data_2o9l_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 2o9l _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 32.4 mt . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.7 p -71.19 -168.95 0.34 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.381 1.472 . . . . 0.0 112.683 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -48.48 -25.22 1.56 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.581 1.552 . . . . 0.0 114.556 172.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.7 40.11 0.14 Allowed Glycine 0 CA--C 1.529 0.929 0 CA-C-O 117.688 -1.618 . . . . 0.0 116.063 174.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.98 -14.06 31.56 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 121.435 2.618 . . . . 0.0 113.364 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pp -111.34 -16.87 13.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.87 1.268 . . . . 0.0 113.278 168.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 9.5 ttm -67.65 -67.05 0.49 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.351 1.46 . . . . 0.0 110.031 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.0 pttp -74.45 18.76 0.15 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.59 1.556 . . . . 0.0 113.712 -172.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -128.8 -38.4 1.68 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 129.53 3.132 . . . . 0.0 111.158 -172.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -61.99 -35.57 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 CA-C-N 119.447 1.021 . . . . 0.0 111.441 -177.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.57 -13.11 28.11 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -177.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -91.59 -17.44 25.59 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 126.855 2.062 . . . . 0.0 111.579 -174.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.29 -46.32 9.73 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 C-N-CA 124.95 1.3 . . . . 0.0 109.727 169.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 87.9 t -64.66 -35.81 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 119.923 1.238 . . . . 0.0 111.091 -175.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -83.74 5.07 26.11 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -112.28 -16.28 13.0 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.471 1.909 . . . . 0.0 113.445 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -94.71 -86.83 0.28 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.152 0.981 . . . . 0.0 111.708 -173.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -139.69 85.11 2.02 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.26 1.424 . . . . 0.0 109.669 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -59.4 -17.99 35.15 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.491 1.116 . . . . 0.0 113.574 172.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -87.74 -7.95 56.67 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 126.607 1.963 . . . . 0.0 113.852 174.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -146.72 71.12 12.6 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 127.438 2.295 . . . . 0.0 110.456 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -69.37 160.49 49.6 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.874 2.383 . . . . 0.0 113.332 -168.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -76.6 -174.25 2.88 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.143 1.377 . . . . 0.0 111.004 167.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -134.0 169.62 16.85 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.078 1.751 . . . . 0.0 110.131 173.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -55.64 -31.34 62.25 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 176.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -68.24 -54.38 18.05 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 119.836 -1.79 . . . . 0.0 110.932 167.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -62.17 -47.48 84.32 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.793 -1.192 . . . . 0.0 112.702 -173.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 pt -59.63 -38.75 77.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.752 1.16 . . . . 0.0 112.061 172.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.2 -34.99 77.52 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.656 1.116 . . . . 0.0 112.055 176.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -68.2 -54.26 19.09 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.213 1.005 . . . . 0.0 112.819 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.8 mt -63.2 -32.89 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-N 119.063 0.847 . . . . 0.0 111.452 -177.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mp -63.3 -20.09 65.17 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.155 1.382 . . . . 0.0 112.855 176.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 ptmt -81.53 -14.89 56.35 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.706 0.803 . . . . 0.0 112.646 173.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -88.21 -11.73 45.87 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.247 0.619 . . . . 0.0 112.361 -176.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.2 pttt -129.06 -27.3 2.51 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.81 6.24 0.04 OUTLIER Glycine 0 N--CA 1.471 0.997 0 CA-C-N 120.592 1.542 . . . . 0.0 116.941 160.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -99.3 -39.86 8.21 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.527 1.163 . . . . 0.0 111.361 -168.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.418 ' HB3' ' HE3' ' A' ' 40' ' ' LYS 0.29 0.0 OUTLIER 37.85 51.06 1.33 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 128.138 2.575 . . . . 0.0 111.776 179.617 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.1 p -91.66 139.88 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 111.592 -2.549 . . . . 0.0 109.194 171.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.09 165.61 18.37 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 128.857 2.863 . . . . 0.0 112.414 176.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.57 -26.6 68.67 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 125.589 1.555 . . . . 0.0 113.981 -177.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -34.38 76.62 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.835 0.854 . . . . 0.0 111.31 -177.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.0 m -84.91 -47.5 10.24 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 127.222 2.209 . . . . 0.0 109.948 -176.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.78 -28.33 42.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.949 -173.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.03 -47.39 80.43 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 125.672 1.589 . . . . 0.0 111.06 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -67.92 -18.27 64.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.106 1.362 . . . . 0.0 112.443 179.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -89.58 -50.35 6.13 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.48 1.512 . . . . 0.0 112.84 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -22.26 47.45 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.687 1.13 . . . . 0.0 112.144 172.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -69.49 -44.18 71.67 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.951 0.9 . . . . 0.0 112.871 170.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.9 ptp -83.31 -31.57 26.78 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -172.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 mp -65.64 -63.48 1.08 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.426 1.09 . . . . 0.0 111.205 175.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.96 8.07 0.03 OUTLIER Glycine 0 CA--C 1.536 1.372 0 N-CA-C 118.227 2.051 . . . . 0.0 118.227 171.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.5 mt -90.96 125.19 59.68 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 119.629 1.714 . . . . 0.0 111.217 -173.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.74 -53.25 0.28 Allowed 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.016 2.477 . . . . 0.0 110.78 175.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.2 p -158.89 -10.99 0.07 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 163.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 56.3 m 61.72 -18.4 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 128.293 2.637 . . . . 0.0 116.071 -164.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -67.11 -42.0 85.27 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 120.476 1.489 . . . . 0.0 109.012 168.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -25.09 54.02 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.993 0.917 . . . . 0.0 113.263 -178.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.9 mtm180 -72.2 -42.82 65.37 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.412 1.485 . . . . 0.0 112.302 169.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -69.49 -58.77 3.56 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.051 1.74 . . . . 0.0 113.229 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.8 tp . . . . . 0 C--O 1.254 1.309 0 C-N-CA 125.985 1.714 . . . . 0.0 114.43 -168.099 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 35.9 mt . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.2 p -71.29 -173.49 0.88 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.701 1.2 . . . . 0.0 112.158 170.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -51.23 -24.46 4.4 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.23 1.412 . . . . 0.0 114.791 175.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.77 39.12 0.21 Allowed Glycine 0 C--N 1.341 0.841 0 CA-C-O 117.61 -1.661 . . . . 0.0 115.954 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.8 -15.82 23.51 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 120.831 2.316 . . . . 0.0 113.137 177.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pp -108.92 -18.4 13.69 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.959 1.303 . . . . 0.0 112.795 170.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.405 ' C ' ' H ' ' A' ' 11' ' ' LEU . 1.4 ttt -73.38 -59.45 2.71 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.541 1.536 . . . . 0.0 111.255 -176.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -76.32 19.2 0.26 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.777 1.231 . . . . 0.0 113.005 -174.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' A' ' 9' ' ' MET . 3.2 mm? -130.57 -38.93 1.3 Allowed 'General case' 0 C--O 1.233 0.223 0 C-N-CA 129.703 3.201 . . . . 0.0 110.992 -170.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.6 pt -64.04 -34.32 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 CA-C-N 119.07 0.85 . . . . 0.0 111.359 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.93 -13.83 43.61 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -93.22 -18.33 22.64 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.48 1.912 . . . . 0.0 111.847 -171.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.95 -48.8 10.99 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.165 0 C-N-CA 124.568 1.147 . . . . 0.0 108.933 168.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.0 t -65.55 -34.6 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 119.961 1.255 . . . . 0.0 111.407 -172.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -81.56 3.22 25.81 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.42 -7.71 9.69 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.153 1.781 . . . . 0.0 114.186 -176.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -100.53 -85.76 0.41 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.838 0.855 . . . . 0.0 112.296 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -136.88 87.77 2.31 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.913 1.285 . . . . 0.0 110.98 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -58.12 -23.82 56.45 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.959 0.904 . . . . 0.0 112.777 166.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -27.49 62.88 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 128.365 2.666 . . . . 0.0 113.914 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -148.29 75.63 10.45 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 127.122 2.169 . . . . 0.0 110.116 -170.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.2 161.48 45.83 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.14 2.56 . . . . 0.0 112.533 -170.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -78.7 -176.22 4.79 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.539 1.136 . . . . 0.0 110.964 167.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 55.1 p -137.43 169.59 17.52 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.098 1.759 . . . . 0.0 110.527 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -56.01 -32.1 63.68 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -67.16 -55.29 14.79 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 120.226 -1.546 . . . . 0.0 110.813 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -61.83 -49.29 76.88 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 120.786 -1.196 . . . . 0.0 112.866 -173.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.9 pt -59.07 -38.53 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 119.484 1.038 . . . . 0.0 112.183 173.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.56 -35.22 78.8 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.803 1.183 . . . . 0.0 111.827 176.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -68.89 -53.19 22.51 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.422 1.089 . . . . 0.0 112.947 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.404 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.8 mt -64.16 -32.86 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 O-C-N 121.321 -0.862 . . . . 0.0 111.433 -177.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.13 -24.69 67.3 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.242 1.417 . . . . 0.0 112.385 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -78.83 -15.75 57.98 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -88.35 -11.65 45.67 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.677 0.791 . . . . 0.0 112.105 -176.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.404 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.8 ptpt -126.58 -21.63 4.09 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -174.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.16 2.32 0.08 OUTLIER Glycine 0 N--CA 1.472 1.055 0 N-CA-C 115.992 1.157 . . . . 0.0 115.992 151.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -89.0 -22.24 23.1 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.3 1.05 . . . . 0.0 113.671 -167.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.01 28.96 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 130.398 3.479 . . . . 0.0 115.673 -175.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.416 ' CG2' ' HB ' ' A' ' 45' ' ' THR . 3.3 p -82.77 141.73 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 121.391 0.615 . . . . 0.0 109.348 -173.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.17 164.95 16.08 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.07 2.548 . . . . 0.0 112.719 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.2 -31.18 68.78 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 125.45 1.5 . . . . 0.0 114.354 -175.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -36.6 78.97 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.205 0.911 . . . . 0.0 110.693 -176.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.416 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 2.6 m -77.41 -47.5 19.64 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 126.492 1.917 . . . . 0.0 109.455 -176.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.25 -29.34 45.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.064 -175.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.06 -35.35 69.28 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.561 1.545 . . . . 0.0 112.287 178.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -67.5 -30.93 70.74 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.398 0.679 . . . . 0.0 111.841 172.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -77.08 -46.07 24.87 Favored 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 123.154 0.582 . . . . 0.0 112.423 -172.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.19 -29.5 14.2 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 175.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -74.0 -37.42 64.42 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.52 0.728 . . . . 0.0 112.515 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -87.28 -23.87 24.53 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -175.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.41 -62.82 1.27 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.265 1.026 . . . . 0.0 111.387 169.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 165.84 3.98 0.04 OUTLIER Glycine 0 CA--C 1.537 1.464 0 N-CA-C 118.029 1.972 . . . . 0.0 118.029 170.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 28.4 mt -84.2 131.33 51.16 Favored Pre-proline 0 CA--C 1.547 0.835 0 CA-C-N 119.371 1.585 . . . . 0.0 111.169 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.6 -63.96 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.737 2.958 . . . . 0.0 110.797 172.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 85.1 p -150.69 -11.9 0.24 Allowed 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.254 1.575 . . . . 0.0 115.254 168.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 73.6 m 61.06 -13.36 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 128.456 2.702 . . . . 0.0 116.184 -166.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -69.11 -40.29 78.42 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.823 1.649 . . . . 0.0 109.263 167.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.65 -20.42 46.73 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -76.25 -38.86 55.72 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.175 1.39 . . . . 0.0 112.174 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -68.83 -58.64 3.9 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.851 1.661 . . . . 0.0 112.133 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.256 1.397 0 C-N-CA 125.596 1.558 . . . . 0.0 114.349 -169.105 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 41.8 mt . . . . . 0 CA--C 1.546 0.81 0 CA-C-O 122.645 1.212 . . . . 0.0 114.018 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.8 p -72.8 -165.5 0.22 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.444 1.498 . . . . 0.0 112.797 -176.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -50.56 -23.66 2.69 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.76 51.78 0.09 OUTLIER Glycine 0 C--N 1.341 0.816 0 CA-C-O 118.438 -1.201 . . . . 0.0 114.783 168.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -64.3 -13.34 49.31 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.096 1.948 . . . . 0.0 114.282 -177.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.7 pp -105.48 -19.71 13.7 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.979 0.912 . . . . 0.0 113.263 166.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.5 ttt -72.39 -59.22 2.84 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.041 1.737 . . . . 0.0 111.006 -176.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.7 pttt -76.53 15.45 0.62 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.659 1.184 . . . . 0.0 113.255 -174.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -126.34 -39.89 2.01 Favored 'General case' 0 C--N 1.34 0.182 0 C-N-CA 129.326 3.05 . . . . 0.0 111.064 -171.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.4 pt -63.09 -34.04 64.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 119.084 0.856 . . . . 0.0 111.708 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.05 -17.48 40.2 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 176.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -97.48 -13.96 21.41 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 127.02 2.128 . . . . 0.0 111.913 -169.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.11 -49.22 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.782 1.233 . . . . 0.0 109.158 166.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.64 -39.41 85.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.736 1.153 . . . . 0.0 111.14 -172.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -83.07 5.26 22.97 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -113.98 -15.61 12.29 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.66 1.584 . . . . 0.0 113.508 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -89.33 -83.86 0.23 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.851 1.26 . . . . 0.0 111.552 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -136.01 95.68 3.26 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 122.702 1.239 . . . . 0.0 112.153 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -56.5 -14.21 2.92 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.783 1.633 . . . . 0.0 114.53 171.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -118.25 8.32 12.26 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.036 1.735 . . . . 0.0 114.962 171.795 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -140.58 79.13 20.46 Favored Pre-proline 0 N--CA 1.484 1.236 0 C-N-CA 125.667 1.587 . . . . 0.0 110.87 161.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -71.83 163.84 37.6 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 123.678 2.919 . . . . 0.0 113.209 -172.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -90.22 175.75 7.01 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.859 1.264 . . . . 0.0 111.157 168.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.7 p -129.45 169.78 14.52 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 126.256 1.822 . . . . 0.0 109.834 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.2 p30 -56.62 -34.42 67.23 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -67.64 -52.4 38.61 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 120.23 -1.544 . . . . 0.0 110.709 168.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -61.52 -50.83 71.12 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.783 -1.198 . . . . 0.0 112.462 -173.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.5 pt -59.46 -38.02 72.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 119.265 0.939 . . . . 0.0 112.036 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.56 -35.2 77.11 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.409 1.004 . . . . 0.0 111.79 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -69.56 -52.99 21.1 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.578 1.151 . . . . 0.0 112.796 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.406 HG23 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -64.41 -32.95 59.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 O-C-N 121.269 -0.894 . . . . 0.0 111.53 -177.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mp -63.58 -23.26 67.31 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.521 1.529 . . . . 0.0 112.207 176.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -80.03 -15.02 58.08 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -87.85 -11.76 46.87 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.68 0.792 . . . . 0.0 112.055 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.406 ' HE3' HG23 ' A' ' 33' ' ' ILE . 13.9 ptpt -127.34 -23.03 3.59 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -173.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.7 1.24 0.07 OUTLIER Glycine 0 N--CA 1.47 0.914 0 N-CA-C 115.948 1.139 . . . . 0.0 115.948 152.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -89.89 -27.36 19.94 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 118.43 1.115 . . . . 0.0 112.869 -167.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 29.19 40.87 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 130.426 3.491 . . . . 0.0 114.205 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -82.66 139.57 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.618 0.767 . . . . 0.0 108.995 -177.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.6 158.21 31.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 127.471 2.308 . . . . 0.0 111.971 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.63 -29.69 64.75 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.398 1.479 . . . . 0.0 113.596 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -65.24 -37.42 87.19 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.003 1.321 . . . . 0.0 111.25 -175.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.3 m -82.25 -52.3 7.08 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 128.261 2.624 . . . . 0.0 109.701 -177.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.84 -29.27 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.027 -171.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.87 -52.55 62.66 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.377 1.471 . . . . 0.0 110.241 175.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -72.5 -9.59 58.74 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.917 -174.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.85 -45.83 11.19 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.537 1.135 . . . . 0.0 112.732 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -55.37 -24.16 28.14 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.348 0.976 . . . . 0.0 112.847 176.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.2 tt0 -62.56 -50.2 72.28 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.785 1.234 . . . . 0.0 112.937 175.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.4 ptt? -84.51 -26.29 28.2 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -169.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 mt -70.58 -57.65 4.52 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.622 1.169 . . . . 0.0 112.129 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.38 5.8 0.02 OUTLIER Glycine 0 CA--C 1.535 1.338 0 N-CA-C 118.194 2.038 . . . . 0.0 118.194 173.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.9 mt -107.22 134.18 20.03 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 119.411 1.606 . . . . 0.0 111.857 -169.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.43 -66.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.485 2.79 . . . . 0.0 109.842 169.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.2 p -150.08 -3.51 0.37 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.749 2.02 . . . . 0.0 113.247 167.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 52.4 m 55.4 -4.08 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 128.987 2.915 . . . . 0.0 116.235 -165.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.9 ttt85 -79.2 -42.57 25.73 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.17 1.388 . . . . 0.0 109.309 176.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -73.99 -21.04 60.15 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.736 1.215 . . . . 0.0 113.62 174.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -73.87 -41.29 62.42 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.604 1.162 . . . . 0.0 111.981 168.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -72.4 -59.72 2.59 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.85 1.66 . . . . 0.0 113.176 -178.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.254 1.335 0 C-N-CA 126.023 1.729 . . . . 0.0 114.386 -167.899 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 42.1 mt . . . . . 0 C--O 1.237 0.444 0 CA-C-O 121.695 0.76 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.1 p -71.96 -168.55 0.39 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.882 1.273 . . . . 0.0 112.2 175.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -49.65 -25.4 2.83 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.238 1.415 . . . . 0.0 114.387 172.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.68 43.3 0.15 Allowed Glycine 0 C--N 1.341 0.835 0 CA-C-O 117.857 -1.524 . . . . 0.0 115.563 174.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -63.86 -11.13 24.82 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.625 2.213 . . . . 0.0 113.973 -179.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.7 pp -110.61 -17.81 13.32 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.732 1.213 . . . . 0.0 113.136 167.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.41 ' C ' ' H ' ' A' ' 11' ' ' LEU . 2.2 ttp -71.4 -63.15 1.17 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.573 1.549 . . . . 0.0 110.595 -178.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.0 pttt -73.07 18.07 0.11 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.054 1.342 . . . . 0.0 113.791 -174.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.41 ' H ' ' C ' ' A' ' 9' ' ' MET . 3.4 mm? -127.52 -43.72 1.57 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 129.621 3.168 . . . . 0.0 110.909 -171.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.5 pt -60.74 -36.42 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 119.082 0.855 . . . . 0.0 111.564 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.29 -18.77 41.16 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -96.48 -20.86 18.09 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.812 2.045 . . . . 0.0 111.908 -167.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -96.7 -50.15 11.64 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.166 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 169.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.3 t -65.02 -35.88 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 O-C-N 120.597 -1.315 . . . . 0.0 111.19 -171.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -80.22 -2.66 45.88 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.0 t30 -109.38 -19.57 13.22 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.721 1.609 . . . . 0.0 113.072 -175.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -91.4 -89.62 0.17 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.766 0.826 . . . . 0.0 111.734 -169.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -141.02 82.71 1.85 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.698 1.199 . . . . 0.0 110.051 -177.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.9 mtmm -60.62 -21.66 62.94 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.18 0.992 . . . . 0.0 113.261 173.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -69.79 -25.55 63.84 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 128.033 2.533 . . . . 0.0 115.04 167.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -143.1 70.81 18.42 Favored Pre-proline 0 N--CA 1.479 1.015 0 C-N-CA 127.645 2.378 . . . . 0.0 109.742 -176.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.48 166.49 29.67 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.585 2.857 . . . . 0.0 113.502 -165.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -78.68 -170.94 2.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.073 1.349 . . . . 0.0 111.011 164.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.1 m -149.88 175.94 11.19 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.389 1.476 . . . . 0.0 110.048 169.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 27.1 p30 -57.41 -31.05 65.46 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -66.86 -53.02 36.66 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.331 -1.481 . . . . 0.0 110.666 167.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -66.77 -43.07 84.99 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 120.621 -1.299 . . . . 0.0 113.275 -172.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.7 pt -60.04 -40.0 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-N 120.164 1.347 . . . . 0.0 111.912 171.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.18 -34.89 77.3 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 120.06 1.3 . . . . 0.0 112.28 173.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -67.63 -53.61 26.53 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.796 1.639 . . . . 0.0 112.459 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.8 mt -66.66 -32.8 59.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 121.373 -0.83 . . . . 0.0 111.406 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.92 -24.06 66.73 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.161 0.985 . . . . 0.0 112.131 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 pttm -80.01 -15.18 57.76 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -87.65 -12.96 43.97 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.899 0.88 . . . . 0.0 112.294 -178.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -126.33 -20.51 4.42 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -173.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.13 -0.13 0.08 OUTLIER Glycine 0 N--CA 1.47 0.923 0 N-CA-C 115.812 1.085 . . . . 0.0 115.812 151.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -89.24 -31.47 17.87 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 118.634 1.217 . . . . 0.0 112.728 -167.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 28.55 43.69 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 130.338 3.455 . . . . 0.0 114.018 -171.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -81.25 142.31 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -82.92 163.55 21.02 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 128.365 2.666 . . . . 0.0 111.98 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -56.68 -36.17 69.29 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.909 1.283 . . . . 0.0 113.807 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -66.58 -32.41 73.73 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.356 1.062 . . . . 0.0 111.175 -169.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.5 m -80.93 -52.02 7.91 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.643 2.777 . . . . 0.0 109.842 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.35 -30.81 50.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.268 1.027 . . . . 0.0 110.949 -173.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.49 -37.18 74.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.107 2.163 . . . . 0.0 112.255 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.6 mtmm -79.56 -14.95 58.49 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -82.77 -40.27 20.69 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.3 ptt-85 -52.86 -26.28 14.19 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 175.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.9 -39.99 75.88 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.413 1.085 . . . . 0.0 112.957 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 23.9 ptp -80.25 -23.48 40.79 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.2 mt -81.54 -61.42 1.94 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.113 1.365 . . . . 0.0 111.981 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.31 5.25 0.05 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 118.035 1.974 . . . . 0.0 118.035 168.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.0 mt -95.05 128.7 38.0 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 119.492 1.646 . . . . 0.0 111.452 -172.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -73.12 -49.36 0.23 Allowed 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.526 3.484 . . . . 0.0 113.445 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.3 p -139.84 -68.41 0.42 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.739 1.616 . . . . 0.0 109.88 169.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 62.8 m 121.2 -20.3 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.005 1 C-N-CA 134.351 5.06 . . . . 0.0 110.747 -164.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -74.78 -41.12 60.63 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.083 2.153 . . . . 0.0 109.697 174.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.17 -21.31 43.2 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.708 0.803 . . . . 0.0 112.948 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -69.76 -32.78 71.48 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.909 1.284 . . . . 0.0 112.055 173.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -82.46 -59.92 2.37 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.085 1.754 . . . . 0.0 113.16 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 C--O 1.253 1.25 0 C-N-CA 125.932 1.693 . . . . 0.0 114.64 -163.596 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 35.4 mt . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.1 p -71.83 -168.78 0.39 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 125.374 1.47 . . . . 0.0 112.671 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -49.04 -24.79 1.69 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.284 1.434 . . . . 0.0 114.469 173.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.92 46.25 0.12 Allowed Glycine 0 C--N 1.341 0.835 0 CA-C-O 118.228 -1.318 . . . . 0.0 115.552 170.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.21 -17.13 39.28 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.822 2.311 . . . . 0.0 113.175 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pp -109.33 -18.7 13.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.632 1.173 . . . . 0.0 112.582 170.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.7 ttm -71.18 -63.11 1.17 Allowed 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.586 1.555 . . . . 0.0 110.274 -175.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.3 pttm -76.61 18.99 0.29 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.564 1.145 . . . . 0.0 113.547 -172.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -128.3 -39.02 1.73 Allowed 'General case' 0 C--O 1.233 0.229 0 C-N-CA 129.706 3.202 . . . . 0.0 110.726 -171.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -65.03 -35.45 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.027 0.831 . . . . 0.0 111.696 -176.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.82 -11.93 54.66 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -92.92 -17.95 23.37 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 127.297 2.239 . . . . 0.0 111.825 -170.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.15 -46.28 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 125.056 1.342 . . . . 0.0 109.671 168.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.4 t -65.99 -36.19 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-N 119.58 1.082 . . . . 0.0 111.309 -173.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -78.97 -1.19 34.19 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -107.11 -15.82 14.58 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.701 1.6 . . . . 0.0 112.998 -177.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -98.45 -93.06 0.25 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.781 0.832 . . . . 