " O5'" " C2'" ' D' ' 1' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.589 1 P-O3'-C3' 107.776 -9.937 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.833 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.681 1 P-O3'-C3' 107.638 -10.052 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.833 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.65 1 P-O3'-C3' 107.789 -9.926 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.814 " H1'" HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.612 1.859 1 P-O3'-C3' 108.457 -9.37 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.814 HG12 " H1'" ' D' ' 5' ' ' ' DC' . 4.3 p . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.637 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.1 OUTLIER -116.09 153.53 31.58 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 116.213 -0.449 . . . . 0.0 109.825 -159.758 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -60.41 139.43 57.69 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.491 152.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -115.01 4.21 14.66 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.783 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.652 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -70.87 -46.16 63.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.29 164.209 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 21.9 p -112.88 -16.88 12.63 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.671 -177.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.8 17.54 79.76 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -98.17 172.25 7.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.44 -0.38 . . . . 0.0 110.342 170.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -91.09 130.48 36.98 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.285 -164.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.61 59.92 2.74 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 160.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -176.95 175.02 1.65 Allowed 'General case' 0 C--O 1.234 0.269 0 O-C-N 122.073 -0.663 . . . . 0.0 110.207 154.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.867 HG23 ' ND2' ' E' ' 15' ' ' ASN . 0.0 OUTLIER -112.53 132.67 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-O 122.267 1.032 . . . . 0.0 109.225 -155.13 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.785 ' H ' HD13 ' E' ' 12' ' ' ILE . . . -60.33 -35.72 76.31 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.608 -160.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.434 ' H ' HD12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.42 -16.77 50.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.516 0.675 . . . . 0.0 110.564 -166.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.867 ' ND2' HG23 ' E' ' 12' ' ' ILE . 0.1 OUTLIER -120.39 17.26 12.2 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.698 -165.349 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.1 t -80.9 134.0 35.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.622 -162.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.33 -30.24 11.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.294 169.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.616 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.378 -169.649 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.822 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.359 0 O4'-C1'-N19 109.326 1.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.847 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.633 1 P-O3'-C3' 107.746 -9.962 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.847 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.627 1 P-O3'-C3' 107.666 -10.028 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.843 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.694 1 P-O3'-C3' 107.818 -9.901 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.759 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.792 1 P-O3'-C3' 108.479 -9.351 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.678 HG22 ' H ' ' E' ' 2' ' ' LYS . 9.9 p . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.678 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.6 OUTLIER -102.26 142.36 33.61 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.265 -163.232 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.9 t -61.2 137.4 58.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.597 158.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.94 -5.13 14.91 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.871 177.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.486 ' HB2' ' CA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -62.53 -55.13 30.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.133 166.585 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.9 p -103.13 -39.49 6.84 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.645 -176.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.2 18.04 23.02 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -176.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.62 175.05 6.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.336 168.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -102.82 140.88 36.52 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.255 -167.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.31 44.7 7.86 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 161.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -172.04 177.84 3.11 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 122.482 -0.423 . . . . 0.0 110.142 158.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.895 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -108.09 149.68 11.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 122.122 0.963 . . . . 0.0 110.505 -163.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.895 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -60.74 -54.56 43.76 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.948 -169.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.566 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -62.05 -16.45 52.0 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.563 0.697 . . . . 0.0 110.497 -170.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.485 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.274 0.0 OUTLIER -101.96 18.24 21.14 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.235 -176.82 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 29.3 t -91.38 150.29 21.34 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.877 -0.514 . . . . 0.0 109.717 -163.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 mtm105 -103.49 -39.89 6.57 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.215 164.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.569 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.269 -168.003 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.821 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.347 0 O4'-C1'-N19 109.366 1.958 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.845 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.551 1 P-O3'-C3' 107.779 -9.934 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.848 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.658 1 P-O3'-C3' 107.71 -9.992 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.848 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.647 1 P-O3'-C3' 107.816 -9.903 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.879 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.611 1.828 1 P-O3'-C3' 108.477 -9.353 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.879 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 5.7 p . . . . . 0 N--CA 1.474 0.728 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.518 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -100.45 147.47 25.83 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.164 160.032 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.3 t -60.47 140.87 57.07 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.577 156.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -112.86 -10.99 13.51 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.595 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.476 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -60.61 -44.71 95.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.284 169.747 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.4 p -110.79 -45.18 3.52 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.832 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 122.74 -32.2 4.52 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.514 -1.035 . . . . 0.0 110.514 -174.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -63.27 153.59 34.27 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.115 -0.543 . . . . 0.0 110.325 -174.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.07 143.04 29.99 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.386 -163.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.72 52.65 6.34 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 162.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 27.1 p-80 -173.51 -177.48 1.47 Allowed 'General case' 0 C--O 1.237 0.426 0 O-C-N 122.316 -0.52 . . . . 0.0 109.914 155.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.92 HD12 ' H ' ' E' ' 13' ' ' ALA . 1.5 tp -116.79 143.07 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 CA-C-O 122.264 1.03 . . . . 0.0 109.293 -154.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.92 ' H ' HD12 ' E' ' 12' ' ' ILE . . . -63.77 -44.99 91.79 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.906 -164.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.41 -19.57 63.59 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 121.805 0.812 . . . . 0.0 110.352 -169.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.775 ' ND2' HG23 ' E' ' 12' ' ' ILE . 0.1 OUTLIER -106.99 16.43 24.25 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.946 -170.117 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 t -87.53 132.01 34.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.634 -161.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.23 17.9 7.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.331 165.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.512 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.346 -168.136 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.818 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.302 0 O4'-C1'-N19 109.377 1.972 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.862 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.603 1 P-O3'-C3' 107.818 -9.902 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.862 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.632 1 P-O3'-C3' 107.655 -10.037 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.844 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.78 1 P-O3'-C3' 107.851 -9.874 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.925 ' C2 ' HG22 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.612 1.855 1 P-O3'-C3' 108.494 -9.339 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.925 HG22 ' C2 ' ' D' ' 5' ' ' ' DC' . 27.2 m . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 121.261 0.553 . . . . 0.0 109.897 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.438 ' HD3' ' HD1' ' E' ' 4' ' ' PHE . 0.0 OUTLIER -121.2 136.61 54.94 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.852 -177.749 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 29.4 t -60.07 136.73 58.11 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.191 168.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . 0.5 ' CE2' ' N1 ' ' D' ' 3' ' ' ' DG' . 0.7 OUTLIER -104.55 -15.62 15.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.419 174.636 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.485 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -60.75 -38.75 86.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.068 178.569 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 19.1 p -111.38 -50.69 2.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 113.76 -1.564 . . . . 0.0 110.895 171.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.89 13.54 9.23 Favored Glycine 0 CA--C 1.522 0.512 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.849 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -100.3 163.6 12.32 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.563 -0.319 . . . . 0.0 110.363 172.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -90.33 143.51 26.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.239 -166.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.51 -69.06 0.33 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 164.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 45.3 p-80 -89.15 -178.77 5.74 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.286 -0.457 . . . . 0.0 110.331 -165.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.895 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -109.5 151.64 11.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.961 0.886 . . . . 0.0 110.527 -166.479 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.895 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -59.95 -55.08 38.44 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.259 -172.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.638 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -62.19 -14.15 34.84 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.684 0.754 . . . . 0.0 110.546 -170.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.46 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.264 0.0 OUTLIER -109.48 16.91 21.93 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.968 -174.11 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 37.0 t -77.63 132.74 38.38 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -162.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -84.6 -38.05 20.38 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.131 163.