0.0 112.386 -170.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -136.38 92.09 2.74 Favored 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 124.63 1.172 . . . . 0.0 110.372 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.0 mttt -58.56 -20.38 46.18 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.737 0.815 . . . . 0.0 112.938 166.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.58 -20.46 60.61 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 127.745 2.418 . . . . 0.0 113.919 170.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -146.85 72.7 12.45 Favored Pre-proline 0 N--CA 1.477 0.877 0 C-N-CA 127.457 2.303 . . . . 0.0 109.754 -176.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.62 155.44 68.91 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.835 2.357 . . . . 0.0 112.4 -168.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -75.54 169.1 18.76 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.676 0.75 . . . . 0.0 110.19 164.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.1 p -124.63 168.55 12.99 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.359 1.464 . . . . 0.0 109.746 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.8 p30 -53.92 -32.13 52.54 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 175.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -67.98 -55.04 14.15 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 119.616 -1.927 . . . . 0.0 110.726 167.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -61.08 -50.05 74.85 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 120.81 -1.181 . . . . 0.0 112.784 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.1 pt -59.54 -37.76 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 119.856 1.207 . . . . 0.0 112.278 173.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.54 -35.14 78.5 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.508 1.049 . . . . 0.0 111.74 177.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -68.39 -52.53 31.98 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.413 1.085 . . . . 0.0 112.7 -178.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.428 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -64.3 -32.69 58.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 121.347 -0.846 . . . . 0.0 111.621 -177.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -65.01 -21.67 66.88 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.631 1.572 . . . . 0.0 112.67 176.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -80.09 -15.55 56.9 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -86.39 -13.96 44.82 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 123.132 0.573 . . . . 0.0 111.926 -176.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.428 ' HE3' HG22 ' A' ' 33' ' ' ILE . 15.3 ptpt -130.15 -26.36 2.37 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 116.93 2.196 . . . . 0.0 116.93 -167.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 165.26 10.35 0.03 OUTLIER Glycine 0 N--CA 1.471 1.007 0 N-CA-C 117.126 1.61 . . . . 0.0 117.126 163.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -112.12 -36.11 5.44 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 118.895 1.347 . . . . 0.0 112.385 -167.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.27 1.4 ttpt 40.3 43.84 1.51 Allowed 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 128.33 2.652 . . . . 0.0 113.095 175.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.5 p -91.44 144.44 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.842 2.057 . . . . 0.0 109.129 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.54 170.73 10.25 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.612 2.765 . . . . 0.0 112.853 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -59.73 -33.84 72.15 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 125.694 1.598 . . . . 0.0 114.052 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -38.34 85.87 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.73 1.212 . . . . 0.0 111.278 -172.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.6 m -86.68 -47.96 8.7 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 127.137 2.175 . . . . 0.0 109.036 -172.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.15 -31.65 54.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.667 -174.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.57 -46.94 74.36 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 125.597 1.559 . . . . 0.0 111.118 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -68.06 -20.01 64.93 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.414 1.086 . . . . 0.0 112.595 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -82.78 -48.3 10.96 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.072 0.949 . . . . 0.0 112.072 178.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -54.53 -29.8 51.78 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 119.906 1.23 . . . . 0.0 112.08 171.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -71.91 -38.04 69.97 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.384 1.074 . . . . 0.0 113.364 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 15.0 ptm -84.97 -28.37 25.84 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.8 mp -69.76 -64.05 0.96 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.106 0.962 . . . . 0.0 111.478 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.47 2.59 0.03 OUTLIER Glycine 0 CA--C 1.538 1.509 0 N-CA-C 118.516 2.166 . . . . 0.0 118.516 175.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.6 mt -90.23 132.16 36.6 Favored Pre-proline 0 CA--C 1.547 0.85 0 CA-C-N 119.59 1.695 . . . . 0.0 110.912 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.73 -62.05 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.503 2.802 . . . . 0.0 110.594 173.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.4 p -151.9 -7.71 0.22 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 164.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 72.0 m 58.45 -16.45 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 127.872 2.469 . . . . 0.0 116.272 -166.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 -66.37 -43.01 87.15 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.14 1.376 . . . . 0.0 108.402 167.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -22.69 52.91 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.192 0.997 . . . . 0.0 113.587 -178.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.9 mtp180 -74.31 -42.99 58.57 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.208 1.403 . . . . 0.0 111.796 170.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -72.33 -59.24 2.83 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.497 1.519 . . . . 0.0 112.694 -176.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.784 1.634 . . . . 0.0 114.469 -169.266 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 18.4 mt . . . . . 0 N--CA 1.467 0.403 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.0 p -74.56 -170.4 1.02 Allowed 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.191 175.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.03 -26.81 1.95 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.349 1.46 . . . . 0.0 114.663 172.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -170.55 38.09 0.18 Allowed Glycine 0 C--N 1.34 0.77 0 CA-C-O 117.608 -1.662 . . . . 0.0 115.688 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.1 -13.77 19.53 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.902 2.351 . . . . 0.0 113.26 176.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 pp -107.75 -18.56 13.79 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.176 0.99 . . . . 0.0 112.976 168.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.3 ttt -70.09 -62.62 1.31 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.633 1.573 . . . . 0.0 110.301 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.3 pttt -76.78 17.06 0.44 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.04 1.336 . . . . 0.0 113.215 -172.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -129.45 -35.55 1.74 Allowed 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 129.236 3.014 . . . . 0.0 111.482 -171.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pt -61.59 -34.92 63.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 119.291 0.95 . . . . 0.0 111.312 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.0 -12.39 36.02 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -93.2 -17.89 23.18 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 127.125 2.17 . . . . 0.0 111.819 -174.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.51 -48.51 11.19 Favored 'Isoleucine or valine' 0 C--N 1.341 0.229 0 C-N-CA 124.863 1.265 . . . . 0.0 109.427 169.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 72.8 t -63.03 -39.26 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 119.671 1.123 . . . . 0.0 111.013 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -82.1 5.09 20.65 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -111.58 -15.48 13.48 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.312 1.845 . . . . 0.0 113.583 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -94.95 -86.25 0.29 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.341 1.056 . . . . 0.0 111.874 -174.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -139.7 87.95 2.21 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.85 1.26 . . . . 0.0 110.107 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -54.35 -27.63 37.42 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.441 1.096 . . . . 0.0 112.8 169.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -81.18 -12.93 59.07 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.035 2.134 . . . . 0.0 114.175 177.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -146.51 73.65 12.76 Favored Pre-proline 0 N--CA 1.481 1.11 0 C-N-CA 127.43 2.292 . . . . 0.0 110.514 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -73.11 167.95 26.01 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.07 2.513 . . . . 0.0 113.408 -169.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -88.29 -175.29 4.97 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.464 1.505 . . . . 0.0 111.619 171.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.6 p -139.98 171.64 13.9 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.798 2.039 . . . . 0.0 110.166 176.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.0 p-10 -48.04 -48.4 33.06 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -62.48 -48.74 78.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.293 -1.504 . . . . 0.0 110.449 174.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -63.22 -49.8 72.75 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 120.849 -1.157 . . . . 0.0 112.545 -174.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.6 pt -59.36 -38.16 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.322 0.964 . . . . 0.0 112.437 173.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.83 -35.85 77.58 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.387 0.994 . . . . 0.0 111.658 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -68.77 -52.83 26.17 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.502 1.121 . . . . 0.0 112.853 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.406 HG23 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -64.36 -32.65 58.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.337 -0.852 . . . . 0.0 111.793 -177.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mp -62.64 -23.81 67.28 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.504 1.522 . . . . 0.0 112.451 174.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -79.19 -15.67 57.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 176.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -86.95 -12.94 46.09 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.465 0.706 . . . . 0.0 112.08 -176.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.406 ' HE3' HG23 ' A' ' 33' ' ' ILE . 14.2 ptpt -127.56 -21.28 3.82 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -172.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.2 1.91 0.07 OUTLIER Glycine 0 N--CA 1.471 0.991 0 N-CA-C 116.05 1.18 . . . . 0.0 116.05 151.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -91.29 -21.36 21.1 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.355 1.077 . . . . 0.0 113.803 -165.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.05 28.12 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 130.531 3.532 . . . . 0.0 115.62 -175.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.422 ' CG2' ' HB ' ' A' ' 45' ' ' THR . 3.6 p -84.06 141.29 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 121.49 0.662 . . . . 0.0 109.254 -170.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.0 166.23 15.23 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 128.412 2.685 . . . . 0.0 112.562 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 44.2 ttp85 -58.77 -32.19 69.06 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 125.767 1.627 . . . . 0.0 114.263 -173.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -65.05 -39.68 93.64 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.142 0.972 . . . . 0.0 111.5 -174.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.422 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 1.9 m -77.85 -49.6 13.93 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 127.345 2.258 . . . . 0.0 108.943 -175.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -31.1 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.825 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.412 -173.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.6 -37.88 67.99 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.874 1.67 . . . . 0.0 111.961 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -68.95 -22.71 64.11 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 175.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -84.62 -47.99 9.96 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.316 1.047 . . . . 0.0 112.423 -176.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.6 ptm85 -54.78 -28.37 48.35 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.337 0.971 . . . . 0.0 112.28 171.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -72.91 -34.24 66.5 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.925 0.89 . . . . 0.0 112.914 176.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.8 ptt? -92.17 -29.39 16.5 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 mp -67.17 -63.93 0.96 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.82 0.848 . . . . 0.0 111.264 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.88 3.22 0.03 OUTLIER Glycine 0 CA--C 1.538 1.471 0 N-CA-C 118.414 2.126 . . . . 0.0 118.414 173.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 47.6 mt -79.54 128.26 75.56 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-N 119.826 1.813 . . . . 0.0 111.038 -176.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -50.29 -68.87 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 125.213 3.942 . . . . 0.0 112.34 165.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.3 m 165.66 106.64 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.174 1 C-N-CA 134.638 5.175 . . . . 0.0 105.395 167.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.6 m -42.33 -5.53 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 131.128 3.771 . . . . 0.0 119.122 -169.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -70.38 -15.76 62.89 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.972 1.309 . . . . 0.0 112.116 167.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -118.53 -11.93 9.86 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -69.07 -50.41 48.63 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.713 0.688 . . . . 0.0 112.516 169.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -74.11 -56.16 5.25 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.011 1.724 . . . . 0.0 113.267 -171.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.256 1.404 0 C-N-CA 126.291 1.836 . . . . 0.0 114.339 -167.848 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 21.2 mt . . . . . 0 CA--C 1.538 0.502 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.6 p -74.03 -168.96 0.68 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.416 1.486 . . . . 0.0 112.55 177.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -48.64 -25.05 1.57 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.82 1.648 . . . . 0.0 114.667 172.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.73 45.65 0.12 Allowed Glycine 0 C--N 1.341 0.817 0 CA-C-O 118.073 -1.404 . . . . 0.0 115.305 172.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.41 -15.19 34.48 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 120.38 2.09 . . . . 0.0 113.421 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 pp -108.51 -19.18 13.53 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.777 1.231 . . . . 0.0 113.007 169.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.2 ttt -73.9 -58.38 3.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.077 1.751 . . . . 0.0 111.442 -174.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.6 pttt -76.99 17.1 0.46 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.405 1.082 . . . . 0.0 112.971 -173.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -125.65 -43.93 1.85 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 129.908 3.283 . . . . 0.0 110.359 -170.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.9 pt -61.51 -36.45 73.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 118.344 0.52 . . . . 0.0 111.91 -177.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.07 -17.79 41.95 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 177.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -96.96 -15.45 21.12 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 127.117 2.167 . . . . 0.0 112.003 -168.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -102.04 -47.97 11.1 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 C-N-CA 124.63 1.172 . . . . 0.0 109.013 166.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.1 t -65.64 -35.77 76.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 119.903 1.229 . . . . 0.0 111.635 -172.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -82.03 4.7 21.89 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -118.95 -9.96 9.96 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.309 1.844 . . . . 0.0 114.042 -177.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -101.52 -82.62 0.47 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.97 0.908 . . . . 0.0 112.139 -174.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -139.22 84.11 1.98 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.526 1.13 . . . . 0.0 111.089 -173.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -58.31 -25.07 61.45 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.161 0.984 . . . . 0.0 113.181 171.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -16.66 56.03 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 127.152 2.181 . . . . 0.0 114.956 172.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -147.53 76.07 11.02 Favored Pre-proline 0 N--CA 1.479 1.025 0 C-N-CA 126.769 2.028 . . . . 0.0 110.126 -178.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -69.18 162.28 42.42 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.041 2.494 . . . . 0.0 112.86 -171.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -79.68 -173.13 3.65 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.731 1.212 . . . . 0.0 110.756 167.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.3 p -138.03 168.19 20.22 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.995 1.318 . . . . 0.0 111.154 171.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.2 p30 -52.1 -30.99 28.64 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 175.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -68.11 0.32 Allowed 'General case' 0 C--N 1.333 -0.124 0 O-C-N 120.322 -1.486 . . . . 0.0 110.08 165.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -57.5 -49.33 76.65 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.222 1.009 . . . . 0.0 112.86 -170.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.4 pt -59.32 -37.29 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 119.193 0.906 . . . . 0.0 112.166 174.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.15 -34.62 78.47 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.862 1.21 . . . . 0.0 111.878 175.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -68.02 -53.47 25.61 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.235 1.014 . . . . 0.0 112.604 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.401 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -63.73 -32.68 57.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 121.572 -0.705 . . . . 0.0 111.617 -176.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.98 -23.1 67.21 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.394 1.477 . . . . 0.0 112.295 175.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -80.25 -15.77 56.23 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -86.24 -13.08 47.89 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.604 0.762 . . . . 0.0 112.163 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.401 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.0 ptpt -127.17 -21.99 3.83 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -172.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.54 2.6 0.07 OUTLIER Glycine 0 N--CA 1.47 0.916 0 N-CA-C 115.97 1.148 . . . . 0.0 115.97 151.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -89.38 -21.93 22.83 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 118.265 1.032 . . . . 0.0 113.443 -167.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.49 30.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 130.368 3.467 . . . . 0.0 115.298 -176.244 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.1 p -83.0 138.43 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 121.576 0.703 . . . . 0.0 109.238 -172.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.05 159.92 28.43 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 127.72 2.408 . . . . 0.0 112.21 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.83 -29.73 63.09 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.261 1.424 . . . . 0.0 113.543 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -32.27 72.71 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.61 1.164 . . . . 0.0 111.722 -175.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.1 m -87.14 -48.64 7.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.104 2.562 . . . . 0.0 110.059 -177.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.24 -30.11 49.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.096 -174.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.21 -37.96 86.81 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.223 1.409 . . . . 0.0 111.042 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -75.34 -17.94 60.12 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.456 1.102 . . . . 0.0 112.311 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.74 -50.13 7.41 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.46 1.104 . . . . 0.0 112.635 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.81 -23.58 18.85 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 175.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -68.78 -43.74 75.12 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.0 1.32 . . . . 0.0 112.585 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -87.63 -28.14 22.06 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -173.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.26 -59.21 3.16 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.319 1.048 . . . . 0.0 111.695 177.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.92 4.52 0.03 OUTLIER Glycine 0 CA--C 1.534 1.257 0 N-CA-C 118.312 2.085 . . . . 0.0 118.312 170.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 35.3 mt -91.81 121.47 67.01 Favored Pre-proline 0 CA--C 1.545 0.754 0 CA-C-N 120.014 1.907 . . . . 0.0 111.047 -173.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.94 -58.07 0.16 Allowed 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.382 2.721 . . . . 0.0 110.204 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.7 p -150.81 -8.87 0.25 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 160.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 77.4 p 60.61 -15.86 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 128.878 2.871 . . . . 0.0 116.151 -166.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 63.3 ttt180 -71.61 -43.74 65.68 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.345 1.458 . . . . 0.0 109.351 167.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -22.34 61.02 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -178.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -74.69 -39.5 61.94 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.776 1.63 . . . . 0.0 112.149 169.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -74.11 -59.09 2.88 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.568 1.547 . . . . 0.0 112.931 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.725 2.01 . . . . 0.0 114.483 -167.505 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 25.6 mt . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.8 p -73.88 -170.56 0.92 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.337 1.455 . . . . 0.0 112.245 176.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -49.23 -25.44 2.29 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.589 1.555 . . . . 0.0 114.599 172.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -171.68 40.66 0.17 Allowed Glycine 0 C--N 1.343 0.918 0 CA-C-O 117.682 -1.621 . . . . 0.0 115.682 175.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.61 -13.96 26.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 120.815 2.307 . . . . 0.0 113.467 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 pp -108.72 -18.86 13.61 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.385 1.074 . . . . 0.0 113.151 168.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.404 ' C ' ' H ' ' A' ' 11' ' ' LEU . 1.4 ttp -71.64 -61.55 1.74 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.592 1.557 . . . . 0.0 111.104 -177.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.6 pttt -75.17 17.01 0.27 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.305 1.042 . . . . 0.0 113.193 -171.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.404 ' H ' ' C ' ' A' ' 9' ' ' MET . 3.3 mm? -125.4 -45.82 1.79 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 129.82 3.248 . . . . 0.0 110.392 -169.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.0 pt -59.64 -36.85 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt -82.76 -14.6 54.18 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 174.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -90.87 -17.76 25.96 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 125.55 1.54 . . . . 0.0 112.094 -174.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.39 -45.19 11.18 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 C-N-CA 124.167 0.987 . . . . 0.0 109.32 170.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.77 -31.18 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 O-C-N 120.891 -1.131 . . . . 0.0 111.225 -174.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -79.08 -2.39 40.32 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.253 -0.905 . . . . 0.0 112.816 174.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -108.73 -14.46 14.6 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.903 1.681 . . . . 0.0 112.851 -176.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -103.4 -102.59 0.29 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.201 0.909 . . . . 0.0 112.095 -168.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -139.96 80.82 1.79 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.495 1.118 . . . . 0.0 109.896 -172.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -62.62 -17.31 60.05 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 174.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -66.09 -22.29 66.4 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 127.212 2.205 . . . . 0.0 114.623 164.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -142.6 66.22 18.06 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 128.29 2.636 . . . . 0.0 109.637 177.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -70.23 162.0 43.93 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.318 2.679 . . . . 0.0 113.424 -163.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -77.53 170.01 17.3 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.845 0.831 . . . . 0.0 111.106 166.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.8 p -124.69 170.31 11.11 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 126.003 1.721 . . . . 0.0 109.846 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.4 p30 -53.98 -32.65 54.68 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -68.54 -54.67 15.25 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 119.776 -1.827 . . . . 0.0 110.789 168.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -62.55 -47.85 82.06 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 120.704 -1.247 . . . . 0.0 112.714 -173.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.3 pt -58.94 -38.92 76.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-N 119.871 1.214 . . . . 0.0 112.317 172.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.8 -35.41 78.11 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.543 1.065 . . . . 0.0 111.892 176.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -68.87 -52.62 27.69 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.518 1.127 . . . . 0.0 112.74 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.409 HG23 ' HE3' ' A' ' 37' ' ' LYS . 2.7 mt -64.03 -33.18 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 118.841 0.746 . . . . 0.0 111.269 -177.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.13 -24.93 68.12 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.369 1.468 . . . . 0.0 112.486 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -14.82 58.26 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 176.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -86.5 -13.19 46.73 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.436 0.694 . . . . 0.0 112.017 -178.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.409 ' HE3' HG23 ' A' ' 33' ' ' ILE . 14.1 ptpt -126.49 -22.55 3.95 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -172.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.04 2.54 0.08 OUTLIER Glycine 0 N--CA 1.47 0.933 0 CA-C-N 119.562 1.074 . . . . 0.0 115.668 151.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -87.16 -23.12 24.92 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 118.331 1.065 . . . . 0.0 113.303 -168.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.8 30.88 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 130.351 3.461 . . . . 0.0 115.109 -175.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.0 p -82.07 138.55 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.56 0.695 . . . . 0.0 109.226 -174.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.9 161.59 24.31 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 127.894 2.478 . . . . 0.0 112.033 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.63 -27.57 67.89 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 125.386 1.474 . . . . 0.0 113.853 -178.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.28 -32.51 72.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.118 0.967 . . . . 0.0 111.956 -177.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 m -84.09 -51.35 7.15 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 128.298 2.639 . . . . 0.0 109.914 -177.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.57 -29.06 45.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.848 -172.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.6 94.65 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.303 1.441 . . . . 0.0 110.91 176.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -71.43 -16.63 62.39 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.509 0.723 . . . . 0.0 112.487 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -85.97 -51.61 6.25 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.222 1.009 . . . . 0.0 112.267 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -54.36 -25.42 24.19 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.035 0.834 . . . . 0.0 112.679 175.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -68.77 -40.32 79.77 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.331 1.452 . . . . 0.0 113.025 178.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -92.88 -25.44 18.08 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -173.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.2 -60.56 2.17 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.625 1.17 . . . . 0.0 112.013 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 177.17 -0.6 0.03 OUTLIER Glycine 0 CA--C 1.534 1.254 0 N-CA-C 118.141 2.016 . . . . 0.0 118.141 172.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.8 mt -86.85 129.13 53.54 Favored Pre-proline 0 CA--C 1.546 0.794 0 CA-C-N 119.518 1.659 . . . . 0.0 110.628 -177.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.41 -60.02 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.827 2.351 . . . . 0.0 110.387 174.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.5 p -153.27 -7.47 0.17 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 163.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 28.9 m 59.26 -21.55 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.977 2.511 . . . . 0.0 116.199 -164.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.7 ttt85 -67.56 -43.15 81.34 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.923 1.238 . . . . 0.0 108.585 170.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -25.6 60.41 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.3 mtm180 -71.3 -43.47 67.05 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.197 1.399 . . . . 0.0 112.244 169.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -74.19 -61.04 1.99 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.682 1.593 . . . . 0.0 113.31 -176.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.1 tp . . . . . 0 C--O 1.255 1.355 0 C-N-CA 126.515 1.926 . . . . 0.0 114.593 -166.108 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 42.9 p -72.19 -163.09 0.1 Allowed 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 125.68 1.592 . . . . 0.0 112.635 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -48.16 -25.35 1.44 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.065 1.346 . . . . 0.0 114.335 169.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 176.14 53.96 0.06 OUTLIER Glycine 0 CA--C 1.527 0.808 0 CA-C-O 118.728 -1.04 . . . . 0.0 114.276 168.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -64.87 -13.54 56.66 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.688 1.744 . . . . 0.0 114.202 -175.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pp -106.0 -19.7 13.65 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.218 1.007 . . . . 0.0 113.113 168.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.0 ttp -72.25 -60.21 2.35 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.092 1.757 . . . . 0.0 110.68 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.3 pttp -75.28 15.78 0.41 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.601 1.16 . . . . 0.0 113.459 -173.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -127.03 -41.59 1.78 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 129.404 3.082 . . . . 0.0 111.391 -170.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.0 pt -60.95 -33.83 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 119.069 0.85 . . . . 0.0 112.125 178.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -17.58 44.65 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 175.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -96.71 -13.03 23.01 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 126.439 1.896 . . . . 0.0 111.929 -170.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.28 -48.7 9.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.183 0 C-N-CA 124.482 1.113 . . . . 0.0 108.776 167.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.2 -32.49 57.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 120.282 1.401 . . . . 0.0 111.434 -172.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -78.29 -2.76 39.52 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.381 -0.824 . . . . 0.0 112.893 175.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -117.22 -9.19 11.03 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.432 1.893 . . . . 0.0 113.816 -172.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -102.66 -97.78 0.29 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.003 0.82 . . . . 0.0 112.263 -170.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -137.33 83.21 1.98 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.588 1.155 . . . . 0.0 110.219 -177.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -62.46 -17.96 60.67 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 175.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.409 ' H ' ' HD3' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -79.96 -12.48 59.72 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.814 2.046 . . . . 0.0 114.799 168.491 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -145.06 67.06 13.17 Favored Pre-proline 0 N--CA 1.48 1.075 0 C-N-CA 127.368 2.267 . . . . 0.0 109.624 175.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.15 165.44 32.7 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.956 2.437 . . . . 0.0 112.99 -164.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -77.34 -175.49 3.74 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.684 1.194 . . . . 0.0 111.416 167.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 93.2 p -136.64 170.87 15.35 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.651 1.98 . . . . 0.0 109.634 171.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.5 p30 -54.03 -32.14 53.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 172.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -67.76 -54.11 21.88 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.011 -1.681 . . . . 0.0 110.691 169.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -62.45 -47.93 81.86 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 120.812 -1.18 . . . . 0.0 112.663 -174.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.4 pt -58.97 -39.13 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.625 1.102 . . . . 0.0 112.096 173.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.78 -35.37 79.62 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.578 1.081 . . . . 0.0 111.943 176.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -69.18 -52.34 28.89 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.439 1.096 . . . . 