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.623 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.296 -168.951 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.823 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.32 0 O4'-C1'-N19 109.312 1.889 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.861 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.59 1 P-O3'-C3' 107.79 -9.925 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.866 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.67 1 P-O3'-C3' 107.669 -10.026 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.866 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.709 1 P-O3'-C3' 107.837 -9.885 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.758 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.775 1 P-O3'-C3' 108.497 -9.336 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.736 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 90.3 t . . . . . 0 N--CA 1.473 0.718 0 CA-C-O 121.437 0.637 . . . . 0.0 109.858 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -122.88 148.96 44.82 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.485 -167.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -60.57 148.57 37.62 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.953 163.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.5 -9.81 10.77 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.462 -175.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -64.48 -51.27 63.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.237 0.541 . . . . 0.0 110.193 164.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . 0.422 ' HB3' ' HB2' ' E' ' 18' ' ' ALA . 25.7 p -109.02 -33.41 6.91 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.036 -172.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 105.55 -30.0 10.53 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -176.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -63.35 135.58 57.1 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.282 -0.459 . . . . 0.0 110.236 -172.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -67.25 139.79 57.36 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.311 -164.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.43 -69.5 0.43 Allowed Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 162.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 -87.53 169.67 11.99 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.423 -0.457 . . . . 0.0 110.45 -159.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.687 HG23 ' HB3' ' E' ' 15' ' ' ASN . 0.6 OUTLIER -91.59 148.9 4.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.359 -172.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.509 ' N ' HG13 ' E' ' 12' ' ' ILE . . . -57.76 -50.37 73.46 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.486 177.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -11.6 16.78 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.7 0.762 . . . . 0.0 110.473 -169.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.687 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.256 0.0 OUTLIER -119.7 15.74 12.73 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.78 -169.821 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.93 -94.47 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.821 -0.55 . . . . 0.0 109.703 -157.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 61.29 74.83 0.43 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 121.832 -0.542 . . . . 0.0 109.916 -154.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . 0.422 ' HB2' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.238 0.492 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.332 -170.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.816 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.374 0 O4'-C1'-N19 109.263 1.829 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.861 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.537 1 P-O3'-C3' 107.754 -9.955 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.861 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.739 1 P-O3'-C3' 107.665 -10.029 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.853 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.699 1 P-O3'-C3' 107.834 -9.888 . . . . 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 1.792 1 P-O3'-C3' 108.482 -9.349 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.589 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 42.4 t . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 121.035 0.445 . . . . 0.0 109.855 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.455 ' N ' HG12 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -111.03 143.36 41.85 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.645 -170.196 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.0 t -60.76 148.79 37.73 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.172 167.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -116.58 -14.39 10.88 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.103 -172.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.471 HD22 ' HB3' ' E' ' 16' ' ' CYS . 47.3 t30 -62.28 -54.22 43.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.164 164.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 27.1 p -105.52 -22.35 13.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.013 -170.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.87 -31.27 7.42 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.8 mmtm -61.78 166.12 4.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.107 -0.547 . . . . 0.0 110.345 -174.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.95 139.61 32.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.324 -165.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.35 47.62 5.66 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 161.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 26.7 p-80 -169.56 169.57 8.67 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 122.29 -0.535 . . . . 0.0 110.281 155.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.899 HG23 ' ND2' ' E' ' 15' ' ' ASN . 0.7 OUTLIER -104.69 141.75 19.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 122.066 0.936 . . . . 0.0 110.121 -167.122 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.86 -34.37 69.68 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.581 -169.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -15.87 54.45 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.562 -168.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.899 ' ND2' HG23 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -128.54 21.01 6.09 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.364 -162.431 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . 0.471 ' HB3' HD22 ' E' ' 5' ' ' ASN . 39.9 t -74.84 147.44 41.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.433 -161.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 2.9 tpt85 -90.48 -51.28 5.49 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.853 158.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.633 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.306 -169.519 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.805 " H2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.264 0 O4'-C1'-N19 109.36 1.95 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.851 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.547 1 P-O3'-C3' 107.814 -9.905 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.851 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.598 1 P-O3'-C3' 107.626 -10.061 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.84 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.693 1 P-O3'-C3' 107.798 -9.919 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.764 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.798 1 P-O3'-C3' 108.422 -9.398 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.642 HG11 ' O2 ' ' D' ' 4' ' ' ' DC' . 69.6 t . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 121.544 0.688 . . . . 0.0 109.887 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.535 ' N ' HG12 ' E' ' 1' ' ' VAL . 0.3 OUTLIER -114.4 149.48 36.11 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.638 -173.418 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.4 t -61.63 136.98 58.21 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.778 167.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -114.03 -3.67 13.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.185 -1.371 . . . . 0.0 111.844 175.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.511 ' HB2' ' HB1' ' E' ' 13' ' ' ALA . 0.6 OUTLIER -62.53 -49.73 74.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.258 0.551 . . . . 0.0 110.247 166.182 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 25.2 p -106.18 -48.86 3.49 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.72 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.11 27.68 3.36 Favored Glycine 0 CA--C 1.525 0.673 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.483 -175.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -116.65 147.41 41.96 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.041 -0.579 . . . . 0.0 110.415 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -74.82 146.12 42.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.334 -164.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.85 45.73 56.35 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 160.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 23.5 p-80 -165.84 168.91 15.48 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 122.368 -0.489 . . . . 0.0 110.011 155.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.769 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -102.85 147.39 9.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 122.221 1.01 . . . . 0.0 110.464 -162.782 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.769 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -59.42 -52.78 64.15 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.027 -169.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.669 ' H ' HD13 ' E' ' 12' ' ' ILE . 0.3 OUTLIER -61.9 -16.88 54.18 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.38 -171.217 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.495 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.274 0.0 OUTLIER -101.96 16.24 26.59 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.288 -175.912 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 34.1 t -86.37 149.9 24.7 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -162.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.56 17.57 6.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.454 164.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.579 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.351 -167.846 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.816 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.323 0 O4'-C1'-N19 109.323 1.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.864 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.643 1 P-O3'-C3' 107.79 -9.925 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.864 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.634 1 P-O3'-C3' 107.645 -10.046 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.854 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.698 1 P-O3'-C3' 107.805 -9.913 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.817 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.611 1.785 1 P-O3'-C3' 108.432 -9.39 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.817 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 10.0 p . . . . . 0 N--CA 1.475 0.781 0 CA-C-O 121.317 0.58 . . . . 0.0 109.765 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.668 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -97.4 133.77 41.56 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.389 -167.242 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 30.0 t -61.85 137.92 58.29 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.671 160.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.9 -9.96 14.76 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.708 177.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.468 ' HB2' ' CB ' ' E' ' 13' ' ' ALA . 0.5 OUTLIER -61.68 -44.4 97.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.193 171.412 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 20.4 p -110.94 -47.54 3.21 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.649 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.17 22.99 5.38 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.687 -175.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.2 155.25 24.29 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.001 -0.599 . . . . 0.0 110.471 -179.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -87.34 138.1 31.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.391 -171.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.3 -63.48 0.61 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 167.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 49.4 p-80 -101.49 176.59 5.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.154 0.502 . . . . 0.0 110.399 -165.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.587 HD12 ' H41' ' D' ' 5' ' ' ' DC' . 1.7 tt -97.82 155.46 3.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.251 -175.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.468 ' CB ' ' HB2' ' E' ' 5' ' ' ASN . . . -55.94 -46.43 78.52 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.709 171.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.58 ' H ' HG12 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.66 -10.25 8.04 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-O 121.557 0.694 . . . . 0.0 110.505 -169.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.573 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.258 0.0 OUTLIER -125.21 15.31 8.39 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.949 -167.526 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 35.1 t -81.47 143.69 31.9 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.887 -0.508 . . . . 0.0 109.735 -158.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -115.0 10.04 16.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.438 166.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.556 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.42 -173.538 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.823 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.606 1.29 0 O4'-C1'-N19 109.329 1.