0.0 112.819 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.419 HG21 ' HE3' ' A' ' 37' ' ' LYS . 2.3 mt -64.22 -33.65 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 O-C-N 121.437 -0.789 . . . . 0.0 111.19 -178.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -62.11 -25.65 67.84 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.238 1.415 . . . . 0.0 112.644 176.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -79.01 -15.78 57.79 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -87.21 -12.73 45.96 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 123.446 0.698 . . . . 0.0 112.144 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 33' ' ' ILE . 14.0 ptpt -126.79 -21.48 4.05 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -173.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.79 2.21 0.07 OUTLIER Glycine 0 N--CA 1.472 1.083 0 N-CA-C 115.932 1.133 . . . . 0.0 115.932 153.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -90.42 -19.75 23.57 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 118.334 1.067 . . . . 0.0 113.43 -167.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 35.82 25.17 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 130.699 3.6 . . . . 0.0 116.095 -175.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -81.75 137.93 20.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -169.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.39 158.73 31.13 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.148 2.179 . . . . 0.0 112.093 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -55.64 -30.81 61.63 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.841 1.257 . . . . 0.0 113.243 175.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -66.37 -34.36 77.8 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.117 1.367 . . . . 0.0 111.615 -174.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.8 m -83.66 -51.91 6.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 129.036 2.934 . . . . 0.0 109.882 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.93 -30.93 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.932 -173.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.84 -34.7 77.22 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.862 1.665 . . . . 0.0 111.788 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -84.18 -9.55 58.46 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.416 1.086 . . . . 0.0 112.989 176.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -90.03 -51.37 5.5 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.82 1.248 . . . . 0.0 112.297 176.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -20.31 5.96 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 174.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -65.26 -42.59 93.11 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.761 1.625 . . . . 0.0 113.143 173.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -94.61 -26.33 16.41 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.1 mt -73.73 -59.69 2.6 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.404 1.082 . . . . 0.0 112.166 -179.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.89 -8.47 0.03 OUTLIER Glycine 0 CA--C 1.533 1.213 0 N-CA-C 118.142 2.017 . . . . 0.0 118.142 167.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.4 mt -69.6 121.63 83.04 Favored Pre-proline 0 CA--C 1.542 0.642 0 CA-C-N 119.439 1.62 . . . . 0.0 110.743 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.88 -64.36 0.05 OUTLIER 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.116 2.544 . . . . 0.0 109.308 178.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.1 p -150.94 -10.17 0.24 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.122 1.369 . . . . 0.0 114.422 158.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.3 m 56.85 -17.82 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 128.389 2.676 . . . . 0.0 116.455 -163.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -67.21 -42.34 84.29 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 120.308 1.413 . . . . 0.0 108.743 166.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.81 -22.11 60.87 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -71.27 -46.49 60.8 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.643 1.577 . . . . 0.0 111.667 166.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -75.37 -59.44 2.75 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.515 1.926 . . . . 0.0 113.405 -170.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 C--O 1.253 1.285 0 C-N-CA 127.384 2.274 . . . . 0.0 114.525 -167.596 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.6 mt . . . . . 0 C--O 1.236 0.361 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 60.2 p -73.44 -172.59 1.21 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.035 1.334 . . . . 0.0 111.582 171.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -51.86 -23.58 5.03 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.206 1.402 . . . . 0.0 114.73 172.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.64 29.44 0.24 Allowed Glycine 0 C--N 1.34 0.781 0 CA-C-O 117.339 -1.812 . . . . 0.0 116.939 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -62.01 -10.81 10.86 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 121.784 2.792 . . . . 0.0 113.82 178.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 pp -111.18 -16.89 13.33 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.624 1.17 . . . . 0.0 113.508 166.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 6.3 ttt -68.3 -67.06 0.49 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.224 1.41 . . . . 0.0 110.339 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.9 pttp -73.79 15.88 0.25 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.406 1.482 . . . . 0.0 113.673 -172.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -127.4 -35.15 2.2 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 128.798 2.839 . . . . 0.0 111.822 -172.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -61.3 -29.96 46.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.471 1.032 . . . . 0.0 112.023 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.52 -9.53 23.2 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -178.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -88.74 -16.61 31.78 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 125.64 1.576 . . . . 0.0 111.56 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 pp -101.45 -51.81 9.06 Favored 'Isoleucine or valine' 0 C--N 1.342 0.265 0 C-N-CA 123.974 0.91 . . . . 0.0 108.786 168.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.7 t -63.88 -35.48 73.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 120.378 1.444 . . . . 0.0 111.325 -172.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -80.77 -0.74 39.96 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -109.9 -19.78 12.99 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.752 1.621 . . . . 0.0 112.991 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -93.82 -95.47 0.16 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.741 0.816 . . . . 0.0 112.202 -167.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -139.98 85.53 2.03 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.194 0.998 . . . . 0.0 110.971 -175.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -58.05 -22.34 49.62 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.571 1.149 . . . . 0.0 113.354 168.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 -68.79 -23.83 64.33 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.079 2.152 . . . . 0.0 114.598 169.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -147.29 70.7 11.87 Favored Pre-proline 0 N--CA 1.481 1.115 0 C-N-CA 127.67 2.388 . . . . 0.0 109.771 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -76.82 173.58 14.24 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.167 2.578 . . . . 0.0 113.772 -165.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -89.8 -175.03 4.5 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.832 1.653 . . . . 0.0 112.158 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.7 p -140.08 175.99 9.13 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 126.749 2.02 . . . . 0.0 109.515 172.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 40.3 p-10 -49.28 -47.3 46.88 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 173.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -60.01 -51.17 70.78 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.025 -1.672 . . . . 0.0 110.706 173.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.97 -43.39 83.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 120.934 -1.104 . . . . 0.0 113.366 -174.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 pt -60.07 -39.87 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 120.366 1.439 . . . . 0.0 111.881 171.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.84 -35.76 77.39 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.83 1.195 . . . . 0.0 112.257 174.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -67.66 -51.68 46.99 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.713 1.605 . . . . 0.0 112.323 -178.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.3 mt -67.55 -32.68 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 O-C-N 121.372 -0.83 . . . . 0.0 111.598 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mp -63.53 -23.14 67.27 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.011 1.324 . . . . 0.0 112.022 175.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -82.37 -14.27 55.53 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 176.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -85.3 -13.33 50.03 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.463 0.705 . . . . 0.0 112.135 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -127.38 -21.64 3.82 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -172.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.28 1.37 0.09 OUTLIER Glycine 0 N--CA 1.468 0.83 0 N-CA-C 115.521 0.968 . . . . 0.0 115.521 150.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -85.1 -29.47 24.84 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.405 1.102 . . . . 0.0 112.59 -169.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.3 ptmt 28.84 41.81 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 130.388 3.475 . . . . 0.0 114.185 -173.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.78 139.73 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.305 1.042 . . . . 0.0 108.244 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.71 163.68 24.32 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.103 2.161 . . . . 0.0 112.515 177.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -61.78 -30.15 70.61 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 125.545 1.538 . . . . 0.0 114.205 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -71.96 -31.12 66.0 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.62 1.1 . . . . 0.0 111.791 -175.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 m -79.45 -48.89 13.17 Favored 'General case' 0 CA--C 1.505 -0.761 0 C-N-CA 125.853 1.661 . . . . 0.0 108.848 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -64.79 -32.06 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 CA-C-N 115.003 -0.998 . . . . 0.0 110.615 -176.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.95 -36.92 67.27 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 125.218 1.407 . . . . 0.0 112.354 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -75.64 -15.17 60.36 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.954 1.302 . . . . 0.0 112.655 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -90.28 -49.54 6.48 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.249 1.42 . . . . 0.0 111.991 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -22.8 26.63 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.426 1.012 . . . . 0.0 112.963 169.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -69.15 -45.3 70.41 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.706 1.202 . . . . 0.0 112.683 171.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 13.8 ptt? -87.08 -28.98 22.22 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.917 0.887 . . . . 0.0 113.283 -170.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.3 mp -67.24 -65.52 0.67 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.505 1.122 . . . . 0.0 111.088 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.75 6.55 0.03 OUTLIER Glycine 0 CA--C 1.537 1.407 0 N-CA-C 119.594 2.598 . . . . 0.0 119.594 169.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 59.5 mt -82.91 124.13 77.16 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 120.399 2.099 . . . . 0.0 111.839 -173.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -51.57 -60.9 0.63 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 124.967 3.778 . . . . 0.0 112.852 170.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 90.7 p -162.41 -18.43 0.04 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 165.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 60.8 m 61.41 0.56 0.46 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.464 1.905 . . . . 0.0 115.181 -163.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -85.99 -16.28 38.82 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.797 1.639 . . . . 0.0 111.681 165.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.25 -14.01 9.28 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.311 1.444 . . . . 0.0 114.36 -176.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -70.8 -45.92 63.76 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.12 1.368 . . . . 0.0 112.032 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -76.07 -56.22 4.86 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.706 1.603 . . . . 0.0 112.728 -173.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.254 1.297 0 C-N-CA 126.923 2.089 . . . . 0.0 114.529 -168.543 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 32.1 mt . . . . . 0 CA--C 1.537 0.446 0 CA-C-O 122.012 0.911 . . . . 0.0 113.334 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 38.9 p -73.44 -164.31 0.19 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.009 1.724 . . . . 0.0 112.571 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -49.06 -24.98 1.79 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.433 1.493 . . . . 0.0 114.468 169.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 178.83 51.23 0.08 OUTLIER Glycine 0 C--N 1.341 0.807 0 CA-C-O 118.598 -1.112 . . . . 0.0 114.53 169.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.64 -13.88 55.7 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.913 1.857 . . . . 0.0 113.947 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 pp -106.37 -19.18 13.77 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.464 1.105 . . . . 0.0 113.106 167.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.5 ttt -72.65 -57.97 3.72 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.322 1.849 . . . . 0.0 111.196 -175.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.0 pttp -77.08 15.71 0.66 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.691 1.196 . . . . 0.0 113.046 -174.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -126.27 -40.91 1.94 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 129.473 3.109 . . . . 0.0 110.899 -170.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 pt -61.68 -37.85 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 118.776 0.717 . . . . 0.0 111.356 -178.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.94 -16.47 50.4 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -98.25 -16.15 19.54 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 126.452 1.901 . . . . 0.0 112.016 -168.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -99.09 -43.5 11.55 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 C-N-CA 124.737 1.215 . . . . 0.0 109.379 167.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.65 -32.09 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 119.818 1.19 . . . . 0.0 111.139 -175.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -77.99 -3.92 44.43 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 121.453 -0.779 . . . . 0.0 112.92 174.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -105.33 -16.24 14.81 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.721 1.608 . . . . 0.0 112.551 -176.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -101.31 -97.48 0.27 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.713 0.688 . . . . 0.0 112.393 -169.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -137.01 87.8 2.31 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.391 1.077 . . . . 0.0 110.13 -177.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -59.79 -17.51 36.18 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.651 1.18 . . . . 0.0 114.163 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -93.87 -2.55 53.23 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.431 1.892 . . . . 0.0 114.595 171.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -142.57 63.94 15.06 Favored Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 127.755 2.422 . . . . 0.0 110.45 174.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -71.21 160.38 49.15 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.274 2.65 . . . . 0.0 112.743 -165.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -74.53 -178.59 3.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.998 0.919 . . . . 0.0 111.066 164.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.5 p -142.84 172.93 12.02 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.387 1.475 . . . . 0.0 109.96 172.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -55.11 -33.53 62.92 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.83 1.418 . . . . 0.0 114.83 -174.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.8 tp60 -67.2 -51.03 58.42 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 120.159 -1.588 . . . . 0.0 110.661 169.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -62.39 -50.56 71.04 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 120.959 -1.088 . . . . 0.0 111.949 -173.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 pt -58.97 -37.82 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.455 1.025 . . . . 0.0 112.424 174.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.86 -34.94 78.42 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.307 0.958 . . . . 0.0 112.047 177.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -69.1 -52.0 32.81 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.413 1.085 . . . . 0.0 112.659 -178.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.401 HG23 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -63.95 -32.88 58.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 O-C-N 121.413 -0.804 . . . . 0.0 111.4 -177.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.74 -22.89 67.14 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.28 1.432 . . . . 0.0 112.736 175.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.7 ptmt -81.31 -14.62 57.14 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.663 -0.648 . . . . 0.0 112.736 175.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -85.93 -14.02 46.0 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.305 0.642 . . . . 0.0 111.969 -178.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.401 ' HE3' HG23 ' A' ' 33' ' ' ILE . 14.1 ptpt -126.66 -22.23 3.95 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -171.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.95 1.99 0.07 OUTLIER Glycine 0 N--CA 1.47 0.961 0 N-CA-C 115.82 1.088 . . . . 0.0 115.82 151.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -87.82 -27.19 22.42 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.314 1.057 . . . . 0.0 112.839 -168.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.0 ptmt 30.49 40.51 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 130.101 3.36 . . . . 0.0 114.253 -173.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.1 p -82.51 141.43 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -82.35 166.35 19.54 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 127.433 2.293 . . . . 0.0 112.449 176.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -64.56 -24.87 67.74 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.309 1.444 . . . . 0.0 114.587 -174.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -70.28 -39.03 75.16 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.16 -0.963 . . . . 0.0 111.948 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.1 m -78.74 -45.82 20.3 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 126.588 1.955 . . . . 0.0 109.003 -175.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.47 -32.5 58.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.093 -176.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.2 -35.92 74.25 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.595 1.558 . . . . 0.0 111.949 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.0 mttm -78.54 -18.95 53.94 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.592 1.157 . . . . 0.0 112.41 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -82.01 -48.44 11.43 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.46 1.104 . . . . 0.0 112.616 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.05 -20.76 10.26 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 175.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -68.54 -46.6 69.1 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.76 1.224 . . . . 0.0 112.822 173.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -82.87 -27.14 30.97 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -173.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.3 mt -70.61 -59.77 2.64 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.476 1.11 . . . . 0.0 111.724 176.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.59 6.04 0.03 OUTLIER Glycine 0 CA--C 1.535 1.305 0 N-CA-C 118.714 2.246 . . . . 0.0 118.714 169.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.8 mt -90.15 126.58 56.53 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 119.898 1.849 . . . . 0.0 111.157 -173.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.48 -52.04 0.29 Allowed 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.447 2.765 . . . . 0.0 111.034 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.1 p -160.68 -10.68 0.05 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.386 1.624 . . . . 0.0 115.386 161.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.6 m 64.63 -19.5 0.08 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 128.059 2.544 . . . . 0.0 115.731 -166.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.8 ttp180 -69.13 -36.94 78.03 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.626 1.171 . . . . 0.0 109.373 171.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -24.71 33.25 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.555 1.142 . . . . 0.0 113.576 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -74.01 -40.07 63.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.212 1.405 . . . . 0.0 112.704 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -63.69 -63.48 1.16 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 126.053 1.741 . . . . 0.0 112.277 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.6 tp . . . . . 0 C--O 1.253 1.267 0 C-N-CA 126.729 2.012 . . . . 0.0 114.357 -167.715 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 34.2 mt . . . . . 0 CA--C 1.54 0.558 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.7 p -75.15 -167.33 0.6 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.196 1.799 . . . . 0.0 113.004 -177.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -48.75 -24.68 1.49 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.638 1.575 . . . . 0.0 114.697 173.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.69 44.72 0.11 Allowed Glycine 0 C--N 1.341 0.857 0 CA-C-O 117.874 -1.514 . . . . 0.0 115.745 170.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -61.87 -13.98 29.49 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.612 2.206 . . . . 0.0 113.487 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pp -112.33 -17.55 12.7 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.969 1.308 . . . . 0.0 113.228 168.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.5 ttt -72.0 -60.54 2.18 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.198 1.399 . . . . 0.0 111.166 -176.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.3 pttt -75.17 18.86 0.17 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.378 1.071 . . . . 0.0 113.624 -174.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -126.22 -43.77 1.77 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 129.318 3.047 . . . . 0.0 110.168 -171.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.5 pt -63.19 -32.02 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 118.268 0.486 . . . . 0.0 112.078 -173.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.46 -14.85 23.39 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -89.86 -14.28 34.67 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.785 2.034 . . . . 0.0 111.673 -176.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -105.47 -52.38 7.54 Favored 'Isoleucine or valine' 0 C--N 1.341 0.214 0 C-N-CA 124.34 1.056 . . . . 0.0 108.72 167.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.77 -36.88 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 120.608 1.549 . . . . 0.0 111.382 -170.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -87.24 9.28 20.72 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -116.96 -24.35 7.64 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.028 1.731 . . . . 0.0 112.99 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -85.6 -79.32 0.24 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.415 1.086 . . . . 0.0 111.282 -171.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -139.2 86.7 2.15 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.561 1.144 . . . . 0.0 110.747 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -59.68 -19.37 49.15 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.278 1.031 . . . . 0.0 113.615 170.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -16.94 39.03 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 127.217 2.207 . . . . 0.0 114.654 171.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -148.21 72.76 11.07 Favored Pre-proline 0 N--CA 1.481 1.116 0 C-N-CA 127.175 2.19 . . . . 0.0 110.386 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -72.75 168.35 24.79 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.054 2.503 . . . . 0.0 113.236 -170.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -78.93 -173.81 3.71 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.212 1.405 . . . . 0.0 110.629 166.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 91.1 p -133.93 172.54 12.67 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.898 1.679 . . . . 0.0 109.284 171.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -65.76 -23.52 66.75 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.292 -0.88 . . . . 0.0 112.453 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -68.74 -54.15 17.74 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.418 -1.426 . . . . 0.0 110.665 165.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -61.96 -48.0 82.32 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 120.843 -1.161 . . . . 0.0 112.606 -174.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 pt -60.83 -38.61 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-N 119.544 1.066 . . . . 0.0 112.207 173.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.74 -34.48 75.9 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.631 1.105 . . . . 0.0 111.712 177.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -67.81 -55.44 12.98 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.676 1.191 . . . . 0.0 112.886 178.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.9 mt -64.83 -32.54 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 O-C-N 121.463 -0.773 . . . . 0.0 111.167 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.3 -22.64 66.2 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.74 1.216 . . . . 0.0 112.214 176.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 pttm -81.86 -13.03 58.17 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 175.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -90.01 -9.28 49.21 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.503 0.721 . . . . 0.0 112.191 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 pttt -127.61 -23.3 3.47 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 114.862 1.431 . . . . 0.0 114.862 -176.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 154.35 4.53 0.11 Allowed Glycine 0 N--CA 1.471 1.033 0 CA-C-N 119.377 0.99 . . . . 0.0 115.418 151.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -84.46 -31.35 24.61 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 118.148 0.974 . . . . 0.0 111.943 -171.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.1 ptmt 26.11 50.7 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 129.802 3.241 . . . . 0.0 113.01 -172.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.8 p -88.12 140.62 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.648 1.579 . . . . 0.0 108.77 171.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.6 165.33 17.13 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 129.025 2.93 . . . . 0.0 113.309 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -25.62 68.08 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.471 1.908 . . . . 0.0 114.65 -175.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -34.45 75.93 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.823 1.249 . . . . 0.0 110.785 -178.255 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 m -87.18 -47.05 9.19 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 127.407 2.283 . . . . 0.0 110.509 -176.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.23 -28.7 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.875 -173.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.95 -37.23 72.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.176 1.79 . . . . 0.0 113.129 174.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -70.54 -23.65 62.66 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.262 1.025 . . . . 0.0 112.281 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -80.5 -40.72 25.56 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -175.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -55.4 -25.15 34.07 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 118.943 0.792 . . . . 0.0 112.629 174.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -70.15 -38.13 75.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 176.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.5 ptp -81.09 -26.66 36.07 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 mt -73.61 -59.76 2.56 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.345 1.058 . . . . 0.0 111.758 172.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 156.12 15.03 0.05 OUTLIER Glycine 0 CA--C 1.536 1.344 0 N-CA-C 117.648 1.819 . . . . 0.0 117.648 167.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.1 mt -117.49 133.23 23.27 Favored Pre-proline 0 CA--C 1.548 0.874 0 CA-C-N 119.2 1.5 . . . . 0.0 111.328 -167.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -71.74 -52.83 0.19 Allowed 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.926 3.084 . . . . 0.0 113.793 -177.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.9 p -156.35 -9.2 0.1 Allowed 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.6 m 61.78 -13.97 0.05 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.144 2.178 . . . . 0.0 115.568 -166.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -85.23 -36.69 20.79 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.753 1.621 . . . . 0.0 110.476 176.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -20.23 57.7 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 177.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 64.4 mtp85 -70.43 -42.2 71.89 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.047 1.739 . . . . 0.0 111.977 167.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -70.65 -59.17 2.98 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.392 1.877 . . . . 0.0 113.224 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.9 tp . . . . . 0 C--O 1.255 1.355 0 C-N-CA 126.593 1.957 . . . . 0.0 114.595 -166.816 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 39.1 mt . . . . . 0 CA--C 1.54 0.594 0 N-CA-C 116.605 2.076 . . . . 0.0 116.605 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.9 p -72.34 -168.11 0.39 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.102 1.761 . . . . 0.0 112.7 -178.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -48.7 -24.4 1.37 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.446 1.498 . . . . 0.0 114.72 172.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.54 41.18 0.11 Allowed Glycine 0 CA--C 1.527 0.817 0 CA-C-O 117.75 -1.583 . . . . 0.0 115.769 173.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -62.63 -13.01 26.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 121.25 2.525 . . . . 0.0 113.871 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pp -109.35 -17.39 13.81 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.692 1.197 . . . . 0.0 113.627 167.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.6 ttt -67.7 -66.01 0.62 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.948 1.299 . . . . 0.0 109.982 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.3 pttp -74.43 17.17 0.21 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.207 1.403 . . . . 0.0 113.829 -172.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -130.03 -34.34 1.69 Allowed 'General case' 0 C--O 1.234 0.289 0 C-N-CA 129.082 2.953 . . . . 0.0 111.946 -172.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -62.8 -34.15 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 119.689 1.131 . . . . 0.0 111.656 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -9.93 41.88 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -178.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -91.13 -15.99 28.52 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.559 1.943 . . . . 0.0 111.943 -175.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -105.03 -47.93 9.4 Favored 'Isoleucine or valine' 0 C--N 1.342 0.252 0 C-N-CA 124.621 1.168 . . . . 0.0 109.337 168.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 63.6 t -66.56 -35.6 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 119.982 1.265 . . . . 0.0 111.249 -172.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -78.84 -0.59 31.23 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.561 -0.712 . . . . 0.0 112.612 176.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -109.65 -13.15 14.56 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.593 1.957 . . . . 0.0 113.544 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -101.92 -89.55 0.36 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.537 0.735 . . . . 0.0 112.531 -170.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -135.67 91.24 2.69 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 122.433 1.111 . . . . 0.0 112.371 -173.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -53.53 -30.98 44.35 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.61 1.564 . . . . 0.0 113.389 170.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.42 -8.69 49.92 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.613 1.965 . . . . 0.0 114.986 177.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -145.49 76.84 12.91 Favored Pre-proline 0 N--CA 1.481 1.114 0 C-N-CA 126.681 1.992 . . . . 0.0 110.345 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -72.02 164.43 35.69 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.796 2.331 . . . . 0.0 112.643 -172.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -78.69 -174.79 4.07 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.488 1.115 . . . . 0.0 110.91 166.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.2 p -136.88 169.87 17.03 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.127 1.771 . . . . 0.0 109.949 172.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.4 p30 -53.06 -33.77 53.48 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 176.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -68.16 -53.56 24.24 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 119.982 -1.698 . . . . 0.0 110.678 169.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.34 -49.12 78.26 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 120.929 -1.107 . . . . 0.0 112.504 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.0 pt -59.64 -38.26 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-N 119.574 1.079 . . . . 0.0 112.222 174.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.94 -35.54 78.74 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.625 1.102 . . . . 0.0 111.829 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -69.26 -53.14 21.31 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.566 1.146 . . . . 0.0 112.656 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.4 HG23 ' HE3' ' A' ' 37' ' ' LYS . 2.4 mt -64.36 -32.74 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.112 0.869 . . . . 0.0 111.53 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 mp -63.11 -22.03 66.59 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.78 1.232 . . . . 0.0 112.181 176.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.3 pttt -79.43 -16.03 56.83 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 174.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -89.57 -11.22 43.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.945 0.898 . . . . 0.0 112.146 -176.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.4 ' HE3' HG23 ' A' ' 33' ' ' ILE . 13.0 ptpt -126.8 -22.32 3.89 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -173.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.46 0.92 0.06 OUTLIER Glycine 0 N--CA 1.472 1.043 0 N-CA-C 116.215 1.246 . . . . 0.0 116.215 153.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -91.45 -30.97 16.18 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.76 1.28 . . . . 0.0 113.159 -166.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt 26.66 50.05 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 129.391 3.076 . . . . 0.0 113.081 -170.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.1 p -86.7 138.45 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.729 1.612 . . . . 0.0 108.849 174.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.54 161.91 26.69 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 128.344 2.658 . . . . 0.0 112.16 177.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -59.44 -27.58 66.2 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.409 1.483 . . . . 0.0 113.513 179.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -66.53 -34.29 77.59 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.405 1.482 . . . . 0.0 111.167 -174.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.0 m -87.1 -48.85 7.73 Favored 'General case' 0 CA--C 1.509 -0.601 0 C-N-CA 128.346 2.658 . . . . 0.0 110.397 -178.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.44 -29.45 46.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.994 -172.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.04 -42.8 80.01 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 125.608 1.563 . . . . 0.0 111.175 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -70.24 -19.61 63.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.775 1.23 . . . . 0.0 112.406 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -87.94 -46.7 9.16 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.634 1.174 . . . . 0.0 113.264 -177.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -22.81 40.94 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.389 0.995 . . . . 0.0 112.557 172.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -72.22 -42.31 65.88 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.661 1.185 . . . . 0.0 112.739 172.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.2 ptm -83.35 -30.14 27.69 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.829 0.852 . . . . 0.0 113.107 -173.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.9 mp -67.65 -67.82 0.43 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.665 1.186 . . . . 0.0 111.061 173.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.18 6.46 0.03 OUTLIER Glycine 0 CA--C 1.536 1.356 0 N-CA-C 118.427 2.131 . . . . 0.0 118.427 172.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.1 mt -84.74 125.42 71.15 Favored Pre-proline 0 CA--C 1.545 0.784 0 CA-C-N 119.87 1.835 . . . . 0.0 110.838 -177.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.6 -53.35 0.36 Allowed 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.923 2.416 . . . . 0.0 110.642 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 82.7 p -161.11 -10.82 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.484 1.514 . . . . 0.0 114.988 162.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.9 m 62.36 -19.71 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.38 2.672 . . . . 0.0 115.752 -165.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -67.75 -44.43 77.53 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.584 1.554 . . . . 0.0 108.688 169.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -22.85 59.24 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -178.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -73.75 -42.3 61.28 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.426 1.49 . . . . 0.0 111.821 170.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -73.61 -58.89 2.99 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.841 1.656 . . . . 0.0 113.036 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.253 1.26 0 C-N-CA 126.127 1.771 . . . . 0.0 114.459 -167.707 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.5 mt . . . . . 0 CA--C 1.54 0.586 0 CA-C-O 122.134 0.969 . . . . 0.0 113.599 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.7 p -73.47 -169.31 0.65 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.705 1.202 . . . . 0.0 112.513 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -48.91 -24.66 1.56 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.554 1.542 . . . . 0.0 114.699 172.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.28 44.21 0.16 Allowed Glycine 0 C--N 1.341 0.841 0 CA-C-O 117.953 -1.471 . . . . 0.0 115.864 172.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -61.41 -14.92 31.91 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.7 2.25 . . . . 0.0 113.47 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 pp -109.97 -17.21 13.66 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.716 1.206 . . . . 0.0 112.814 169.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.402 ' C ' ' H ' ' A' ' 11' ' ' LEU . 1.2 ttt -74.05 -59.17 2.84 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.914 1.686 . . . . 0.0 111.517 -175.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.4 pttt -76.86 19.26 0.3 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.91 1.284 . . . . 0.0 112.918 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' A' ' 9' ' ' MET . 3.4 mm? -128.45 -41.33 1.55 Allowed 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 129.716 3.207 . . . . 0.0 110.574 -170.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 pt -61.33 -37.75 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 118.69 0.677 . . . . 0.0 111.274 -177.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.42 -14.01 44.57 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.715 1.005 . . . . 0.0 113.715 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.7 tp10 -95.21 -19.96 19.62 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 125.972 1.709 . . . . 0.0 111.761 -170.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -98.61 -46.53 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 C-N-CA 124.813 1.245 . . . . 0.0 109.149 169.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.81 -35.44 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.593 1.088 . . . . 0.0 111.324 -173.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -79.01 -2.64 41.24 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 177.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -104.85 -17.64 14.5 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.204 1.801 . . . . 0.0 112.87 -176.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -97.32 -91.73 0.25 Allowed 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.577 0.751 . . . . 0.0 112.256 -169.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -137.18 89.26 2.42 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 125.064 1.346 . . . . 0.0 110.218 177.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.3 mtmm -59.12 -18.81 39.06 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.62 1.168 . . . . 0.0 112.754 167.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -21.47 61.57 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 127.436 2.295 . . . . 0.0 114.051 169.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.5 mtmt -148.73 74.66 10.29 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 127.819 2.448 . . . . 0.0 109.747 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -68.75 161.56 44.89 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.09 2.526 . . . . 0.0 113.011 -169.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -76.5 -172.73 2.27 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.714 1.206 . . . . 0.0 110.671 167.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 59.7 p -136.78 167.51 21.3 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 126.316 1.847 . . . . 0.0 109.457 176.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 51.3 p30 -54.66 -30.96 56.83 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 175.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -68.17 -54.45 17.88 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.0 -1.688 . . . . 0.0 110.702 168.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.71 -47.78 82.13 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 120.659 -1.275 . . . . 0.0 112.757 -173.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.1 pt -59.27 -38.24 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-N 119.518 1.053 . . . . 0.0 112.142 173.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.8 -35.46 79.93 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.647 1.112 . . . . 0.0 112.138 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -67.31 -53.11 32.66 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.651 1.18 . . . . 0.0 112.952 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.425 HG23 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -64.74 -32.42 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 O-C-N 121.567 -0.708 . . . . 0.0 111.657 -176.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.29 -22.36 66.82 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 125.174 1.39 . . . . 0.0 112.149 175.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -81.28 -14.6 57.23 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 175.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -87.57 -11.51 48.47 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.562 0.745 . . . . 0.0 111.992 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.425 ' HE3' HG23 ' A' ' 33' ' ' ILE . 14.1 ptpt -127.49 -22.73 3.6 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -173.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.45 0.5 0.07 OUTLIER Glycine 0 N--CA 1.47 0.931 0 N-CA-C 115.93 1.132 . . . . 0.0 115.93 152.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -89.48 -29.4 19.0 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.426 1.113 . . . . 0.0 112.694 -167.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt 29.03 43.37 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 130.243 3.417 . . . . 0.0 114.181 -173.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.401 ' CG2' ' HB ' ' A' ' 45' ' ' THR . 3.3 p -83.4 144.24 10.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.092 0.957 . . . . 0.0 109.132 175.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.45 165.5 14.29 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.307 2.643 . . . . 0.0 112.806 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.01 -29.5 69.74 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.494 1.518 . . . . 0.0 114.254 -175.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -68.42 -32.11 71.92 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.188 0.904 . . . . 0.0 111.747 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.401 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 2.1 m -84.15 -48.16 10.12 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 127.913 2.485 . . . . 0.0 110.174 -177.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.9 -28.98 44.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.641 -173.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.56 -33.4 72.7 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.804 1.642 . . . . 0.0 111.921 176.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -72.74 -22.5 60.85 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.734 0.814 . . . . 0.0 112.693 174.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -83.49 -44.17 14.99 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.514 0.726 . . . . 0.0 112.909 -174.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.17 -30.65 7.1 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 118.785 0.72 . . . . 0.0 112.926 172.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -72.64 -33.07 66.36 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.195 0.998 . . . . 0.0 112.853 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 23.6 ptt? -94.37 -22.74 18.13 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.861 1.059 . . . . 0.0 113.861 -176.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 mt -72.92 -63.64 1.13 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.148 0.979 . . . . 0.0 111.374 170.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 165.93 -2.78 0.05 OUTLIER Glycine 0 CA--C 1.536 1.349 0 N-CA-C 117.675 1.83 . . . . 0.0 117.675 169.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.8 mt -72.63 128.06 88.98 Favored Pre-proline 0 CA--C 1.547 0.861 0 CA-C-N 119.127 1.463 . . . . 0.0 111.074 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.73 -64.42 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 123.459 2.773 . . . . 0.0 109.887 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 77.2 p -149.04 -10.41 0.33 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.1 1.36 . . . . 0.0 114.58 164.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.9 m 59.24 -14.58 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 128.436 2.694 . . . . 0.0 116.259 -165.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -67.39 -45.21 76.87 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.421 1.489 . . . . 0.0 108.76 165.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -22.34 59.25 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -177.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -73.99 -41.93 61.19 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.543 1.537 . . . . 0.0 111.76 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -73.58 -58.38 3.35 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.441 1.496 . . . . 0.0 113.192 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.253 1.264 0 C-N-CA 126.622 1.969 . . . . 0.0 114.479 -168.031 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.1 mt . . . . . 0 CA--C 1.541 0.602 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.3 p -73.97 -169.24 0.72 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.625 1.57 . . . . 0.0 112.645 177.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -49.19 -24.88 1.91 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.78 1.632 . . . . 0.0 114.626 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.63 45.76 0.12 Allowed Glycine 0 C--N 1.34 0.8 0 CA-C-O 118.174 -1.348 . . . . 0.0 114.833 171.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.36 -19.85 38.82 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 120.038 1.919 . . . . 0.0 113.552 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pp -108.67 -17.63 13.91 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.146 1.378 . . . . 0.0 112.761 171.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -73.18 -57.33 4.1 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 126.09 1.756 . . . . 0.0 111.48 -175.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.3 pttp -76.0 15.68 0.51 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.733 1.213 . . . . 0.0 113.161 -174.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -126.32 -42.03 1.86 Allowed 'General case' 0 C--O 1.233 0.203 0 C-N-CA 129.753 3.221 . . . . 0.0 110.436 -170.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.4 pt -62.99 -35.88 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-N 118.658 0.663 . . . . 0.0 111.679 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.07 -19.04 41.05 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 178.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -94.95 -17.47 21.94 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 127.091 2.156 . . . . 0.0 111.919 -168.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -100.8 -51.16 9.87 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 C-N-CA 123.955 0.902 . . . . 0.0 108.746 167.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 93.7 t -63.87 -39.11 84.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 119.81 1.186 . . . . 0.0 111.181 -170.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -82.39 3.74 26.82 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 120.076 -0.65 . . . . 0.0 112.273 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.67 -11.39 9.42 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.312 1.845 . . . . 0.0 114.17 -177.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -91.15 -86.95 0.21 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.243 1.017 . . . . 0.0 111.621 -176.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -131.99 96.66 3.96 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 122.53 1.157 . . . . 0.0 112.243 178.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -57.81 -15.72 9.18 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.273 1.429 . . . . 0.0 113.939 171.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -102.06 -10.2 19.92 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.921 2.088 . . . . 0.0 113.747 173.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -140.6 76.09 25.14 Favored Pre-proline 0 N--CA 1.483 1.195 0 C-N-CA 125.773 1.629 . . . . 0.0 111.076 172.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.51 161.9 44.38 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.254 2.636 . . . . 0.0 112.445 -176.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -81.89 -178.01 6.82 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.642 1.177 . . . . 0.0 111.255 169.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 93.2 p -131.18 169.01 16.5 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.889 1.676 . . . . 0.0 109.866 173.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -54.33 -31.96 55.55 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 174.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -68.83 -53.82 19.29 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.001 -1.687 . . . . 0.0 110.988 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -61.81 -47.64 84.19 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 120.578 -1.326 . . . . 0.0 112.597 -174.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.5 pt -59.98 -38.38 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 119.657 1.117 . . . . 0.0 112.06 173.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.89 -34.52 76.18 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.433 1.015 . . . . 0.0 112.197 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -68.16 -54.39 18.33 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.65 1.18 . . . . 0.0 112.771 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.411 HG21 ' HE3' ' A' ' 37' ' ' LYS . 3.0 mt -63.37 -33.46 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 121.496 -0.753 . . . . 0.0 111.509 -176.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.88 -23.03 67.19 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.499 1.52 . . . . 0.0 112.332 176.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -80.95 -15.46 56.2 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -84.39 -13.59 51.77 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.505 0.722 . . . . 0.0 112.179 -178.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.411 ' HE3' HG21 ' A' ' 33' ' ' ILE . 14.2 ptpt -127.0 -23.51 3.61 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.342 1.608 . . . . 0.0 115.342 -171.003 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.63 1.7 0.07 OUTLIER Glycine 0 N--CA 1.471 0.975 0 N-CA-C 115.752 1.061 . . . . 0.0 115.752 152.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -87.42 -30.7 20.52 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.412 1.106 . . . . 0.0 112.676 -169.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ptmt 29.01 44.81 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 129.947 3.299 . . . . 0.0 113.921 -171.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -82.08 140.46 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.078 1.351 . . . . 0.0 109.002 176.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.98 165.23 20.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.355 2.262 . . . . 0.0 112.328 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -25.75 68.4 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.267 1.427 . . . . 0.0 113.904 -177.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -67.3 -36.35 81.33 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.165 0.986 . . . . 0.0 111.516 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.1 m -84.89 -48.91 8.85 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 127.481 2.312 . . . . 0.0 109.4 -175.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.91 -30.05 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.27 -174.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.11 -48.88 72.09 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.105 1.362 . . . . 0.0 110.727 176.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -69.22 -16.26 63.56 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.522 0.729 . . . . 0.0 112.938 -178.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -81.54 -47.53 12.97 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.985 0.914 . . . . 0.0 112.158 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.9 ptp180 -56.27 -23.08 34.11 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 119.066 0.848 . . . . 0.0 113.081 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -66.85 -47.46 71.87 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.723 1.209 . . . . 0.0 112.654 174.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -84.65 -25.33 28.57 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -171.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.0 -59.57 2.71 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.325 1.05 . . . . 0.0 111.868 175.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 167.42 8.6 0.03 OUTLIER Glycine 0 CA--C 1.534 1.262 0 N-CA-C 118.192 2.037 . . . . 0.0 118.192 171.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.8 mt -96.38 130.34 31.07 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 119.938 1.869 . . . . 0.0 110.928 -175.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -69.98 -58.7 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.669 2.912 . . . . 0.0 111.233 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.2 p -155.5 -4.13 0.13 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.722 1.609 . . . . 0.0 114.715 168.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 83.4 p 59.23 -10.6 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.785 2.834 . . . . 0.0 116.217 -168.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -82.17 -30.92 30.73 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 120.521 1.51 . . . . 0.0 111.057 172.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -23.73 59.07 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 174.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -72.95 -37.33 67.16 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.941 1.296 . . . . 0.0 112.417 170.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -72.85 -59.67 2.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.137 1.775 . . . . 0.0 112.88 179.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.7 tp . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.668 1.587 . . . . 0.0 114.415 -167.315 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.6 mt . . . . . 0 CA--C 1.541 0.625 0 CA-C-O 121.579 0.704 . . . . 0.0 112.468 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.5 p -71.53 -169.86 0.47 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.796 1.238 . . . . 0.0 112.502 175.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -48.7 -24.68 1.46 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.718 1.607 . . . . 0.0 114.655 173.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.2 45.83 0.11 Allowed Glycine 0 C--N 1.341 0.82 0 CA-C-O 117.954 -1.47 . . . . 0.0 115.205 170.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.59 -17.4 32.69 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.623 2.212 . . . . 0.0 113.425 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 pp -107.85 -20.06 13.32 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.526 1.13 . . . . 0.0 112.635 171.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.5 ttt -68.79 -62.66 1.29 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 126.134 1.774 . . . . 0.0 110.718 -178.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 pttp -76.67 16.36 0.52 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.098 1.359 . . . . 0.0 113.675 -171.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -127.46 -39.67 1.84 Allowed 'General case' 0 C--O 1.233 0.214 0 C-N-CA 129.375 3.07 . . . . 0.0 110.745 -171.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pt -63.07 -36.8 77.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.947 0.794 . . . . 0.0 111.447 -176.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 -16.03 44.89 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -179.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -97.57 -17.06 19.77 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 127.828 2.451 . . . . 0.0 111.773 -167.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.0 pp -101.42 -46.51 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 C-N-CA 124.981 1.312 . . . . 0.0 109.762 167.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.6 t -62.81 -42.78 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-N 119.463 1.028 . . . . 0.0 110.471 -174.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -81.41 0.19 38.64 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.659 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -96.22 -21.49 17.84 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.22 1.408 . . . . 0.0 112.622 175.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -91.8 -84.64 0.26 Allowed 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.504 1.122 . . . . 0.0 112.005 -172.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -140.1 92.42 2.54 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.573 1.149 . . . . 0.0 110.465 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -53.13 -27.76 22.44 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 160.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -22.59 63.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.611 2.765 . . . . 0.0 114.208 173.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -148.11 73.36 11.11 Favored Pre-proline 0 N--CA 1.478 0.937 0 C-N-CA 127.398 2.279 . . . . 0.0 109.878 -174.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -69.26 155.96 66.06 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.848 2.365 . . . . 0.0 112.402 -168.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -78.96 172.25 14.06 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.639 0.733 . . . . 0.0 110.423 165.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.5 p -129.09 169.01 15.26 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.491 1.516 . . . . 0.0 110.008 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.0 p30 -53.29 -34.15 56.14 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 178.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -67.64 -53.84 24.61 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 119.716 -1.865 . . . . 0.0 110.8 168.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -61.33 -49.66 76.08 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 120.807 -1.183 . . . . 0.0 112.558 -173.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.3 pt -59.22 -38.61 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-N 119.593 1.088 . . . . 0.0 112.28 173.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.92 -34.42 76.04 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.527 1.058 . . . . 0.0 112.01 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -68.36 -55.28 12.55 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.415 1.086 . . . . 0.0 112.826 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.8 -33.03 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-N 118.826 0.739 . . . . 0.0 111.201 -176.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mp -61.01 -26.37 67.56 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.048 1.339 . . . . 0.0 112.629 176.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -78.89 -13.66 59.67 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.648 0.779 . . . . 0.0 112.76 176.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -90.01 -9.6 48.04 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.553 0.741 . . . . 0.0 112.341 -177.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.5 pttt -127.86 -22.62 3.5 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -175.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 153.56 5.14 0.11 Allowed Glycine 0 N--CA 1.47 0.902 0 CA-C-N 119.65 1.114 . . . . 0.0 115.499 151.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -85.09 -20.73 29.91 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.023 0.912 . . . . 0.0 112.905 -171.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 36.52 28.38 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 130.603 3.561 . . . . 0.0 115.342 -177.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.427 ' CG2' ' HB ' ' A' ' 45' ' ' THR . 4.1 p -84.79 139.84 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-O 121.441 0.638 . . . . 0.0 109.978 -171.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.73 164.31 19.68 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.641 2.376 . . . . 0.0 112.363 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -57.1 -36.62 70.84 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.6 1.16 . . . . 0.0 113.839 -176.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -37.99 86.09 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.56 0.695 . . . . 0.0 110.54 -172.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.427 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 3.2 m -79.04 -48.82 13.7 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 127.972 2.509 . . . . 0.0 109.957 -175.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.06 -29.69 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.823 -175.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.52 -38.53 80.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.828 1.651 . . . . 0.0 111.757 178.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -64.78 -32.35 74.0 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.601 0.76 . . . . 0.0 111.396 175.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -79.52 -48.79 13.27 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 118.555 -0.736 . . . . 0.0 112.195 -171.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -53.54 -32.31 50.05 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.253 0.933 . . . . 0.0 112.286 172.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -72.37 -36.46 68.74 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.564 0.746 . . . . 0.0 112.372 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.0 ptt? -85.79 -31.69 22.21 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -175.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 mp -67.1 -61.2 2.04 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.079 0.952 . . . . 0.0 111.312 176.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 174.29 -2.63 0.03 OUTLIER Glycine 0 CA--C 1.536 1.371 0 N-CA-C 117.763 1.865 . . . . 0.0 117.763 174.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.7 mt -77.23 131.98 71.15 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 119.476 1.638 . . . . 0.0 110.251 177.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.11 -65.28 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.181 2.587 . . . . 0.0 109.873 170.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.6 p -151.03 -2.48 0.34 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.01 1.724 . . . . 0.0 114.225 163.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.5 m 57.73 -8.59 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.79 2.836 . . . . 0.0 116.026 -167.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -73.28 -40.53 64.49 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.491 1.516 . . . . 0.0 108.854 174.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -78.94 -21.53 47.11 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -71.79 -41.93 67.71 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.867 0.867 . . . . 0.0 111.981 169.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -75.27 -59.97 2.51 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.063 1.345 . . . . 0.0 112.86 -176.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.254 1.33 0 C-N-CA 125.541 1.536 . . . . 0.0 114.553 -168.087 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.3 mt . . . . . 0 CA--C 1.534 0.354 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 48.2 p -70.28 -173.6 0.72 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.089 0.956 . . . . 0.0 112.148 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -43.06 -25.73 0.12 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.123 2.169 . . . . 0.0 115.897 170.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -172.58 40.44 0.16 Allowed Glycine 0 C--N 1.341 0.818 0 CA-C-O 117.747 -1.585 . . . . 0.0 115.657 170.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -64.5 -10.28 24.49 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 121.06 2.43 . . . . 0.0 114.127 -177.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 pp -112.64 -15.33 13.03 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.751 1.22 . . . . 0.0 113.687 166.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 3.0 ttp -71.73 -61.72 1.68 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.96 1.304 . . . . 0.0 110.489 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.7 pttp -73.62 16.37 0.21 Allowed 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -173.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.23 -46.11 1.94 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 129.632 3.173 . . . . 0.0 110.931 -171.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pp -63.98 -34.51 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.635 0.652 . . . . 0.0 112.166 -176.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.78 -17.12 51.93 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 175.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -94.68 -16.23 23.28 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.609 1.964 . . . . 0.0 111.81 -168.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.0 -46.25 9.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 C-N-CA 124.601 1.16 . . . . 0.0 109.381 169.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.1 -32.33 55.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 119.848 1.204 . . . . 0.0 111.367 -174.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -80.28 -0.95 38.76 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.495 -0.753 . . . . 0.0 112.583 175.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -110.05 -14.49 14.22 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.124 1.769 . . . . 0.0 113.07 -176.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -101.43 -96.58 0.27 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.052 0.842 . . . . 0.0 112.386 -169.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -136.74 88.33 2.36 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.886 1.274 . . . . 0.0 109.971 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -58.93 -20.46 52.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.543 0.737 . . . . 0.0 112.691 165.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -23.08 61.91 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 128.889 2.875 . . . . 0.0 114.208 169.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -148.45 69.7 10.49 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 127.649 2.379 . . . . 0.0 109.722 -174.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -72.35 165.54 32.36 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.934 2.423 . . . . 0.0 113.645 -163.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -76.02 -170.97 1.52 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.735 1.214 . . . . 0.0 111.045 165.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 60.3 p -141.47 169.02 18.4 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.726 2.01 . . . . 0.0 109.39 174.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -55.2 -32.32 62.13 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -66.5 -53.85 30.43 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 119.846 -1.784 . . . . 0.0 110.919 168.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.62 -49.02 76.85 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 120.661 -1.274 . . . . 0.0 112.758 -173.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.4 pt -59.34 -37.49 69.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-N 119.888 1.222 . . . . 0.0 112.212 173.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.35 -35.16 79.48 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.585 1.084 . . . . 0.0 112.456 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -68.41 -51.09 47.84 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.806 1.242 . . . . 0.0 113.015 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.3 mt -63.6 -35.48 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 121.829 -0.544 . . . . 0.0 110.938 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.3 mp -62.58 -23.22 66.9 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.534 1.534 . . . . 0.0 112.643 176.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 pttm -78.02 -15.11 59.22 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -83.39 -19.96 35.06 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.458 0.703 . . . . 0.0 111.801 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -89.3 -57.48 2.87 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.339 1.856 . . . . 0.0 108.735 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 155.93 7.92 0.07 OUTLIER Glycine 0 CA--C 1.529 0.937 0 CA-C-N 114.185 -1.37 . . . . 0.0 114.152 173.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -79.37 -24.42 42.67 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.492 1.146 . . . . 0.0 112.3 -175.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt 32.69 35.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 130.692 3.597 . . . . 0.0 114.586 -176.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -82.48 139.83 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -175.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.36 160.71 26.61 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.345 2.258 . . . . 0.0 112.22 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -34.9 64.48 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.726 1.211 . . . . 0.0 113.915 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.08 -31.49 72.39 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 118.735 0.698 . . . . 0.0 111.661 -173.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.8 m -83.86 -49.64 8.84 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 128.584 2.753 . . . . 0.0 109.745 -176.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.79 -26.9 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.193 -176.104 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.46 -36.16 76.32 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 126.718 2.007 . . . . 0.0 111.829 177.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -64.74 -39.04 92.96 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.982 -0.449 . . . . 0.0 111.626 172.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -73.47 -35.94 65.76 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -164.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.98 -30.84 6.51 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 170.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -71.11 -36.42 72.14 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.1 ptp -86.51 -20.62 27.78 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -175.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.2 mt -86.45 -63.4 1.32 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.295 1.438 . . . . 0.0 111.623 179.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.92 -5.55 0.04 OUTLIER Glycine 0 CA--C 1.535 1.294 0 N-CA-C 117.851 1.901 . . . . 0.0 117.851 167.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.0 mt -76.73 122.7 86.99 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 119.329 1.564 . . . . 