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.842 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.536 1 P-O3'-C3' 107.821 -9.899 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.842 " H5'" H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.609 1.64 1 P-O3'-C3' 107.638 -10.052 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.834 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.732 1 P-O3'-C3' 107.825 -9.896 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.754 ' C2 ' HG12 ' E' ' 1' ' ' VAL . . . . . . . . 0 P--O5' 1.612 1.856 1 P-O3'-C3' 108.484 -9.346 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.754 HG12 ' C2 ' ' D' ' 5' ' ' ' DC' . 6.8 p . . . . . 0 N--CA 1.477 0.922 0 CA-C-O 121.442 0.639 . . . . 0.0 109.662 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.705 ' H ' HG22 ' E' ' 1' ' ' VAL . 0.0 OUTLIER -105.31 147.18 28.41 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.332 -170.121 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -59.66 136.68 58.07 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.911 157.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.26 -0.61 17.67 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.862 177.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.505 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -67.17 -56.56 9.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.173 165.476 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . . . . . . . . . 22.0 p -102.01 -38.13 7.9 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.73 -175.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.75 17.6 27.73 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 6.5 mttp -94.62 173.69 7.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.271 168.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.83 134.59 43.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.349 -166.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.97 50.13 5.03 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 163.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -172.43 -175.68 1.42 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 122.465 -0.432 . . . . 0.0 110.116 157.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.701 HG23 ' HB3' ' E' ' 15' ' ' ASN . 5.1 tp -108.6 144.87 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.82 -161.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.505 ' HA ' ' HB2' ' E' ' 5' ' ' ASN . . . -57.43 -54.66 44.25 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.519 -1.218 . . . . 0.0 111.557 175.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.411 ' H ' HG13 ' E' ' 12' ' ' ILE . 0.0 OUTLIER -61.6 -11.65 12.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.576 0.703 . . . . 0.0 110.506 -169.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.701 ' HB3' HG23 ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -115.91 16.8 16.16 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.218 -172.722 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 27.7 t -89.52 145.58 25.19 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.088 0.471 . . . . 0.0 109.831 -162.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.45 -24.54 12.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.314 167.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.623 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.341 -169.802 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D ' 1' ' ' ' DA' . . . . . 0.818 " C2'" " O5'" ' D' ' 2' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.353 0 O4'-C1'-N19 109.299 1.873 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.849 H2'' " H5'" ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.571 1 P-O3'-C3' 107.785 -9.929 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.853 H2'' " H5'" ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.67 1 P-O3'-C3' 107.641 -10.05 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 4' ' ' ' DC' . . . . . 0.853 " H5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.698 1 P-O3'-C3' 107.83 -9.892 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.751 " H5'" H2'' ' D' ' 4' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.92 1 P-O3'-C3' 108.47 -9.358 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 1' ' ' VAL . . . . . 0.604 HG12 " H1'" ' D' ' 5' ' ' ' DC' . 14.5 p . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.561 ' H ' HG22 ' E' ' 1' ' ' VAL . 8.9 ptpt -105.94 144.23 32.96 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.477 -163.16 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -61.5 142.49 57.01 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.739 160.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.6 -3.09 9.84 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.745 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 5' ' ' ASN . . . . . 0.479 ' HB2' ' HA ' ' E' ' 13' ' ' ALA . 0.7 OUTLIER -61.4 -47.37 86.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.25 0.548 . . . . 0.0 110.077 162.74 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' E' E ' 6' ' ' CYS . . . . . 0.76 ' HB3' ' HB2' ' E' ' 18' ' ' ALA . 24.7 p -110.22 -46.1 3.48 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.906 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.66 -36.91 2.15 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -177.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.92 173.64 5.18 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.269 -168.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.71 145.04 25.13 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.326 -163.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.13 49.78 8.21 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 160.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 11' ' ' HIS . . . . . . . . . . . . . 35.5 p-80 -175.0 175.23 2.35 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 122.361 -0.493 . . . . 0.0 110.063 156.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 12' ' ' ILE . . . . . 0.908 HD13 ' N ' ' E' ' 13' ' ' ALA . 0.0 OUTLIER -106.52 151.72 8.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.951 0.882 . . . . 0.0 110.518 -163.626 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.908 ' N ' HD13 ' E' ' 12' ' ' ILE . . . -61.9 -52.84 62.46 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.972 -169.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 14' ' ' ARG . . . . . 0.514 ' H ' HD13 ' E' ' 12' ' ' ILE . 14.1 tpt180 -62.2 -16.9 56.28 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.283 -171.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 15' ' ' ASN . . . . . 0.446 ' HB3' ' CG2' ' E' ' 12' ' ' ILE 0.269 0.0 OUTLIER -102.33 19.63 18.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.097 -176.137 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 23.9 t -94.66 164.93 12.75 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.289 0.566 . . . . 0.0 109.848 -163.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -142.1 21.11 2.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.357 -173.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 18' ' ' ALA . . . . . 0.76 ' HB2' ' HB3' ' E' ' 6' ' ' CYS . . . . . . . . 0 C--O 1.241 0.651 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.217 -169.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 19' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_