0.0 110.871 -176.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.23 -59.41 0.08 OUTLIER 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.556 2.838 . . . . 0.0 110.729 -178.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 83.2 p -146.24 -6.8 0.55 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.798 1.639 . . . . 0.0 113.884 159.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 85.1 p 60.45 -20.43 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 129.561 3.144 . . . . 0.0 116.17 -163.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -71.1 -43.6 67.36 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.801 1.64 . . . . 0.0 109.649 172.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -23.56 60.81 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.652 0.781 . . . . 0.0 112.768 -172.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -70.23 -46.29 64.76 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.989 1.716 . . . . 0.0 111.993 167.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -72.0 -58.98 2.99 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.188 1.795 . . . . 0.0 113.194 -174.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.833 2.053 . . . . 0.0 114.437 -167.602 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 CA--C 1.536 0.407 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 54.2 p -74.25 -168.03 0.6 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.821 1.648 . . . . 0.0 112.485 179.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -49.05 -25.7 2.19 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.204 1.402 . . . . 0.0 114.378 173.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.47 45.8 0.12 Allowed Glycine 0 C--N 1.34 0.776 0 CA-C-O 118.09 -1.394 . . . . 0.0 115.021 172.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -62.84 -15.77 55.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 120.504 2.152 . . . . 0.0 113.373 -178.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pp -108.16 -18.07 13.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.111 0.964 . . . . 0.0 112.832 169.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.2 ttp -70.07 -61.78 1.64 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.411 1.484 . . . . 0.0 110.749 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.6 pttt -76.71 15.89 0.58 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.996 0.918 . . . . 0.0 113.385 -171.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -124.96 -43.4 1.98 Allowed 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 129.305 3.042 . . . . 0.0 110.631 -171.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.8 pt -58.48 -37.79 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-N 118.67 0.668 . . . . 0.0 111.553 -177.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.37 -18.53 41.7 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -105.92 -12.22 15.91 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.344 1.857 . . . . 0.0 112.738 -167.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -94.54 -48.2 13.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 124.472 1.109 . . . . 0.0 108.777 162.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 82.7 t -64.33 -37.51 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 O-C-N 120.7 -1.25 . . . . 0.0 111.167 -173.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -83.85 5.35 25.5 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 178.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -109.29 -22.9 11.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.501 1.52 . . . . 0.0 112.756 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -89.23 -85.59 0.2 Allowed 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.798 1.239 . . . . 0.0 111.665 -173.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -142.97 82.67 1.77 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.764 1.226 . . . . 0.0 110.81 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -60.22 -19.29 53.73 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 166.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -72.06 -28.3 63.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.981 2.512 . . . . 0.0 114.755 169.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.88 79.02 12.33 Favored Pre-proline 0 N--CA 1.482 1.174 0 C-N-CA 127.509 2.324 . . . . 0.0 109.6 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.37 168.29 25.15 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.881 3.054 . . . . 0.0 113.769 -167.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -81.1 -171.0 3.0 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.077 1.751 . . . . 0.0 111.704 168.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 70.0 p -139.4 173.38 11.6 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 127.61 2.364 . . . . 0.0 108.959 172.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -66.86 -27.18 67.32 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 120.182 1.355 . . . . 0.0 112.085 -175.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -65.67 -52.73 49.29 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 119.888 -1.757 . . . . 0.0 110.968 166.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -62.26 -48.46 79.83 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 120.623 -1.298 . . . . 0.0 112.372 -173.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.3 pt -59.92 -38.11 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.575 1.079 . . . . 0.0 112.104 173.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.02 -35.61 79.08 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.283 0.947 . . . . 0.0 111.881 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -68.3 -52.36 34.47 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.322 1.049 . . . . 0.0 112.816 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.419 HG21 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -64.84 -32.27 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 O-C-N 121.211 -0.93 . . . . 0.0 111.627 -178.042 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.45 -22.87 66.55 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.149 1.38 . . . . 0.0 112.369 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.1 pttt -79.86 -16.11 56.06 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 175.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -87.73 -12.26 45.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.887 0.875 . . . . 0.0 112.138 -176.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 33' ' ' ILE . 13.7 ptpt -125.92 -21.73 4.3 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -174.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.6 1.07 0.08 OUTLIER Glycine 0 N--CA 1.471 0.976 0 N-CA-C 115.672 1.029 . . . . 0.0 115.672 151.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -86.75 -25.92 24.45 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.41 1.105 . . . . 0.0 113.036 -168.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.6 ptmt 30.56 40.45 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 130.371 3.468 . . . . 0.0 114.474 -173.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.0 p -84.3 156.71 3.62 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 124.489 1.116 . . . . 0.0 109.099 175.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -109.04 169.81 8.45 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.662 2.785 . . . . 0.0 112.646 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -59.17 -32.87 70.3 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.028 1.331 . . . . 0.0 114.079 -172.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -37.53 87.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.022 0.529 . . . . 0.0 110.2 -174.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.0 m -84.31 -44.09 14.15 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 126.584 1.954 . . . . 0.0 109.941 -174.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.91 -31.18 52.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.328 -178.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.13 -36.24 72.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.815 1.646 . . . . 0.0 112.789 174.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -65.77 -27.77 68.54 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.422 0.689 . . . . 0.0 112.097 172.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -84.2 -53.69 5.33 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 124.058 0.943 . . . . 0.0 111.778 -175.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.21 -26.82 19.0 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 118.837 0.744 . . . . 0.0 112.851 174.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.3 -39.78 89.56 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.943 0.897 . . . . 0.0 113.082 175.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -92.41 -22.15 19.81 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -174.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.86 -65.16 0.8 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.49 1.116 . . . . 0.0 111.761 172.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 173.53 15.98 0.02 OUTLIER Glycine 0 CA--C 1.535 1.327 0 N-CA-C 118.024 1.97 . . . . 0.0 118.024 175.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.4 mp -120.72 135.3 24.58 Favored Pre-proline 0 CA--C 1.552 1.028 0 CA-C-N 119.408 1.604 . . . . 0.0 113.077 -166.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.29 -47.99 0.14 Allowed 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 124.333 3.355 . . . . 0.0 113.701 177.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 88.2 p -163.46 -7.75 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.903 2.081 . . . . 0.0 114.126 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.9 m 63.99 -6.59 0.25 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.515 2.726 . . . . 0.0 115.569 -162.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -81.74 -39.21 24.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.82 1.248 . . . . 0.0 110.088 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -91.19 -6.09 53.98 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.374 1.469 . . . . 0.0 114.624 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.5 mtp85 -69.29 -33.09 72.65 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 121.298 -0.876 . . . . 0.0 112.15 161.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -83.45 -63.37 1.37 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.865 2.066 . . . . 0.0 112.384 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.9 mm . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.2 1.8 . . . . 0.0 112.261 -178.061 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 41.1 mt . . . . . 0 CA--C 1.541 0.609 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.3 p -69.91 -169.5 0.26 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.015 1.326 . . . . 0.0 112.581 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -48.44 -24.45 1.27 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.592 1.557 . . . . 0.0 114.627 172.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.67 42.09 0.13 Allowed Glycine 0 CA--C 1.527 0.823 0 CA-C-O 117.518 -1.712 . . . . 0.0 116.081 172.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.37 -12.82 23.57 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 121.431 2.615 . . . . 0.0 113.697 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 pp -112.02 -16.46 13.07 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.915 1.286 . . . . 0.0 113.242 168.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.8 ttt -69.15 -65.92 0.64 Allowed 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.211 1.405 . . . . 0.0 110.17 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.1 pttp -74.05 17.33 0.18 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.599 1.56 . . . . 0.0 113.7 -173.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -128.41 -37.54 1.81 Allowed 'General case' 0 C--O 1.233 0.219 0 C-N-CA 129.205 3.002 . . . . 0.0 111.733 -172.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.1 pt -62.95 -33.19 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.648 1.113 . . . . 0.0 111.514 -178.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.03 -11.24 39.4 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -96.94 -13.35 22.46 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.385 1.874 . . . . 0.0 111.879 -174.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.27 -46.97 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 124.91 1.284 . . . . 0.0 109.473 167.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.23 -36.58 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 119.828 1.194 . . . . 0.0 111.028 -174.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -78.43 -1.63 34.51 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -106.71 -16.67 14.43 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.63 1.572 . . . . 0.0 113.03 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -96.41 -88.93 0.27 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.874 0.87 . . . . 0.0 112.331 -172.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -138.76 90.68 2.47 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.719 1.208 . . . . 0.0 110.367 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -57.36 -20.5 29.57 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.71 0.804 . . . . 0.0 113.04 164.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -75.37 -21.66 58.14 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.832 2.453 . . . . 0.0 113.822 171.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -147.81 75.79 10.86 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 127.286 2.235 . . . . 0.0 110.2 -174.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -70.05 162.19 43.16 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.143 2.562 . . . . 0.0 113.1 -170.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -78.34 -166.43 0.84 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.33 1.452 . . . . 0.0 110.943 169.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.9 m -149.85 172.43 15.17 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.205 1.802 . . . . 0.0 109.61 173.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.411 ' CG ' ' HE ' ' A' ' 43' ' ' ARG . 23.7 p30 -62.55 -31.47 72.27 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -171.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -65.03 -50.89 64.46 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.078 -1.639 . . . . 0.0 110.67 165.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.95 -50.97 70.0 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 120.677 -1.264 . . . . 0.0 112.531 -173.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.7 pt -59.23 -37.27 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 119.363 0.983 . . . . 0.0 112.366 174.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.72 -35.6 80.29 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.403 1.001 . . . . 0.0 111.973 176.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -67.49 -53.25 30.37 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.202 1.001 . . . . 0.0 112.745 -178.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.428 HG21 ' HE3' ' A' ' 37' ' ' LYS . 2.6 mt -63.81 -32.36 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 O-C-N 121.42 -0.8 . . . . 0.0 111.449 -177.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.86 -21.65 66.55 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.031 1.332 . . . . 0.0 112.522 175.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.5 ptmt -80.84 -15.37 56.56 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 175.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -88.33 -12.31 43.81 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.821 0.849 . . . . 0.0 112.267 -177.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.428 ' HE3' HG21 ' A' ' 33' ' ' ILE . 13.9 ptpt -126.75 -22.51 3.87 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -173.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.33 1.83 0.07 OUTLIER Glycine 0 N--CA 1.469 0.899 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 152.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -88.91 -34.65 16.86 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.395 1.097 . . . . 0.0 112.017 -168.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.8 ptmt 27.12 53.61 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 129.15 2.98 . . . . 0.0 112.486 -170.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.2 p -88.16 142.76 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 126.372 1.869 . . . . 0.0 108.858 168.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.32 169.87 11.91 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 129.384 3.073 . . . . 0.0 113.291 175.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.411 ' HE ' ' CG ' ' A' ' 27' ' ' ASP . 0.7 OUTLIER -64.14 -28.85 70.04 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 125.681 1.592 . . . . 0.0 114.39 -171.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -35.14 69.7 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.795 1.18 . . . . 0.0 111.132 -175.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.2 m -77.43 -48.65 16.65 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 125.816 1.646 . . . . 0.0 108.589 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.29 -30.9 51.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.82 -175.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.67 -43.65 72.09 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 126.311 1.844 . . . . 0.0 111.594 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -66.99 -25.64 66.41 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 173.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -79.4 -46.47 17.51 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.666 0.787 . . . . 0.0 112.673 -178.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.408 ' HE ' ' HB3' ' A' ' 27' ' ' ASP . 30.8 ptt85 -51.94 -31.68 29.91 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.765 1.166 . . . . 0.0 111.821 170.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -77.89 -23.51 48.72 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 178.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.9 ptm -93.05 -26.99 17.25 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.573 1.079 . . . . 0.0 112.823 177.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.2 mp -73.73 -74.63 0.17 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.994 1.318 . . . . 0.0 111.322 172.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 176.12 14.53 0.02 OUTLIER Glycine 0 CA--C 1.537 1.44 0 N-CA-C 118.253 2.061 . . . . 0.0 118.253 178.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.9 mt -112.27 126.39 28.48 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 119.556 1.678 . . . . 0.0 111.773 -173.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.29 -70.36 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 124.143 3.229 . . . . 0.0 110.348 173.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 95.2 p -141.38 -7.05 1.02 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.41 2.284 . . . . 0.0 113.351 174.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.2 m 56.86 -1.58 0.05 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 128.488 2.715 . . . . 0.0 116.088 -161.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -82.45 -39.63 22.28 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 120.309 1.413 . . . . 0.0 110.369 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -73.44 -20.62 60.67 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.2 mtp180 -75.3 -42.54 54.47 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.678 1.191 . . . . 0.0 112.43 167.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -66.15 -58.67 4.92 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.231 1.812 . . . . 0.0 112.835 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 C--O 1.254 1.308 0 C-N-CA 125.498 1.519 . . . . 0.0 114.441 -169.432 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 63.9 mtt 52.5 37.33 22.64 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.951 2.1 . . . . 0.0 114.091 175.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 32.4 mt -65.71 174.16 2.47 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.729 2.012 . . . . 0.0 115.107 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.7 p -71.19 -168.95 0.34 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.381 1.472 . . . . 0.0 112.683 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -48.48 -25.22 1.56 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.581 1.552 . . . . 0.0 114.556 172.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.7 40.11 0.14 Allowed Glycine 0 CA--C 1.529 0.929 0 CA-C-O 117.688 -1.618 . . . . 0.0 116.063 174.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.98 -14.06 31.56 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 121.435 2.618 . . . . 0.0 113.364 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pp -111.34 -16.87 13.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.87 1.268 . . . . 0.0 113.278 168.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 9.5 ttm -67.65 -67.05 0.49 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.351 1.46 . . . . 0.0 110.031 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.0 pttp -74.45 18.76 0.15 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.59 1.556 . . . . 0.0 113.712 -172.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -128.8 -38.4 1.68 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 129.53 3.132 . . . . 0.0 111.158 -172.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -61.99 -35.57 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 CA-C-N 119.447 1.021 . . . . 0.0 111.441 -177.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.57 -13.11 28.11 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -177.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -91.59 -17.44 25.59 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 126.855 2.062 . . . . 0.0 111.579 -174.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.29 -46.32 9.73 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 C-N-CA 124.95 1.3 . . . . 0.0 109.727 169.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 87.9 t -64.66 -35.81 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 119.923 1.238 . . . . 0.0 111.091 -175.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -83.74 5.07 26.11 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -112.28 -16.28 13.0 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.471 1.909 . . . . 0.0 113.445 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -94.71 -86.83 0.28 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.152 0.981 . . . . 0.0 111.708 -173.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -139.69 85.11 2.02 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.26 1.424 . . . . 0.0 109.669 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -59.4 -17.99 35.15 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.491 1.116 . . . . 0.0 113.574 172.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -87.74 -7.95 56.67 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 126.607 1.963 . . . . 0.0 113.852 174.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -146.72 71.12 12.6 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 127.438 2.295 . . . . 0.0 110.456 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -69.37 160.49 49.6 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.874 2.383 . . . . 0.0 113.332 -168.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -76.6 -174.25 2.88 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.143 1.377 . . . . 0.0 111.004 167.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -134.0 169.62 16.85 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.078 1.751 . . . . 0.0 110.131 173.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -55.64 -31.34 62.25 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 176.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -68.24 -54.38 18.05 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 119.836 -1.79 . . . . 0.0 110.932 167.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -62.17 -47.48 84.32 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.793 -1.192 . . . . 0.0 112.702 -173.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 pt -59.63 -38.75 77.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.752 1.16 . . . . 0.0 112.061 172.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.2 -34.99 77.52 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.656 1.116 . . . . 0.0 112.055 176.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -68.2 -54.26 19.09 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.213 1.005 . . . . 0.0 112.819 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.8 mt -63.2 -32.89 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-N 119.063 0.847 . . . . 0.0 111.452 -177.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mp -63.3 -20.09 65.17 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.155 1.382 . . . . 0.0 112.855 176.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 ptmt -81.53 -14.89 56.35 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.706 0.803 . . . . 0.0 112.646 173.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -88.21 -11.73 45.87 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.247 0.619 . . . . 0.0 112.361 -176.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.2 pttt -129.06 -27.3 2.51 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.81 6.24 0.04 OUTLIER Glycine 0 N--CA 1.471 0.997 0 CA-C-N 120.592 1.542 . . . . 0.0 116.941 160.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -99.3 -39.86 8.21 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.527 1.163 . . . . 0.0 111.361 -168.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.418 ' HB3' ' HE3' ' A' ' 40' ' ' LYS 0.29 0.0 OUTLIER 37.85 51.06 1.33 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 128.138 2.575 . . . . 0.0 111.776 179.617 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.1 p -91.66 139.88 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 111.592 -2.549 . . . . 0.0 109.194 171.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.09 165.61 18.37 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 128.857 2.863 . . . . 0.0 112.414 176.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.57 -26.6 68.67 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 125.589 1.555 . . . . 0.0 113.981 -177.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -34.38 76.62 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.835 0.854 . . . . 0.0 111.31 -177.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.0 m -84.91 -47.5 10.24 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 127.222 2.209 . . . . 0.0 109.948 -176.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.78 -28.33 42.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.949 -173.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.03 -47.39 80.43 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 125.672 1.589 . . . . 0.0 111.06 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -67.92 -18.27 64.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.106 1.362 . . . . 0.0 112.443 179.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -89.58 -50.35 6.13 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.48 1.512 . . . . 0.0 112.84 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -22.26 47.45 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.687 1.13 . . . . 0.0 112.144 172.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -69.49 -44.18 71.67 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.951 0.9 . . . . 0.0 112.871 170.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.9 ptp -83.31 -31.57 26.78 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -172.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 mp -65.64 -63.48 1.08 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.426 1.09 . . . . 0.0 111.205 175.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.96 8.07 0.03 OUTLIER Glycine 0 CA--C 1.536 1.372 0 N-CA-C 118.227 2.051 . . . . 0.0 118.227 171.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.5 mt -90.96 125.19 59.68 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 119.629 1.714 . . . . 0.0 111.217 -173.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.74 -53.25 0.28 Allowed 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.016 2.477 . . . . 0.0 110.78 175.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.2 p -158.89 -10.99 0.07 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 163.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 56.3 m 61.72 -18.4 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 128.293 2.637 . . . . 0.0 116.071 -164.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -67.11 -42.0 85.27 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 120.476 1.489 . . . . 0.0 109.012 168.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -25.09 54.02 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.993 0.917 . . . . 0.0 113.263 -178.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.9 mtm180 -72.2 -42.82 65.37 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.412 1.485 . . . . 0.0 112.302 169.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -69.49 -58.77 3.56 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.051 1.74 . . . . 0.0 113.229 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.8 tp . . . . . 0 C--O 1.254 1.309 0 C-N-CA 125.985 1.714 . . . . 0.0 114.43 -168.099 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.666 0 C4'-C3'-C2' 100.046 -3.154 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.455 0 O4'-C1'-N19 110.714 3.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.62 1 O4'-C1'-N19 111.801 5.001 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.967 0 O4'-C1'-N19 110.786 3.733 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.751 0 O4'-C1'-N19 110.063 2.829 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.728 0 P-O3'-C3' 123.214 2.928 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.146 0 O4'-C1'-N19 110.747 3.683 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.176 0 P-O3'-C3' 122.937 2.697 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . 0.419 ' H41' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.778 1 O4'-C1'-N19 112.199 5.498 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . 0.409 ' H1 ' ' H41' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.535 1 C4'-C3'-C2' 99.054 -4.146 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.409 -3.363 0 O4'-C1'-N19 110.765 3.707 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.298 0 O4'-C4'-C3' 109.084 3.484 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 0 P-O3'-C3' 123.453 3.127 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.097 0 C4'-C3'-C2' 100.129 -3.071 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.177 0 N19-C1'-C2' 109.051 -3.218 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.063 0 C3'-C2'-C1' 106.388 2.634 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.46 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.339 0 P-O3'-C3' 123.951 3.542 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.46 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.326 0 C3'-C2'-C1' 106.029 2.378 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . 0.409 ' H41' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.683 1 O4'-C1'-N19 111.89 5.112 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . 0.419 ' H1 ' ' H41' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.171 2 O4'-C1'-N19 117.526 12.158 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.607 0 C5'-C4'-C3' 110.89 -2.54 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.591 0 N19-C1'-C2' 110.437 -2.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.871 0 O4'-C4'-C3' 108.975 3.375 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.134 0 P-O3'-C3' 123.288 2.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.756 0 O4'-C4'-C3' 108.101 2.501 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.286 0 P-O3'-C3' 123.701 3.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.105 0 O4'-C4'-C3' 108.226 2.626 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.953 0 P-O3'-C3' 122.425 2.271 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.5 p80 . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.765 0.316 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -137.12 -37.48 0.64 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.974 1.31 . . . . 0.0 112.402 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 35.9 mt -93.07 177.78 5.95 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.755 1.622 . . . . 0.0 113.639 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.2 p -71.29 -173.49 0.88 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.701 1.2 . . . . 0.0 112.158 170.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -51.23 -24.46 4.4 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.23 1.412 . . . . 0.0 114.791 175.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.77 39.12 0.21 Allowed Glycine 0 C--N 1.341 0.841 0 CA-C-O 117.61 -1.661 . . . . 0.0 115.954 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.8 -15.82 23.51 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 120.831 2.316 . . . . 0.0 113.137 177.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pp -108.92 -18.4 13.69 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.959 1.303 . . . . 0.0 112.795 170.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.405 ' C ' ' H ' ' A' ' 11' ' ' LEU . 1.4 ttt -73.38 -59.45 2.71 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.541 1.536 . . . . 0.0 111.255 -176.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -76.32 19.2 0.26 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.777 1.231 . . . . 0.0 113.005 -174.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' A' ' 9' ' ' MET . 3.2 mm? -130.57 -38.93 1.3 Allowed 'General case' 0 C--O 1.233 0.223 0 C-N-CA 129.703 3.201 . . . . 0.0 110.992 -170.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.6 pt -64.04 -34.32 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 CA-C-N 119.07 0.85 . . . . 0.0 111.359 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.93 -13.83 43.61 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -93.22 -18.33 22.64 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.48 1.912 . . . . 0.0 111.847 -171.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.95 -48.8 10.99 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.165 0 C-N-CA 124.568 1.147 . . . . 0.0 108.933 168.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.0 t -65.55 -34.6 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 119.961 1.255 . . . . 0.0 111.407 -172.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -81.56 3.22 25.81 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.42 -7.71 9.69 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.153 1.781 . . . . 0.0 114.186 -176.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -100.53 -85.76 0.41 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.838 0.855 . . . . 0.0 112.296 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -136.88 87.77 2.31 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.913 1.285 . . . . 0.0 110.98 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -58.12 -23.82 56.45 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.959 0.904 . . . . 0.0 112.777 166.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -27.49 62.88 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 128.365 2.666 . . . . 0.0 113.914 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -148.29 75.63 10.45 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 127.122 2.169 . . . . 0.0 110.116 -170.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.2 161.48 45.83 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.14 2.56 . . . . 0.0 112.533 -170.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -78.7 -176.22 4.79 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.539 1.136 . . . . 0.0 110.964 167.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 55.1 p -137.43 169.59 17.52 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.098 1.759 . . . . 0.0 110.527 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -56.01 -32.1 63.68 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -67.16 -55.29 14.79 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 120.226 -1.546 . . . . 0.0 110.813 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -61.83 -49.29 76.88 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 120.786 -1.196 . . . . 0.0 112.866 -173.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.9 pt -59.07 -38.53 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 119.484 1.038 . . . . 0.0 112.183 173.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.56 -35.22 78.8 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.803 1.183 . . . . 0.0 111.827 176.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -68.89 -53.19 22.51 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.422 1.089 . . . . 0.0 112.947 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.404 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.8 mt -64.16 -32.86 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 O-C-N 121.321 -0.862 . . . . 0.0 111.433 -177.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.13 -24.69 67.3 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.242 1.417 . . . . 0.0 112.385 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -78.83 -15.75 57.98 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -88.35 -11.65 45.67 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.677 0.791 . . . . 0.0 112.105 -176.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.404 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.8 ptpt -126.58 -21.63 4.09 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -174.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.16 2.32 0.08 OUTLIER Glycine 0 N--CA 1.472 1.055 0 N-CA-C 115.992 1.157 . . . . 0.0 115.992 151.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -89.0 -22.24 23.1 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.3 1.05 . . . . 0.0 113.671 -167.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.01 28.96 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 130.398 3.479 . . . . 0.0 115.673 -175.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.416 ' CG2' ' HB ' ' A' ' 45' ' ' THR . 3.3 p -82.77 141.73 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 121.391 0.615 . . . . 0.0 109.348 -173.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.17 164.95 16.08 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.07 2.548 . . . . 0.0 112.719 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.2 -31.18 68.78 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 125.45 1.5 . . . . 0.0 114.354 -175.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -36.6 78.97 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.205 0.911 . . . . 0.0 110.693 -176.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.416 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 2.6 m -77.41 -47.5 19.64 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 126.492 1.917 . . . . 0.0 109.455 -176.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.25 -29.34 45.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.064 -175.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.06 -35.35 69.28 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.561 1.545 . . . . 0.0 112.287 178.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -67.5 -30.93 70.74 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.398 0.679 . . . . 0.0 111.841 172.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -77.08 -46.07 24.87 Favored 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 123.154 0.582 . . . . 0.0 112.423 -172.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.19 -29.5 14.2 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 175.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -74.0 -37.42 64.42 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.52 0.728 . . . . 0.0 112.515 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -87.28 -23.87 24.53 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -175.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.41 -62.82 1.27 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.265 1.026 . . . . 0.0 111.387 169.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 165.84 3.98 0.04 OUTLIER Glycine 0 CA--C 1.537 1.464 0 N-CA-C 118.029 1.972 . . . . 0.0 118.029 170.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 28.4 mt -84.2 131.33 51.16 Favored Pre-proline 0 CA--C 1.547 0.835 0 CA-C-N 119.371 1.585 . . . . 0.0 111.169 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.6 -63.96 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.737 2.958 . . . . 0.0 110.797 172.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 85.1 p -150.69 -11.9 0.24 Allowed 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.254 1.575 . . . . 0.0 115.254 168.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 73.6 m 61.06 -13.36 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 128.456 2.702 . . . . 0.0 116.184 -166.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -69.11 -40.29 78.42 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.823 1.649 . . . . 0.0 109.263 167.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.65 -20.42 46.73 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -76.25 -38.86 55.72 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.175 1.39 . . . . 0.0 112.174 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -68.83 -58.64 3.9 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.851 1.661 . . . . 0.0 112.133 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.256 1.397 0 C-N-CA 125.596 1.558 . . . . 0.0 114.349 -169.105 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.665 0 C4'-C3'-C2' 100.134 -3.066 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.484 0 O4'-C1'-N19 110.735 3.669 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.91 1 O4'-C1'-N19 112.631 6.039 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.363 0 O4'-C1'-N19 110.758 3.697 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.661 0 P-O3'-C3' 122.691 2.493 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.476 0 P-O3'-C3' 122.86 2.633 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.137 0 O4'-C1'-N19 110.449 3.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.331 0 P-O3'-C3' 123.191 2.909 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.54 1 O4'-C1'-N19 111.232 4.29 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.472 1 C4'-C3'-C2' 99.054 -4.146 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.652 1 O4'-C1'-N19 111.397 4.496 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.674 0 O4'-C4'-C3' 108.638 3.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.402 0 P-O3'-C3' 124.002 3.585 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.383 0 C4'-C3'-C2' 100.038 -3.162 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.176 0 N19-C1'-C2' 109.415 -2.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.426 0 C3'-C2'-C1' 106.763 2.902 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.48 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.328 0 C4'-C3'-C2' 99.523 -3.677 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.48 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.382 0 C3'-C2'-C1' 106.685 2.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . 0.442 " H2'" ' C8 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.658 1 O4'-C1'-N19 113.118 6.648 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . 0.442 ' C8 ' " H2'" ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.574 2 O4'-C1'-N19 117.357 11.946 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.361 1 O4'-C1'-N19 111.101 4.126 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.394 0 C3'-C2'-C1' 105.686 2.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.593 0 O4'-C4'-C3' 108.312 2.712 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.097 0 C4'-C3'-C2' 100.043 -3.157 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.334 0 O4'-C4'-C3' 108.504 2.904 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.348 0 P-O3'-C3' 123.811 3.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.393 0 O4'-C4'-C3' 108.64 3.04 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.984 0 C4'-C3'-C2' 100.781 -2.419 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 121.193 0.52 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -72.9 72.32 1.1 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.555 1.542 . . . . 0.0 111.461 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 41.8 mt -48.55 176.51 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 128.197 2.599 . . . . 0.0 114.018 158.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.8 p -72.8 -165.5 0.22 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.444 1.498 . . . . 0.0 112.797 -176.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -50.56 -23.66 2.69 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.76 51.78 0.09 OUTLIER Glycine 0 C--N 1.341 0.816 0 CA-C-O 118.438 -1.201 . . . . 0.0 114.783 168.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -64.3 -13.34 49.31 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.096 1.948 . . . . 0.0 114.282 -177.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.7 pp -105.48 -19.71 13.7 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.979 0.912 . . . . 0.0 113.263 166.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.5 ttt -72.39 -59.22 2.84 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.041 1.737 . . . . 0.0 111.006 -176.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.7 pttt -76.53 15.45 0.62 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.659 1.184 . . . . 0.0 113.255 -174.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -126.34 -39.89 2.01 Favored 'General case' 0 C--N 1.34 0.182 0 C-N-CA 129.326 3.05 . . . . 0.0 111.064 -171.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.4 pt -63.09 -34.04 64.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 119.084 0.856 . . . . 0.0 111.708 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.05 -17.48 40.2 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 176.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -97.48 -13.96 21.41 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 127.02 2.128 . . . . 0.0 111.913 -169.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.11 -49.22 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.782 1.233 . . . . 0.0 109.158 166.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.64 -39.41 85.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.736 1.153 . . . . 0.0 111.14 -172.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -83.07 5.26 22.97 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -113.98 -15.61 12.29 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.66 1.584 . . . . 0.0 113.508 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -89.33 -83.86 0.23 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.851 1.26 . . . . 0.0 111.552 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -136.01 95.68 3.26 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 122.702 1.239 . . . . 0.0 112.153 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -56.5 -14.21 2.92 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.783 1.633 . . . . 0.0 114.53 171.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -118.25 8.32 12.26 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.036 1.735 . . . . 0.0 114.962 171.795 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -140.58 79.13 20.46 Favored Pre-proline 0 N--CA 1.484 1.236 0 C-N-CA 125.667 1.587 . . . . 0.0 110.87 161.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -71.83 163.84 37.6 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 123.678 2.919 . . . . 0.0 113.209 -172.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -90.22 175.75 7.01 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.859 1.264 . . . . 0.0 111.157 168.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.7 p -129.45 169.78 14.52 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 126.256 1.822 . . . . 0.0 109.834 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.2 p30 -56.62 -34.42 67.23 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -67.64 -52.4 38.61 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 120.23 -1.544 . . . . 0.0 110.709 168.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -61.52 -50.83 71.12 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.783 -1.198 . . . . 0.0 112.462 -173.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.5 pt -59.46 -38.02 72.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 119.265 0.939 . . . . 0.0 112.036 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.56 -35.2 77.11 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.409 1.004 . . . . 0.0 111.79 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -69.56 -52.99 21.1 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.578 1.151 . . . . 0.0 112.796 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.406 HG23 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -64.41 -32.95 59.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 O-C-N 121.269 -0.894 . . . . 0.0 111.53 -177.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mp -63.58 -23.26 67.31 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.521 1.529 . . . . 0.0 112.207 176.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -80.03 -15.02 58.08 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -87.85 -11.76 46.87 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.68 0.792 . . . . 0.0 112.055 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.406 ' HE3' HG23 ' A' ' 33' ' ' ILE . 13.9 ptpt -127.34 -23.03 3.59 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -173.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.7 1.24 0.07 OUTLIER Glycine 0 N--CA 1.47 0.914 0 N-CA-C 115.948 1.139 . . . . 0.0 115.948 152.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -89.89 -27.36 19.94 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 118.43 1.115 . . . . 0.0 112.869 -167.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 29.19 40.87 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 130.426 3.491 . . . . 0.0 114.205 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -82.66 139.57 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.618 0.767 . . . . 0.0 108.995 -177.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.6 158.21 31.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 127.471 2.308 . . . . 0.0 111.971 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.63 -29.69 64.75 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.398 1.479 . . . . 0.0 113.596 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -65.24 -37.42 87.19 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.003 1.321 . . . . 0.0 111.25 -175.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.3 m -82.25 -52.3 7.08 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 128.261 2.624 . . . . 0.0 109.701 -177.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.84 -29.27 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.027 -171.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.87 -52.55 62.66 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.377 1.471 . . . . 0.0 110.241 175.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -72.5 -9.59 58.74 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.917 -174.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.85 -45.83 11.19 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.537 1.135 . . . . 0.0 112.732 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -55.37 -24.16 28.14 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.348 0.976 . . . . 0.0 112.847 176.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.2 tt0 -62.56 -50.2 72.28 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.785 1.234 . . . . 0.0 112.937 175.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.4 ptt? -84.51 -26.29 28.2 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -169.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 mt -70.58 -57.65 4.52 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.622 1.169 . . . . 0.0 112.129 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.38 5.8 0.02 OUTLIER Glycine 0 CA--C 1.535 1.338 0 N-CA-C 118.194 2.038 . . . . 0.0 118.194 173.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.9 mt -107.22 134.18 20.03 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 119.411 1.606 . . . . 0.0 111.857 -169.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.43 -66.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.485 2.79 . . . . 0.0 109.842 169.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.2 p -150.08 -3.51 0.37 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.749 2.02 . . . . 0.0 113.247 167.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 52.4 m 55.4 -4.08 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 128.987 2.915 . . . . 0.0 116.235 -165.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.9 ttt85 -79.2 -42.57 25.73 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.17 1.388 . . . . 0.0 109.309 176.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -73.99 -21.04 60.15 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.736 1.215 . . . . 0.0 113.62 174.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -73.87 -41.29 62.42 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.604 1.162 . . . . 0.0 111.981 168.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -72.4 -59.72 2.59 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.85 1.66 . . . . 0.0 113.176 -178.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.254 1.335 0 C-N-CA 126.023 1.729 . . . . 0.0 114.386 -167.899 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.155 0 O4'-C1'-N19 110.073 2.841 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.451 0 O4'-C1'-N19 110.566 3.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 1 O4'-C1'-N19 111.081 4.101 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.812 0 O4'-C1'-N19 110.878 3.847 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.325 0 O4'-C1'-N19 109.924 2.654 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.576 0 P-O3'-C3' 123.898 3.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.234 0 P-O3'-C3' 123.135 2.862 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.142 0 P-O3'-C3' 122.994 2.745 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.729 1 O4'-C1'-N19 111.139 4.174 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.449 1 C4'-C3'-C2' 98.817 -4.383 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.51 1 O4'-C1'-N19 111.079 4.099 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.432 0 O4'-C4'-C3' 108.829 3.229 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.188 0 P-O3'-C3' 123.761 3.384 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.331 0 C4'-C3'-C2' 99.888 -3.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.69 0 N19-C1'-C2' 109.339 -3.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.3 0 C3'-C2'-C1' 107.002 3.073 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.45 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.349 0 O4'-C4'-C3' 109.374 3.774 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.45 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.411 -3.197 0 O4'-C4'-C3' 108.91 3.31 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.679 0 P-O3'-C3' 123.272 2.977 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.065 1 O4'-C1'-N19 115.393 9.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.776 0 O4'-C1'-N19 110.865 3.831 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.599 0 O4'-C4'-C3' 109.104 3.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.5 0 O4'-C4'-C3' 109.038 3.438 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.222 0 C4'-C3'-C2' 100.309 -2.891 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.666 0 O4'-C1'-N19 109.905 2.631 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.407 0 P-O3'-C3' 123.523 3.185 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.203 0 P-O3'-C3' 123.291 2.992 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.98 0 P-O3'-C3' 122.724 2.52 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 39.7 m80 . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 17.2 tpt 59.44 -59.72 0.05 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.428 2.291 . . . . 0.0 112.365 -157.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 42.1 mt -104.24 -179.83 4.06 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 127.843 2.457 . . . . 0.0 112.496 173.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.1 p -71.96 -168.55 0.39 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.882 1.273 . . . . 0.0 112.2 175.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -49.65 -25.4 2.83 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.238 1.415 . . . . 0.0 114.387 172.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.68 43.3 0.15 Allowed Glycine 0 C--N 1.341 0.835 0 CA-C-O 117.857 -1.524 . . . . 0.0 115.563 174.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -63.86 -11.13 24.82 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.625 2.213 . . . . 0.0 113.973 -179.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.7 pp -110.61 -17.81 13.32 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.732 1.213 . . . . 0.0 113.136 167.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.41 ' C ' ' H ' ' A' ' 11' ' ' LEU . 2.2 ttp -71.4 -63.15 1.17 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.573 1.549 . . . . 0.0 110.595 -178.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.0 pttt -73.07 18.07 0.11 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.054 1.342 . . . . 0.0 113.791 -174.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.41 ' H ' ' C ' ' A' ' 9' ' ' MET . 3.4 mm? -127.52 -43.72 1.57 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 129.621 3.168 . . . . 0.0 110.909 -171.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.5 pt -60.74 -36.42 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 119.082 0.855 . . . . 0.0 111.564 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.29 -18.77 41.16 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -96.48 -20.86 18.09 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.812 2.045 . . . . 0.0 111.908 -167.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -96.7 -50.15 11.64 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.166 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 169.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.3 t -65.02 -35.88 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 O-C-N 120.597 -1.315 . . . . 0.0 111.19 -171.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -80.22 -2.66 45.88 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.0 t30 -109.38 -19.57 13.22 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.721 1.609 . . . . 0.0 113.072 -175.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -91.4 -89.62 0.17 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.766 0.826 . . . . 0.0 111.734 -169.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -141.02 82.71 1.85 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.698 1.199 . . . . 0.0 110.051 -177.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.9 mtmm -60.62 -21.66 62.94 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.18 0.992 . . . . 0.0 113.261 173.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -69.79 -25.55 63.84 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 128.033 2.533 . . . . 0.0 115.04 167.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -143.1 70.81 18.42 Favored Pre-proline 0 N--CA 1.479 1.015 0 C-N-CA 127.645 2.378 . . . . 0.0 109.742 -176.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.48 166.49 29.67 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.585 2.857 . . . . 0.0 113.502 -165.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -78.68 -170.94 2.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.073 1.349 . . . . 0.0 111.011 164.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.1 m -149.88 175.94 11.19 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.389 1.476 . . . . 0.0 110.048 169.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 27.1 p30 -57.41 -31.05 65.46 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -66.86 -53.02 36.66 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.331 -1.481 . . . . 0.0 110.666 167.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -66.77 -43.07 84.99 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 120.621 -1.299 . . . . 0.0 113.275 -172.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.7 pt -60.04 -40.0 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-N 120.164 1.347 . . . . 0.0 111.912 171.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.18 -34.89 77.3 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 120.06 1.3 . . . . 0.0 112.28 173.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -67.63 -53.61 26.53 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.796 1.639 . . . . 0.0 112.459 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.8 mt -66.66 -32.8 59.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 121.373 -0.83 . . . . 0.0 111.406 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.92 -24.06 66.73 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.161 0.985 . . . . 0.0 112.131 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 pttm -80.01 -15.18 57.76 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -87.65 -12.96 43.97 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.899 0.88 . . . . 0.0 112.294 -178.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -126.33 -20.51 4.42 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -173.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.13 -0.13 0.08 OUTLIER Glycine 0 N--CA 1.47 0.923 0 N-CA-C 115.812 1.085 . . . . 0.0 115.812 151.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -89.24 -31.47 17.87 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 118.634 1.217 . . . . 0.0 112.728 -167.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 28.55 43.69 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 130.338 3.455 . . . . 0.0 114.018 -171.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -81.25 142.31 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -82.92 163.55 21.02 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 128.365 2.666 . . . . 0.0 111.98 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -56.68 -36.17 69.29 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.909 1.283 . . . . 0.0 113.807 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -66.58 -32.41 73.73 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.356 1.062 . . . . 0.0 111.175 -169.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.5 m -80.93 -52.02 7.91 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.643 2.777 . . . . 0.0 109.842 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.35 -30.81 50.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.268 1.027 . . . . 0.0 110.949 -173.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.49 -37.18 74.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.107 2.163 . . . . 0.0 112.255 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.6 mtmm -79.56 -14.95 58.49 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -82.77 -40.27 20.69 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.3 ptt-85 -52.86 -26.28 14.19 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 175.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.9 -39.99 75.88 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.413 1.085 . . . . 0.0 112.957 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 23.9 ptp -80.25 -23.48 40.79 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.2 mt -81.54 -61.42 1.94 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.113 1.365 . . . . 0.0 111.981 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.31 5.25 0.05 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 118.035 1.974 . . . . 0.0 118.035 168.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.0 mt -95.05 128.7 38.0 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 119.492 1.646 . . . . 0.0 111.452 -172.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -73.12 -49.36 0.23 Allowed 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.526 3.484 . . . . 0.0 113.445 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.3 p -139.84 -68.41 0.42 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.739 1.616 . . . . 0.0 109.88 169.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 62.8 m 121.2 -20.3 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.005 1 C-N-CA 134.351 5.06 . . . . 0.0 110.747 -164.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -74.78 -41.12 60.63 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.083 2.153 . . . . 0.0 109.697 174.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.17 -21.31 43.2 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.708 0.803 . . . . 0.0 112.948 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -69.76 -32.78 71.48 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.909 1.284 . . . . 0.0 112.055 173.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -82.46 -59.92 2.37 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.085 1.754 . . . . 0.0 113.16 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 C--O 1.253 1.25 0 C-N-CA 125.932 1.693 . . . . 0.0 114.64 -163.596 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.582 0 C4'-C3'-C2' 100.018 -3.182 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.537 0 N19-C1'-C2' 109.325 -3.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.8 1 O4'-C1'-N19 111.742 4.927 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.979 0 O4'-C1'-N19 110.626 3.533 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.026 0 O5'-C5'-C4' 114.485 3.061 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.412 0 P-O3'-C3' 124.052 3.627 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.117 0 O4'-C1'-N19 110.771 3.714 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.258 0 P-O3'-C3' 123.336 3.03 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.536 0 O4'-C1'-N19 110.978 3.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . 0.419 ' H1 ' ' H41' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.175 0 C4'-C3'-C2' 99.293 -3.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.409 -3.376 0 O4'-C1'-N19 110.638 3.547 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.442 0 O4'-C4'-C3' 108.977 3.377 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.27 0 P-O3'-C3' 123.911 3.509 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.356 0 C4'-C3'-C2' 99.955 -3.245 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.692 0 N19-C1'-C2' 108.953 -3.279 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.415 0 C3'-C2'-C1' 106.956 3.04 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.462 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.426 0 O4'-C4'-C3' 109.213 3.613 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.462 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.128 0 O4'-C4'-C3' 108.217 2.617 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . 0.484 " H2'" ' C8 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.324 1 O4'-C1'-N19 112.836 6.295 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . 0.484 ' C8 ' " H2'" ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.433 2 O4'-C1'-N19 116.719 11.148 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.853 0 O4'-C1'-N19 110.876 3.845 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.528 0 O4'-C4'-C3' 109.122 3.522 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.438 0 O4'-C4'-C3' 109.17 3.57 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.99 0 C4'-C3'-C2' 100.315 -2.885 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.566 0 O4'-C1'-N19 109.889 2.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.232 0 P-O3'-C3' 123.567 3.223 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.124 0 P-O3'-C3' 122.684 2.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.948 0 P-O3'-C3' 122.632 2.444 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 111.363 0.135 . . . . 0.0 111.363 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.2 mmt 48.76 37.08 8.99 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 127.036 2.134 . . . . 0.0 114.962 169.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 35.4 mt -64.62 173.06 2.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.494 1.918 . . . . 0.0 115.258 -177.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.1 p -71.83 -168.78 0.39 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 125.374 1.47 . . . . 0.0 112.671 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -49.04 -24.79 1.69 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.284 1.434 . . . . 0.0 114.469 173.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.92 46.25 0.12 Allowed Glycine 0 C--N 1.341 0.835 0 CA-C-O 118.228 -1.318 . . . . 0.0 115.552 170.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.21 -17.13 39.28 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.822 2.311 . . . . 0.0 113.175 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pp -109.33 -18.7 13.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.632 1.173 . . . . 0.0 112.582 170.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.7 ttm -71.18 -63.11 1.17 Allowed 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.586 1.555 . . . . 0.0 110.274 -175.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.3 pttm -76.61 18.99 0.29 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.564 1.145 . . . . 0.0 113.547 -172.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -128.3 -39.02 1.73 Allowed 'General case' 0 C--O 1.233 0.229 0 C-N-CA 129.706 3.202 . . . . 0.0 110.726 -171.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -65.03 -35.45 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.027 0.831 . . . . 0.0 111.696 -176.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.82 -11.93 54.66 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -92.92 -17.95 23.37 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 127.297 2.239 . . . . 0.0 111.825 -170.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.15 -46.28 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 125.056 1.342 . . . . 0.0 109.671 168.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.4 t -65.99 -36.19 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-N 119.58 1.082 . . . . 0.0 111.309 -173.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -78.97 -1.19 34.19 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -107.11 -15.82 14.58 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.701 1.6 . . . . 0.0 112.998 -177.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -98.45 -93.06 0.25 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.781 0.832 . . . . 0.0 112.386 -170.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -136.38 92.09 2.74 Favored 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 124.63 1.172 . . . . 0.0 110.372 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.0 mttt -58.56 -20.38 46.18 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.737 0.815 . . . . 0.0 112.938 166.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.58 -20.46 60.61 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 127.745 2.418 . . . . 0.0 113.919 170.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -146.85 72.7 12.45 Favored Pre-proline 0 N--CA 1.477 0.877 0 C-N-CA 127.457 2.303 . . . . 0.0 109.754 -176.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.62 155.44 68.91 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.835 2.357 . . . . 0.0 112.4 -168.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -75.54 169.1 18.76 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.676 0.75 . . . . 0.0 110.19 164.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.1 p -124.63 168.55 12.99 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.359 1.464 . . . . 0.0 109.746 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.8 p30 -53.92 -32.13 52.54 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 175.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -67.98 -55.04 14.15 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 119.616 -1.927 . . . . 0.0 110.726 167.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -61.08 -50.05 74.85 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 120.81 -1.181 . . . . 0.0 112.784 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.1 pt -59.54 -37.76 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 119.856 1.207 . . . . 0.0 112.278 173.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.54 -35.14 78.5 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.508 1.049 . . . . 0.0 111.74 177.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -68.39 -52.53 31.98 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.413 1.085 . . . . 0.0 112.7 -178.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.428 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -64.3 -32.69 58.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 121.347 -0.846 . . . . 0.0 111.621 -177.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -65.01 -21.67 66.88 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.631 1.572 . . . . 0.0 112.67 176.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -80.09 -15.55 56.9 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -86.39 -13.96 44.82 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 123.132 0.573 . . . . 0.0 111.926 -176.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.428 ' HE3' HG22 ' A' ' 33' ' ' ILE . 15.3 ptpt -130.15 -26.36 2.37 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 116.93 2.196 . . . . 0.0 116.93 -167.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 165.26 10.35 0.03 OUTLIER Glycine 0 N--CA 1.471 1.007 0 N-CA-C 117.126 1.61 . . . . 0.0 117.126 163.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -112.12 -36.11 5.44 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 118.895 1.347 . . . . 0.0 112.385 -167.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.27 1.4 ttpt 40.3 43.84 1.51 Allowed 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 128.33 2.652 . . . . 0.0 113.095 175.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.5 p -91.44 144.44 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.842 2.057 . . . . 0.0 109.129 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.54 170.73 10.25 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.612 2.765 . . . . 0.0 112.853 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -59.73 -33.84 72.15 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 125.694 1.598 . . . . 0.0 114.052 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -38.34 85.87 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.73 1.212 . . . . 0.0 111.278 -172.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.6 m -86.68 -47.96 8.7 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 127.137 2.175 . . . . 0.0 109.036 -172.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.15 -31.65 54.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.667 -174.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.57 -46.94 74.36 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 125.597 1.559 . . . . 0.0 111.118 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -68.06 -20.01 64.93 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.414 1.086 . . . . 0.0 112.595 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -82.78 -48.3 10.96 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.072 0.949 . . . . 0.0 112.072 178.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -54.53 -29.8 51.78 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 119.906 1.23 . . . . 0.0 112.08 171.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -71.91 -38.04 69.97 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.384 1.074 . . . . 0.0 113.364 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 15.0 ptm -84.97 -28.37 25.84 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.8 mp -69.76 -64.05 0.96 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.106 0.962 . . . . 0.0 111.478 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.47 2.59 0.03 OUTLIER Glycine 0 CA--C 1.538 1.509 0 N-CA-C 118.516 2.166 . . . . 0.0 118.516 175.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.6 mt -90.23 132.16 36.6 Favored Pre-proline 0 CA--C 1.547 0.85 0 CA-C-N 119.59 1.695 . . . . 0.0 110.912 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.73 -62.05 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.503 2.802 . . . . 0.0 110.594 173.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.4 p -151.9 -7.71 0.22 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 164.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 72.0 m 58.45 -16.45 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 127.872 2.469 . . . . 0.0 116.272 -166.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 -66.37 -43.01 87.15 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.14 1.376 . . . . 0.0 108.402 167.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -22.69 52.91 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.192 0.997 . . . . 0.0 113.587 -178.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.9 mtp180 -74.31 -42.99 58.57 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.208 1.403 . . . . 0.0 111.796 170.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -72.33 -59.24 2.83 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.497 1.519 . . . . 0.0 112.694 -176.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.784 1.634 . . . . 0.0 114.469 -169.266 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.645 0 C4'-C3'-C2' 100.049 -3.151 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.578 0 O4'-C4'-C3' 108.492 2.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.66 1 O4'-C1'-N19 111.74 4.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.817 1 O4'-C1'-N19 111.037 4.046 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . 0.42 ' H1 ' ' N4 ' ' C' ' 87' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.277 0 P-O3'-C3' 123.411 3.092 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.632 0 P-O3'-C3' 123.161 2.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.892 0 O4'-C1'-N19 110.592 3.49 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.053 0 P-O3'-C3' 123.157 2.881 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . 0.414 ' H41' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.535 1 O4'-C1'-N19 111.355 4.444 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.341 1 C4'-C3'-C2' 99.062 -4.138 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.314 0 O4'-C1'-N19 110.653 3.567 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.506 0 O4'-C4'-C3' 108.722 3.122 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.197 0 P-O3'-C3' 123.74 3.367 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.344 0 C4'-C3'-C2' 100.14 -3.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.754 0 N19-C1'-C2' 109.064 -3.21 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.236 0 C3'-C2'-C1' 106.946 3.033 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.444 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.217 0 O4'-C4'-C3' 109.497 3.897 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.444 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.221 0 O4'-C4'-C3' 108.92 3.32 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.788 1 O4'-C1'-N19 111.873 5.091 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . 0.414 ' H1 ' ' H41' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.297 2 O4'-C1'-N19 118.03 12.788 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.153 1 O4'-C1'-N19 111.171 4.213 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.569 0 C3'-C2'-C1' 105.601 2.072 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.545 0 O4'-C4'-C3' 109.172 3.572 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . 0.42 ' N4 ' ' H1 ' ' B' ' 68' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.234 0 C4'-C3'-C2' 99.685 -3.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.741 0 O4'-C4'-C3' 108.38 2.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.08 0 P-O3'-C3' 123.343 3.036 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.348 0 O4'-C4'-C3' 108.287 2.687 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.187 0 P-O3'-C3' 122.559 2.382 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 . . . . . 0 N--CA 1.484 1.262 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 96.0 mmm -111.5 -28.08 8.32 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -160.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 18.4 mt -79.25 165.08 23.6 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -160.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.0 p -74.56 -170.4 1.02 Allowed 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.191 175.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.03 -26.81 1.95 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.349 1.46 . . . . 0.0 114.663 172.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -170.55 38.09 0.18 Allowed Glycine 0 C--N 1.34 0.77 0 CA-C-O 117.608 -1.662 . . . . 0.0 115.688 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.1 -13.77 19.53 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.902 2.351 . . . . 0.0 113.26 176.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 pp -107.75 -18.56 13.79 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.176 0.99 . . . . 0.0 112.976 168.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.3 ttt -70.09 -62.62 1.31 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.633 1.573 . . . . 0.0 110.301 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.3 pttt -76.78 17.06 0.44 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.04 1.336 . . . . 0.0 113.215 -172.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -129.45 -35.55 1.74 Allowed 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 129.236 3.014 . . . . 0.0 111.482 -171.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pt -61.59 -34.92 63.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 119.291 0.95 . . . . 0.0 111.312 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.0 -12.39 36.02 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -93.2 -17.89 23.18 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 127.125 2.17 . . . . 0.0 111.819 -174.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.51 -48.51 11.19 Favored 'Isoleucine or valine' 0 C--N 1.341 0.229 0 C-N-CA 124.863 1.265 . . . . 0.0 109.427 169.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 72.8 t -63.03 -39.26 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 119.671 1.123 . . . . 0.0 111.013 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -82.1 5.09 20.65 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -111.58 -15.48 13.48 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.312 1.845 . . . . 0.0 113.583 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -94.95 -86.25 0.29 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.341 1.056 . . . . 0.0 111.874 -174.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -139.7 87.95 2.21 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.85 1.26 . . . . 0.0 110.107 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -54.35 -27.63 37.42 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.441 1.096 . . . . 0.0 112.8 169.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -81.18 -12.93 59.07 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.035 2.134 . . . . 0.0 114.175 177.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -146.51 73.65 12.76 Favored Pre-proline 0 N--CA 1.481 1.11 0 C-N-CA 127.43 2.292 . . . . 0.0 110.514 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -73.11 167.95 26.01 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.07 2.513 . . . . 0.0 113.408 -169.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -88.29 -175.29 4.97 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.464 1.505 . . . . 0.0 111.619 171.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.6 p -139.98 171.64 13.9 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.798 2.039 . . . . 0.0 110.166 176.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.0 p-10 -48.04 -48.4 33.06 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -62.48 -48.74 78.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.293 -1.504 . . . . 0.0 110.449 174.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -63.22 -49.8 72.75 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 120.849 -1.157 . . . . 0.0 112.545 -174.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.6 pt -59.36 -38.16 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.322 0.964 . . . . 0.0 112.437 173.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.83 -35.85 77.58 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.387 0.994 . . . . 0.0 111.658 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -68.77 -52.83 26.17 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.502 1.121 . . . . 0.0 112.853 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.406 HG23 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -64.36 -32.65 58.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.337 -0.852 . . . . 0.0 111.793 -177.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mp -62.64 -23.81 67.28 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.504 1.522 . . . . 0.0 112.451 174.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -79.19 -15.67 57.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 176.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -86.95 -12.94 46.09 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.465 0.706 . . . . 0.0 112.08 -176.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.406 ' HE3' HG23 ' A' ' 33' ' ' ILE . 14.2 ptpt -127.56 -21.28 3.82 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -172.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.2 1.91 0.07 OUTLIER Glycine 0 N--CA 1.471 0.991 0 N-CA-C 116.05 1.18 . . . . 0.0 116.05 151.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -91.29 -21.36 21.1 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.355 1.077 . . . . 0.0 113.803 -165.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.05 28.12 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 130.531 3.532 . . . . 0.0 115.62 -175.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.422 ' CG2' ' HB ' ' A' ' 45' ' ' THR . 3.6 p -84.06 141.29 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 121.49 0.662 . . . . 0.0 109.254 -170.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.0 166.23 15.23 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 128.412 2.685 . . . . 0.0 112.562 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 44.2 ttp85 -58.77 -32.19 69.06 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 125.767 1.627 . . . . 0.0 114.263 -173.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -65.05 -39.68 93.64 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.142 0.972 . . . . 0.0 111.5 -174.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.422 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 1.9 m -77.85 -49.6 13.93 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 127.345 2.258 . . . . 0.0 108.943 -175.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -31.1 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.825 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.412 -173.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.6 -37.88 67.99 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.874 1.67 . . . . 0.0 111.961 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -68.95 -22.71 64.11 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 175.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -84.62 -47.99 9.96 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.316 1.047 . . . . 0.0 112.423 -176.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.6 ptm85 -54.78 -28.37 48.35 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.337 0.971 . . . . 0.0 112.28 171.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -72.91 -34.24 66.5 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.925 0.89 . . . . 0.0 112.914 176.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.8 ptt? -92.17 -29.39 16.5 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 mp -67.17 -63.93 0.96 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.82 0.848 . . . . 0.0 111.264 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.88 3.22 0.03 OUTLIER Glycine 0 CA--C 1.538 1.471 0 N-CA-C 118.414 2.126 . . . . 0.0 118.414 173.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 47.6 mt -79.54 128.26 75.56 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-N 119.826 1.813 . . . . 0.0 111.038 -176.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -50.29 -68.87 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 125.213 3.942 . . . . 0.0 112.34 165.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.3 m 165.66 106.64 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.174 1 C-N-CA 134.638 5.175 . . . . 0.0 105.395 167.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.6 m -42.33 -5.53 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 131.128 3.771 . . . . 0.0 119.122 -169.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -70.38 -15.76 62.89 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.972 1.309 . . . . 0.0 112.116 167.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -118.53 -11.93 9.86 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -69.07 -50.41 48.63 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.713 0.688 . . . . 0.0 112.516 169.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -74.11 -56.16 5.25 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.011 1.724 . . . . 0.0 113.267 -171.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.256 1.404 0 C-N-CA 126.291 1.836 . . . . 0.0 114.339 -167.848 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.825 0 C4'-C3'-C2' 100.19 -3.01 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.514 0 O4'-C4'-C3' 108.261 2.661 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 1 O4'-C1'-N19 112.119 5.399 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.388 0 O4'-C1'-N19 110.099 2.874 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.445 0 P-O3'-C3' 122.805 2.587 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.177 0 P-O3'-C3' 122.979 2.733 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.054 0 O4'-C1'-N19 110.566 3.458 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.273 0 P-O3'-C3' 123.1 2.834 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.58 1 O4'-C1'-N19 111.323 4.404 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.555 1 C4'-C3'-C2' 99.097 -4.103 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.243 0 O4'-C1'-N19 110.876 3.845 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.343 0 O4'-C4'-C3' 108.901 3.301 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.249 0 P-O3'-C3' 123.588 3.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.345 0 C4'-C3'-C2' 99.803 -3.397 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.643 0 N19-C1'-C2' 108.848 -3.345 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.429 0 C3'-C2'-C1' 106.797 2.926 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.446 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.432 0 O4'-C4'-C3' 109.31 3.71 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.446 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.535 3.055 0 O4'-C4'-C3' 108.458 2.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.241 1 O4'-C1'-N19 111.951 5.189 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.822 2 O4'-C1'-N19 117.801 12.502 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.061 1 O4'-C1'-N19 111.229 4.286 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.296 0 C3'-C2'-C1' 105.589 2.064 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.315 0 O4'-C4'-C3' 108.706 3.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.125 0 P-O3'-C3' 123.219 2.933 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.494 0 O4'-C4'-C3' 108.384 2.784 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.881 0 P-O3'-C3' 123.569 3.224 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.052 0 O4'-C4'-C3' 108.354 2.754 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.85 0 P-O3'-C3' 122.548 2.373 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 52.1 p-80 . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 121.033 0.444 . . . . 0.0 111.702 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 60.0 ttm -138.23 -40.0 0.53 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.27 1.428 . . . . 0.0 113.223 -174.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 21.2 mt -74.7 171.74 13.38 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.811 1.244 . . . . 0.0 114.141 -176.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.6 p -74.03 -168.96 0.68 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.416 1.486 . . . . 0.0 112.55 177.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -48.64 -25.05 1.57 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.82 1.648 . . . . 0.0 114.667 172.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.73 45.65 0.12 Allowed Glycine 0 C--N 1.341 0.817 0 CA-C-O 118.073 -1.404 . . . . 0.0 115.305 172.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.41 -15.19 34.48 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 120.38 2.09 . . . . 0.0 113.421 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 pp -108.51 -19.18 13.53 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.777 1.231 . . . . 0.0 113.007 169.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.2 ttt -73.9 -58.38 3.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.077 1.751 . . . . 0.0 111.442 -174.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.6 pttt -76.99 17.1 0.46 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.405 1.082 . . . . 0.0 112.971 -173.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -125.65 -43.93 1.85 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 129.908 3.283 . . . . 0.0 110.359 -170.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.9 pt -61.51 -36.45 73.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 118.344 0.52 . . . . 0.0 111.91 -177.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.07 -17.79 41.95 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 177.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -96.96 -15.45 21.12 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 127.117 2.167 . . . . 0.0 112.003 -168.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -102.04 -47.97 11.1 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 C-N-CA 124.63 1.172 . . . . 0.0 109.013 166.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.1 t -65.64 -35.77 76.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 119.903 1.229 . . . . 0.0 111.635 -172.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -82.03 4.7 21.89 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -118.95 -9.96 9.96 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.309 1.844 . . . . 0.0 114.042 -177.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -101.52 -82.62 0.47 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.97 0.908 . . . . 0.0 112.139 -174.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -139.22 84.11 1.98 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.526 1.13 . . . . 0.0 111.089 -173.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -58.31 -25.07 61.45 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.161 0.984 . . . . 0.0 113.181 171.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -16.66 56.03 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 127.152 2.181 . . . . 0.0 114.956 172.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -147.53 76.07 11.02 Favored Pre-proline 0 N--CA 1.479 1.025 0 C-N-CA 126.769 2.028 . . . . 0.0 110.126 -178.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -69.18 162.28 42.42 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.041 2.494 . . . . 0.0 112.86 -171.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -79.68 -173.13 3.65 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.731 1.212 . . . . 0.0 110.756 167.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.3 p -138.03 168.19 20.22 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.995 1.318 . . . . 0.0 111.154 171.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.2 p30 -52.1 -30.99 28.64 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 175.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -68.11 0.32 Allowed 'General case' 0 C--N 1.333 -0.124 0 O-C-N 120.322 -1.486 . . . . 0.0 110.08 165.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -57.5 -49.33 76.65 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.222 1.009 . . . . 0.0 112.86 -170.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.4 pt -59.32 -37.29 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 119.193 0.906 . . . . 0.0 112.166 174.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.15 -34.62 78.47 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.862 1.21 . . . . 0.0 111.878 175.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -68.02 -53.47 25.61 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.235 1.014 . . . . 0.0 112.604 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.401 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -63.73 -32.68 57.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 121.572 -0.705 . . . . 0.0 111.617 -176.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.98 -23.1 67.21 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.394 1.477 . . . . 0.0 112.295 175.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -80.25 -15.77 56.23 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -86.24 -13.08 47.89 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.604 0.762 . . . . 0.0 112.163 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.401 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.0 ptpt -127.17 -21.99 3.83 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -172.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.54 2.6 0.07 OUTLIER Glycine 0 N--CA 1.47 0.916 0 N-CA-C 115.97 1.148 . . . . 0.0 115.97 151.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -89.38 -21.93 22.83 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 118.265 1.032 . . . . 0.0 113.443 -167.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.49 30.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 130.368 3.467 . . . . 0.0 115.298 -176.244 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.1 p -83.0 138.43 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 121.576 0.703 . . . . 0.0 109.238 -172.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.05 159.92 28.43 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 127.72 2.408 . . . . 0.0 112.21 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.83 -29.73 63.09 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.261 1.424 . . . . 0.0 113.543 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -32.27 72.71 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.61 1.164 . . . . 0.0 111.722 -175.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.1 m -87.14 -48.64 7.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.104 2.562 . . . . 0.0 110.059 -177.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.24 -30.11 49.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.096 -174.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.21 -37.96 86.81 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.223 1.409 . . . . 0.0 111.042 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -75.34 -17.94 60.12 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.456 1.102 . . . . 0.0 112.311 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.74 -50.13 7.41 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.46 1.104 . . . . 0.0 112.635 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.81 -23.58 18.85 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 175.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -68.78 -43.74 75.12 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.0 1.32 . . . . 0.0 112.585 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -87.63 -28.14 22.06 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -173.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.26 -59.21 3.16 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.319 1.048 . . . . 0.0 111.695 177.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.92 4.52 0.03 OUTLIER Glycine 0 CA--C 1.534 1.257 0 N-CA-C 118.312 2.085 . . . . 0.0 118.312 170.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 35.3 mt -91.81 121.47 67.01 Favored Pre-proline 0 CA--C 1.545 0.754 0 CA-C-N 120.014 1.907 . . . . 0.0 111.047 -173.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.94 -58.07 0.16 Allowed 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.382 2.721 . . . . 0.0 110.204 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.7 p -150.81 -8.87 0.25 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 160.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 77.4 p 60.61 -15.86 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 128.878 2.871 . . . . 0.0 116.151 -166.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 63.3 ttt180 -71.61 -43.74 65.68 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.345 1.458 . . . . 0.0 109.351 167.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -22.34 61.02 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -178.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -74.69 -39.5 61.94 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.776 1.63 . . . . 0.0 112.149 169.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -74.11 -59.09 2.88 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.568 1.547 . . . . 0.0 112.931 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.725 2.01 . . . . 0.0 114.483 -167.505 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.602 0 C4'-C3'-C2' 100.199 -3.001 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.401 0 O4'-C1'-N19 110.239 3.049 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.537 1 O4'-C1'-N19 112.072 5.34 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.859 0 O4'-C1'-N19 110.533 3.416 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.538 0 P-O3'-C3' 122.795 2.579 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.247 0 P-O3'-C3' 123.116 2.846 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 1 O4'-C1'-N19 111.01 4.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.356 0 P-O3'-C3' 122.997 2.747 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . 0.423 ' H41' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.643 1 O4'-C1'-N19 111.072 4.09 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.72 1 O4'-C4'-C3' 109.627 4.027 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.196 0 P-O3'-C3' 124.37 3.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.682 0 O4'-C4'-C3' 108.838 3.238 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 0 P-O3'-C3' 123.592 3.243 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.2 0 C4'-C3'-C2' 99.799 -3.401 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.729 0 N19-C1'-C2' 109.277 -3.077 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.317 0 C3'-C2'-C1' 106.82 2.943 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.496 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.333 0 C4'-C3'-C2' 99.697 -3.503 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.496 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.611 0 O4'-C4'-C3' 108.593 2.993 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.952 1 O4'-C1'-N19 111.58 4.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . 0.423 ' H1 ' ' H41' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.337 2 O4'-C1'-N19 116.432 10.79 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.666 0 N19-C1'-C2' 118.19 2.494 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.557 0 O4'-C4'-C3' 108.337 2.737 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.571 0 O4'-C4'-C3' 109.311 3.711 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.154 0 P-O3'-C3' 122.967 2.723 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.332 0 O4'-C4'-C3' 108.536 2.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.836 0 P-O3'-C3' 123.46 3.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.879 0 O4'-C4'-C3' 108.424 2.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.801 0 P-O3'-C3' 122.691 2.492 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.3 p-80 . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 121.231 0.539 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 28.1 ttt -147.39 -46.72 0.17 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.268 1.427 . . . . 0.0 112.444 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 25.6 mt -72.73 171.39 12.68 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -171.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.8 p -73.88 -170.56 0.92 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.337 1.455 . . . . 0.0 112.245 176.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -49.23 -25.44 2.29 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.589 1.555 . . . . 0.0 114.599 172.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -171.68 40.66 0.17 Allowed Glycine 0 C--N 1.343 0.918 0 CA-C-O 117.682 -1.621 . . . . 0.0 115.682 175.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.61 -13.96 26.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 120.815 2.307 . . . . 0.0 113.467 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 pp -108.72 -18.86 13.61 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.385 1.074 . . . . 0.0 113.151 168.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.404 ' C ' ' H ' ' A' ' 11' ' ' LEU . 1.4 ttp -71.64 -61.55 1.74 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.592 1.557 . . . . 0.0 111.104 -177.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.6 pttt -75.17 17.01 0.27 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.305 1.042 . . . . 0.0 113.193 -171.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.404 ' H ' ' C ' ' A' ' 9' ' ' MET . 3.3 mm? -125.4 -45.82 1.79 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 129.82 3.248 . . . . 0.0 110.392 -169.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.0 pt -59.64 -36.85 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt -82.76 -14.6 54.18 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 174.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -90.87 -17.76 25.96 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 125.55 1.54 . . . . 0.0 112.094 -174.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.39 -45.19 11.18 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 C-N-CA 124.167 0.987 . . . . 0.0 109.32 170.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.77 -31.18 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 O-C-N 120.891 -1.131 . . . . 0.0 111.225 -174.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -79.08 -2.39 40.32 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.253 -0.905 . . . . 0.0 112.816 174.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -108.73 -14.46 14.6 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.903 1.681 . . . . 0.0 112.851 -176.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -103.4 -102.59 0.29 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.201 0.909 . . . . 0.0 112.095 -168.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -139.96 80.82 1.79 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.495 1.118 . . . . 0.0 109.896 -172.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -62.62 -17.31 60.05 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 174.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -66.09 -22.29 66.4 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 127.212 2.205 . . . . 0.0 114.623 164.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -142.6 66.22 18.06 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 128.29 2.636 . . . . 0.0 109.637 177.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -70.23 162.0 43.93 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.318 2.679 . . . . 0.0 113.424 -163.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -77.53 170.01 17.3 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.845 0.831 . . . . 0.0 111.106 166.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.8 p -124.69 170.31 11.11 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 126.003 1.721 . . . . 0.0 109.846 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.4 p30 -53.98 -32.65 54.68 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -68.54 -54.67 15.25 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 119.776 -1.827 . . . . 0.0 110.789 168.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -62.55 -47.85 82.06 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 120.704 -1.247 . . . . 0.0 112.714 -173.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.3 pt -58.94 -38.92 76.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-N 119.871 1.214 . . . . 0.0 112.317 172.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.8 -35.41 78.11 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.543 1.065 . . . . 0.0 111.892 176.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -68.87 -52.62 27.69 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.518 1.127 . . . . 0.0 112.74 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.409 HG23 ' HE3' ' A' ' 37' ' ' LYS . 2.7 mt -64.03 -33.18 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 118.841 0.746 . . . . 0.0 111.269 -177.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.13 -24.93 68.12 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.369 1.468 . . . . 0.0 112.486 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -14.82 58.26 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 176.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -86.5 -13.19 46.73 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.436 0.694 . . . . 0.0 112.017 -178.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.409 ' HE3' HG23 ' A' ' 33' ' ' ILE . 14.1 ptpt -126.49 -22.55 3.95 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -172.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.04 2.54 0.08 OUTLIER Glycine 0 N--CA 1.47 0.933 0 CA-C-N 119.562 1.074 . . . . 0.0 115.668 151.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -87.16 -23.12 24.92 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 118.331 1.065 . . . . 0.0 113.303 -168.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.8 30.88 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 130.351 3.461 . . . . 0.0 115.109 -175.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.0 p -82.07 138.55 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.56 0.695 . . . . 0.0 109.226 -174.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.9 161.59 24.31 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 127.894 2.478 . . . . 0.0 112.033 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.63 -27.57 67.89 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 125.386 1.474 . . . . 0.0 113.853 -178.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.28 -32.51 72.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.118 0.967 . . . . 0.0 111.956 -177.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 m -84.09 -51.35 7.15 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 128.298 2.639 . . . . 0.0 109.914 -177.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.57 -29.06 45.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.848 -172.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.6 94.65 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.303 1.441 . . . . 0.0 110.91 176.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -71.43 -16.63 62.39 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.509 0.723 . . . . 0.0 112.487 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -85.97 -51.61 6.25 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.222 1.009 . . . . 0.0 112.267 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -54.36 -25.42 24.19 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.035 0.834 . . . . 0.0 112.679 175.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -68.77 -40.32 79.77 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.331 1.452 . . . . 0.0 113.025 178.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -92.88 -25.44 18.08 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -173.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.2 -60.56 2.17 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.625 1.17 . . . . 0.0 112.013 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 177.17 -0.6 0.03 OUTLIER Glycine 0 CA--C 1.534 1.254 0 N-CA-C 118.141 2.016 . . . . 0.0 118.141 172.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.8 mt -86.85 129.13 53.54 Favored Pre-proline 0 CA--C 1.546 0.794 0 CA-C-N 119.518 1.659 . . . . 0.0 110.628 -177.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.41 -60.02 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.827 2.351 . . . . 0.0 110.387 174.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.5 p -153.27 -7.47 0.17 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 163.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 28.9 m 59.26 -21.55 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.977 2.511 . . . . 0.0 116.199 -164.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.7 ttt85 -67.56 -43.15 81.34 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.923 1.238 . . . . 0.0 108.585 170.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -25.6 60.41 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.3 mtm180 -71.3 -43.47 67.05 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.197 1.399 . . . . 0.0 112.244 169.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -74.19 -61.04 1.99 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.682 1.593 . . . . 0.0 113.31 -176.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.1 tp . . . . . 0 C--O 1.255 1.355 0 C-N-CA 126.515 1.926 . . . . 0.0 114.593 -166.108 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.793 0 C4'-C3'-C2' 100.425 -2.775 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.451 0 N19-C1'-C2' 109.71 -2.806 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.586 1 O4'-C1'-N19 112.198 5.497 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.899 0 O4'-C4'-C3' 108.365 2.765 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.734 0 O4'-C1'-N19 109.871 2.588 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.903 0 P-O3'-C3' 123.293 2.994 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.227 0 O4'-C1'-N19 110.137 2.921 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.101 0 P-O3'-C3' 122.919 2.682 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.684 1 O4'-C1'-N19 111.464 4.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.536 0 C4'-C3'-C2' 99.214 -3.986 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.259 0 O4'-C1'-N19 110.886 3.857 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.426 0 O4'-C4'-C3' 108.875 3.275 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.185 0 P-O3'-C3' 123.8 3.416 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.203 0 C4'-C3'-C2' 100.022 -3.178 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.706 0 N19-C1'-C2' 108.677 -3.452 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.107 0 C3'-C2'-C1' 106.674 2.839 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.446 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.538 0 C4'-C3'-C2' 99.637 -3.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.446 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.415 0 C3'-C2'-C1' 106.629 2.807 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . 0.423 " H2'" ' C8 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.389 1 O4'-C1'-N19 112.565 5.956 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . 0.423 ' C8 ' " H2'" ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.522 2 O4'-C1'-N19 117.244 11.805 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.102 0 O4'-C1'-N19 109.935 2.668 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.69 0 N19-C1'-C2' 110.757 -2.152 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.717 0 O4'-C4'-C3' 109.147 3.547 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.296 0 P-O3'-C3' 122.911 2.675 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.796 0 O4'-C1'-N19 110.174 2.968 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.347 0 P-O3'-C3' 124.343 3.869 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.044 0 P-O3'-C3' 122.843 2.619 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.137 0 P-O3'-C3' 122.61 2.425 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 9.5 p-80 . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.2 mmt -127.75 -22.12 3.62 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.8 mt -123.73 -172.94 2.63 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.986 1.714 . . . . 0.0 113.23 -169.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 42.9 p -72.19 -163.09 0.1 Allowed 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 125.68 1.592 . . . . 0.0 112.635 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -48.16 -25.35 1.44 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.065 1.346 . . . . 0.0 114.335 169.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 176.14 53.96 0.06 OUTLIER Glycine 0 CA--C 1.527 0.808 0 CA-C-O 118.728 -1.04 . . . . 0.0 114.276 168.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -64.87 -13.54 56.66 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.688 1.744 . . . . 0.0 114.202 -175.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pp -106.0 -19.7 13.65 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.218 1.007 . . . . 0.0 113.113 168.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.0 ttp -72.25 -60.21 2.35 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.092 1.757 . . . . 0.0 110.68 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.3 pttp -75.28 15.78 0.41 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.601 1.16 . . . . 0.0 113.459 -173.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -127.03 -41.59 1.78 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 129.404 3.082 . . . . 0.0 111.391 -170.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.0 pt -60.95 -33.83 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 119.069 0.85 . . . . 0.0 112.125 178.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -17.58 44.65 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 175.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -96.71 -13.03 23.01 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 126.439 1.896 . . . . 0.0 111.929 -170.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.28 -48.7 9.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.183 0 C-N-CA 124.482 1.113 . . . . 0.0 108.776 167.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.2 -32.49 57.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 120.282 1.401 . . . . 0.0 111.434 -172.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -78.29 -2.76 39.52 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.381 -0.824 . . . . 0.0 112.893 175.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -117.22 -9.19 11.03 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.432 1.893 . . . . 0.0 113.816 -172.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -102.66 -97.78 0.29 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.003 0.82 . . . . 0.0 112.263 -170.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -137.33 83.21 1.98 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.588 1.155 . . . . 0.0 110.219 -177.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -62.46 -17.96 60.67 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 175.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.409 ' H ' ' HD3' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -79.96 -12.48 59.72 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.814 2.046 . . . . 0.0 114.799 168.491 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -145.06 67.06 13.17 Favored Pre-proline 0 N--CA 1.48 1.075 0 C-N-CA 127.368 2.267 . . . . 0.0 109.624 175.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.15 165.44 32.7 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.956 2.437 . . . . 0.0 112.99 -164.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -77.34 -175.49 3.74 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.684 1.194 . . . . 0.0 111.416 167.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 93.2 p -136.64 170.87 15.35 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.651 1.98 . . . . 0.0 109.634 171.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.5 p30 -54.03 -32.14 53.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 172.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -67.76 -54.11 21.88 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.011 -1.681 . . . . 0.0 110.691 169.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -62.45 -47.93 81.86 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 120.812 -1.18 . . . . 0.0 112.663 -174.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.4 pt -58.97 -39.13 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.625 1.102 . . . . 0.0 112.096 173.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.78 -35.37 79.62 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.578 1.081 . . . . 0.0 111.943 176.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -69.18 -52.34 28.89 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.439 1.096 . . . . 0.0 112.819 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.419 HG21 ' HE3' ' A' ' 37' ' ' LYS . 2.3 mt -64.22 -33.65 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 O-C-N 121.437 -0.789 . . . . 0.0 111.19 -178.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -62.11 -25.65 67.84 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.238 1.415 . . . . 0.0 112.644 176.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -79.01 -15.78 57.79 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -87.21 -12.73 45.96 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 123.446 0.698 . . . . 0.0 112.144 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 33' ' ' ILE . 14.0 ptpt -126.79 -21.48 4.05 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -173.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.79 2.21 0.07 OUTLIER Glycine 0 N--CA 1.472 1.083 0 N-CA-C 115.932 1.133 . . . . 0.0 115.932 153.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -90.42 -19.75 23.57 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 118.334 1.067 . . . . 0.0 113.43 -167.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 35.82 25.17 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 130.699 3.6 . . . . 0.0 116.095 -175.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -81.75 137.93 20.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -169.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.39 158.73 31.13 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.148 2.179 . . . . 0.0 112.093 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -55.64 -30.81 61.63 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.841 1.257 . . . . 0.0 113.243 175.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -66.37 -34.36 77.8 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.117 1.367 . . . . 0.0 111.615 -174.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.8 m -83.66 -51.91 6.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 129.036 2.934 . . . . 0.0 109.882 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.93 -30.93 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.932 -173.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.84 -34.7 77.22 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.862 1.665 . . . . 0.0 111.788 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -84.18 -9.55 58.46 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.416 1.086 . . . . 0.0 112.989 176.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -90.03 -51.37 5.5 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.82 1.248 . . . . 0.0 112.297 176.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -20.31 5.96 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 174.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -65.26 -42.59 93.11 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.761 1.625 . . . . 0.0 113.143 173.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -94.61 -26.33 16.41 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.1 mt -73.73 -59.69 2.6 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.404 1.082 . . . . 0.0 112.166 -179.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.89 -8.47 0.03 OUTLIER Glycine 0 CA--C 1.533 1.213 0 N-CA-C 118.142 2.017 . . . . 0.0 118.142 167.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.4 mt -69.6 121.63 83.04 Favored Pre-proline 0 CA--C 1.542 0.642 0 CA-C-N 119.439 1.62 . . . . 0.0 110.743 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.88 -64.36 0.05 OUTLIER 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.116 2.544 . . . . 0.0 109.308 178.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.1 p -150.94 -10.17 0.24 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.122 1.369 . . . . 0.0 114.422 158.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.3 m 56.85 -17.82 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 128.389 2.676 . . . . 0.0 116.455 -163.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -67.21 -42.34 84.29 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 120.308 1.413 . . . . 0.0 108.743 166.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.81 -22.11 60.87 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -71.27 -46.49 60.8 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.643 1.577 . . . . 0.0 111.667 166.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -75.37 -59.44 2.75 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.515 1.926 . . . . 0.0 113.405 -170.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 C--O 1.253 1.285 0 C-N-CA 127.384 2.274 . . . . 0.0 114.525 -167.596 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.633 0 C4'-C3'-C2' 100.396 -2.804 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.492 1 O4'-C1'-N19 111.133 4.166 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.61 1 O4'-C1'-N19 111.872 5.09 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.944 0 O4'-C1'-N19 110.038 2.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.107 0 P-O3'-C3' 123.609 3.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.703 0 P-O3'-C3' 122.893 2.661 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.145 0 O4'-C1'-N19 110.755 3.694 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.503 0 P-O3'-C3' 123.075 2.812 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.531 0 O4'-C1'-N19 110.571 3.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.073 1 C4'-C3'-C2' 99.076 -4.124 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.276 1 O4'-C1'-N19 111.371 4.463 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.496 0 O4'-C4'-C3' 108.806 3.206 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.314 0 P-O3'-C3' 123.459 3.132 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.411 0 C4'-C3'-C2' 99.774 -3.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.705 0 N19-C1'-C2' 109.288 -3.07 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.281 0 C3'-C2'-C1' 106.731 2.879 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.467 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.127 0 C4'-C3'-C2' 99.586 -3.614 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.467 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.309 0 C3'-C2'-C1' 106.408 2.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.416 0 P-O3'-C3' 123.468 3.14 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.953 1 O4'-C1'-N19 115.781 9.976 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.26 1 O4'-C1'-N19 111.03 4.038 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.583 0 O4'-C4'-C3' 108.961 3.361 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.173 0 O4'-C4'-C3' 108.742 3.142 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.976 0 C4'-C3'-C2' 100.134 -3.066 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C4'-C3' 108.379 2.779 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.261 0 P-O3'-C3' 124.111 3.676 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.912 0 O4'-C4'-C3' 108.291 2.691 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.739 0 P-O3'-C3' 122.596 2.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 . . . . . 0 N--CA 1.484 1.235 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -117.99 -27.51 6.13 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 -160.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.6 mt -86.56 169.14 13.04 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -174.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 60.2 p -73.44 -172.59 1.21 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.035 1.334 . . . . 0.0 111.582 171.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -51.86 -23.58 5.03 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.206 1.402 . . . . 0.0 114.73 172.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.64 29.44 0.24 Allowed Glycine 0 C--N 1.34 0.781 0 CA-C-O 117.339 -1.812 . . . . 0.0 116.939 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -62.01 -10.81 10.86 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 121.784 2.792 . . . . 0.0 113.82 178.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 pp -111.18 -16.89 13.33 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.624 1.17 . . . . 0.0 113.508 166.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 6.3 ttt -68.3 -67.06 0.49 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.224 1.41 . . . . 0.0 110.339 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.9 pttp -73.79 15.88 0.25 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.406 1.482 . . . . 0.0 113.673 -172.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -127.4 -35.15 2.2 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 128.798 2.839 . . . . 0.0 111.822 -172.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -61.3 -29.96 46.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.471 1.032 . . . . 0.0 112.023 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.52 -9.53 23.2 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -178.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -88.74 -16.61 31.78 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 125.64 1.576 . . . . 0.0 111.56 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 pp -101.45 -51.81 9.06 Favored 'Isoleucine or valine' 0 C--N 1.342 0.265 0 C-N-CA 123.974 0.91 . . . . 0.0 108.786 168.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.7 t -63.88 -35.48 73.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 120.378 1.444 . . . . 0.0 111.325 -172.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -80.77 -0.74 39.96 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -109.9 -19.78 12.99 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.752 1.621 . . . . 0.0 112.991 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -93.82 -95.47 0.16 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.741 0.816 . . . . 0.0 112.202 -167.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -139.98 85.53 2.03 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.194 0.998 . . . . 0.0 110.971 -175.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -58.05 -22.34 49.62 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.571 1.149 . . . . 0.0 113.354 168.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 -68.79 -23.83 64.33 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.079 2.152 . . . . 0.0 114.598 169.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -147.29 70.7 11.87 Favored Pre-proline 0 N--CA 1.481 1.115 0 C-N-CA 127.67 2.388 . . . . 0.0 109.771 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -76.82 173.58 14.24 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.167 2.578 . . . . 0.0 113.772 -165.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -89.8 -175.03 4.5 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.832 1.653 . . . . 0.0 112.158 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.7 p -140.08 175.99 9.13 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 126.749 2.02 . . . . 0.0 109.515 172.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 40.3 p-10 -49.28 -47.3 46.88 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 173.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -60.01 -51.17 70.78 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.025 -1.672 . . . . 0.0 110.706 173.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.97 -43.39 83.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 120.934 -1.104 . . . . 0.0 113.366 -174.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 pt -60.07 -39.87 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 120.366 1.439 . . . . 0.0 111.881 171.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.84 -35.76 77.39 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.83 1.195 . . . . 0.0 112.257 174.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -67.66 -51.68 46.99 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.713 1.605 . . . . 0.0 112.323 -178.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.3 mt -67.55 -32.68 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 O-C-N 121.372 -0.83 . . . . 0.0 111.598 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mp -63.53 -23.14 67.27 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.011 1.324 . . . . 0.0 112.022 175.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -82.37 -14.27 55.53 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 176.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -85.3 -13.33 50.03 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.463 0.705 . . . . 0.0 112.135 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -127.38 -21.64 3.82 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -172.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.28 1.37 0.09 OUTLIER Glycine 0 N--CA 1.468 0.83 0 N-CA-C 115.521 0.968 . . . . 0.0 115.521 150.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -85.1 -29.47 24.84 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.405 1.102 . . . . 0.0 112.59 -169.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.3 ptmt 28.84 41.81 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 130.388 3.475 . . . . 0.0 114.185 -173.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.78 139.73 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.305 1.042 . . . . 0.0 108.244 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.71 163.68 24.32 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.103 2.161 . . . . 0.0 112.515 177.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -61.78 -30.15 70.61 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 125.545 1.538 . . . . 0.0 114.205 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -71.96 -31.12 66.0 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.62 1.1 . . . . 0.0 111.791 -175.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 m -79.45 -48.89 13.17 Favored 'General case' 0 CA--C 1.505 -0.761 0 C-N-CA 125.853 1.661 . . . . 0.0 108.848 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -64.79 -32.06 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 CA-C-N 115.003 -0.998 . . . . 0.0 110.615 -176.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.95 -36.92 67.27 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 125.218 1.407 . . . . 0.0 112.354 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -75.64 -15.17 60.36 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.954 1.302 . . . . 0.0 112.655 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -90.28 -49.54 6.48 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.249 1.42 . . . . 0.0 111.991 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -22.8 26.63 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.426 1.012 . . . . 0.0 112.963 169.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -69.15 -45.3 70.41 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.706 1.202 . . . . 0.0 112.683 171.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 13.8 ptt? -87.08 -28.98 22.22 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.917 0.887 . . . . 0.0 113.283 -170.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.3 mp -67.24 -65.52 0.67 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.505 1.122 . . . . 0.0 111.088 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.75 6.55 0.03 OUTLIER Glycine 0 CA--C 1.537 1.407 0 N-CA-C 119.594 2.598 . . . . 0.0 119.594 169.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 59.5 mt -82.91 124.13 77.16 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 120.399 2.099 . . . . 0.0 111.839 -173.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -51.57 -60.9 0.63 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 124.967 3.778 . . . . 0.0 112.852 170.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 90.7 p -162.41 -18.43 0.04 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 165.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 60.8 m 61.41 0.56 0.46 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.464 1.905 . . . . 0.0 115.181 -163.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -85.99 -16.28 38.82 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.797 1.639 . . . . 0.0 111.681 165.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.25 -14.01 9.28 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.311 1.444 . . . . 0.0 114.36 -176.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -70.8 -45.92 63.76 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.12 1.368 . . . . 0.0 112.032 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -76.07 -56.22 4.86 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.706 1.603 . . . . 0.0 112.728 -173.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.254 1.297 0 C-N-CA 126.923 2.089 . . . . 0.0 114.529 -168.543 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.694 0 C4'-C3'-C2' 100.2 -3.0 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.548 0 O4'-C1'-N19 110.881 3.851 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.154 1 O4'-C1'-N19 112.273 5.592 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.53 0 O4'-C4'-C3' 108.689 3.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . 0.442 ' H1 ' ' N4 ' ' C' ' 87' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.533 2.729 0 O5'-C5'-C4' 113.637 2.455 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.128 0 P-O3'-C3' 123.899 3.5 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.861 0 O4'-C1'-N19 110.611 3.513 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.981 0 P-O3'-C3' 122.971 2.726 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.137 1 O4'-C1'-N19 111.434 4.542 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.265 1 C4'-C3'-C2' 98.954 -4.246 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.408 -3.45 0 O4'-C1'-N19 110.79 3.737 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.174 0 O4'-C4'-C3' 108.991 3.391 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 0 P-O3'-C3' 123.411 3.093 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.163 0 C4'-C3'-C2' 99.814 -3.386 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.639 0 N19-C1'-C2' 108.539 -3.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.32 0 C3'-C2'-C1' 107.086 3.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.436 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.268 0 C4'-C3'-C2' 99.602 -3.598 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.436 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.54 0 P-O3'-C3' 122.526 2.355 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.554 1 O4'-C1'-N19 113.744 7.43 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.689 2 O4'-C1'-N19 117.836 12.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.31 1 O4'-C1'-N19 111.288 4.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.307 0 C3'-C2'-C1' 105.624 2.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.387 0 O4'-C4'-C3' 108.642 3.042 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . 0.442 ' N4 ' ' H1 ' ' B' ' 68' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.16 0 C4'-C3'-C2' 100.118 -3.082 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.378 0 O4'-C4'-C3' 108.411 2.811 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.847 0 O4'-C4'-C3' 108.558 2.958 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.275 0 O4'-C4'-C3' 108.572 2.972 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.804 0 P-O3'-C3' 122.694 2.495 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.8 p80 . . . . . 0 N--CA 1.483 1.204 0 CA-C-O 120.891 0.377 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 50.5 mtt -131.86 -47.6 0.95 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.905 1.282 . . . . 0.0 112.428 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 32.1 mt -100.32 177.91 4.91 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.541 1.536 . . . . 0.0 113.334 -174.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 38.9 p -73.44 -164.31 0.19 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.009 1.724 . . . . 0.0 112.571 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -49.06 -24.98 1.79 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.433 1.493 . . . . 0.0 114.468 169.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 178.83 51.23 0.08 OUTLIER Glycine 0 C--N 1.341 0.807 0 CA-C-O 118.598 -1.112 . . . . 0.0 114.53 169.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.64 -13.88 55.7 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.913 1.857 . . . . 0.0 113.947 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 pp -106.37 -19.18 13.77 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.464 1.105 . . . . 0.0 113.106 167.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.5 ttt -72.65 -57.97 3.72 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.322 1.849 . . . . 0.0 111.196 -175.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.0 pttp -77.08 15.71 0.66 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.691 1.196 . . . . 0.0 113.046 -174.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -126.27 -40.91 1.94 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 129.473 3.109 . . . . 0.0 110.899 -170.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 pt -61.68 -37.85 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 118.776 0.717 . . . . 0.0 111.356 -178.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.94 -16.47 50.4 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -98.25 -16.15 19.54 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 126.452 1.901 . . . . 0.0 112.016 -168.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -99.09 -43.5 11.55 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 C-N-CA 124.737 1.215 . . . . 0.0 109.379 167.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.65 -32.09 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 119.818 1.19 . . . . 0.0 111.139 -175.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -77.99 -3.92 44.43 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 121.453 -0.779 . . . . 0.0 112.92 174.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -105.33 -16.24 14.81 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.721 1.608 . . . . 0.0 112.551 -176.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -101.31 -97.48 0.27 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.713 0.688 . . . . 0.0 112.393 -169.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -137.01 87.8 2.31 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.391 1.077 . . . . 0.0 110.13 -177.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -59.79 -17.51 36.18 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.651 1.18 . . . . 0.0 114.163 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -93.87 -2.55 53.23 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.431 1.892 . . . . 0.0 114.595 171.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -142.57 63.94 15.06 Favored Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 127.755 2.422 . . . . 0.0 110.45 174.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -71.21 160.38 49.15 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.274 2.65 . . . . 0.0 112.743 -165.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -74.53 -178.59 3.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.998 0.919 . . . . 0.0 111.066 164.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.5 p -142.84 172.93 12.02 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.387 1.475 . . . . 0.0 109.96 172.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -55.11 -33.53 62.92 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.83 1.418 . . . . 0.0 114.83 -174.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.8 tp60 -67.2 -51.03 58.42 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 120.159 -1.588 . . . . 0.0 110.661 169.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -62.39 -50.56 71.04 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 120.959 -1.088 . . . . 0.0 111.949 -173.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 pt -58.97 -37.82 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.455 1.025 . . . . 0.0 112.424 174.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.86 -34.94 78.42 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.307 0.958 . . . . 0.0 112.047 177.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -69.1 -52.0 32.81 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.413 1.085 . . . . 0.0 112.659 -178.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.401 HG23 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -63.95 -32.88 58.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 O-C-N 121.413 -0.804 . . . . 0.0 111.4 -177.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.74 -22.89 67.14 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.28 1.432 . . . . 0.0 112.736 175.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.7 ptmt -81.31 -14.62 57.14 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.663 -0.648 . . . . 0.0 112.736 175.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -85.93 -14.02 46.0 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.305 0.642 . . . . 0.0 111.969 -178.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.401 ' HE3' HG23 ' A' ' 33' ' ' ILE . 14.1 ptpt -126.66 -22.23 3.95 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -171.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.95 1.99 0.07 OUTLIER Glycine 0 N--CA 1.47 0.961 0 N-CA-C 115.82 1.088 . . . . 0.0 115.82 151.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -87.82 -27.19 22.42 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.314 1.057 . . . . 0.0 112.839 -168.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.0 ptmt 30.49 40.51 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 130.101 3.36 . . . . 0.0 114.253 -173.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.1 p -82.51 141.43 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -82.35 166.35 19.54 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 127.433 2.293 . . . . 0.0 112.449 176.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -64.56 -24.87 67.74 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.309 1.444 . . . . 0.0 114.587 -174.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -70.28 -39.03 75.16 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.16 -0.963 . . . . 0.0 111.948 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.1 m -78.74 -45.82 20.3 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 126.588 1.955 . . . . 0.0 109.003 -175.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.47 -32.5 58.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.093 -176.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.2 -35.92 74.25 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.595 1.558 . . . . 0.0 111.949 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.0 mttm -78.54 -18.95 53.94 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.592 1.157 . . . . 0.0 112.41 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -82.01 -48.44 11.43 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.46 1.104 . . . . 0.0 112.616 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.05 -20.76 10.26 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 175.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -68.54 -46.6 69.1 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.76 1.224 . . . . 0.0 112.822 173.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -82.87 -27.14 30.97 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -173.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.3 mt -70.61 -59.77 2.64 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.476 1.11 . . . . 0.0 111.724 176.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.59 6.04 0.03 OUTLIER Glycine 0 CA--C 1.535 1.305 0 N-CA-C 118.714 2.246 . . . . 0.0 118.714 169.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.8 mt -90.15 126.58 56.53 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 119.898 1.849 . . . . 0.0 111.157 -173.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.48 -52.04 0.29 Allowed 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.447 2.765 . . . . 0.0 111.034 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.1 p -160.68 -10.68 0.05 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.386 1.624 . . . . 0.0 115.386 161.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.6 m 64.63 -19.5 0.08 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 128.059 2.544 . . . . 0.0 115.731 -166.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.8 ttp180 -69.13 -36.94 78.03 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.626 1.171 . . . . 0.0 109.373 171.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -24.71 33.25 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.555 1.142 . . . . 0.0 113.576 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -74.01 -40.07 63.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.212 1.405 . . . . 0.0 112.704 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -63.69 -63.48 1.16 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 126.053 1.741 . . . . 0.0 112.277 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.6 tp . . . . . 0 C--O 1.253 1.267 0 C-N-CA 126.729 2.012 . . . . 0.0 114.357 -167.715 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.758 0 O5'-C5'-C4' 114.267 2.905 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.482 1 O4'-C1'-N19 112.17 5.462 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.659 1 O4'-C1'-N19 111.731 4.914 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.971 0 O4'-C1'-N19 110.714 3.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . 0.453 ' H1 ' ' N4 ' ' C' ' 87' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.081 0 P-O3'-C3' 123.314 3.012 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.151 0 P-O3'-C3' 123.163 2.885 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.931 1 O4'-C1'-N19 111.143 4.179 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.251 0 P-O3'-C3' 123.215 2.929 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.582 1 O4'-C1'-N19 111.013 4.016 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.381 1 C4'-C3'-C2' 98.956 -4.244 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.275 1 O4'-C1'-N19 111.306 4.382 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.401 0 O4'-C4'-C3' 108.857 3.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.217 0 P-O3'-C3' 123.578 3.232 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.317 0 C4'-C3'-C2' 99.847 -3.353 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.761 0 N19-C1'-C2' 108.707 -3.433 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.208 0 O4'-C1'-N19 110.246 3.058 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.495 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.418 0 P-O3'-C3' 123.747 3.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.495 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.362 0 O4'-C4'-C3' 108.649 3.049 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.744 0 O4'-C1'-N19 110.893 3.867 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.096 2 O4'-C1'-N19 117.474 12.093 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.165 0 O4'-C1'-N19 110.393 3.242 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.659 0 O4'-C4'-C3' 109.361 3.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.551 0 O4'-C4'-C3' 108.443 2.843 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . 0.453 ' N4 ' ' H1 ' ' B' ' 68' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.222 0 P-O3'-C3' 123.116 2.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.985 0 O4'-C1'-N19 110.891 3.864 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.503 0 P-O3'-C3' 122.978 2.732 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 0 O4'-C4'-C3' 108.345 2.745 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.927 0 P-O3'-C3' 122.799 2.583 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 119.767 -0.158 . . . . 0.0 111.041 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 10.5 ttt 57.07 15.9 2.64 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 117.384 2.365 . . . . 0.0 117.384 156.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 34.2 mt -61.63 170.41 1.95 Allowed 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 -175.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.7 p -75.15 -167.33 0.6 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.196 1.799 . . . . 0.0 113.004 -177.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -48.75 -24.68 1.49 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.638 1.575 . . . . 0.0 114.697 173.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.69 44.72 0.11 Allowed Glycine 0 C--N 1.341 0.857 0 CA-C-O 117.874 -1.514 . . . . 0.0 115.745 170.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -61.87 -13.98 29.49 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.612 2.206 . . . . 0.0 113.487 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pp -112.33 -17.55 12.7 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.969 1.308 . . . . 0.0 113.228 168.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.5 ttt -72.0 -60.54 2.18 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.198 1.399 . . . . 0.0 111.166 -176.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.3 pttt -75.17 18.86 0.17 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.378 1.071 . . . . 0.0 113.624 -174.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -126.22 -43.77 1.77 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 129.318 3.047 . . . . 0.0 110.168 -171.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.5 pt -63.19 -32.02 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 118.268 0.486 . . . . 0.0 112.078 -173.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.46 -14.85 23.39 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -89.86 -14.28 34.67 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.785 2.034 . . . . 0.0 111.673 -176.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -105.47 -52.38 7.54 Favored 'Isoleucine or valine' 0 C--N 1.341 0.214 0 C-N-CA 124.34 1.056 . . . . 0.0 108.72 167.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.77 -36.88 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 120.608 1.549 . . . . 0.0 111.382 -170.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -87.24 9.28 20.72 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -116.96 -24.35 7.64 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.028 1.731 . . . . 0.0 112.99 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -85.6 -79.32 0.24 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.415 1.086 . . . . 0.0 111.282 -171.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -139.2 86.7 2.15 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.561 1.144 . . . . 0.0 110.747 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -59.68 -19.37 49.15 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.278 1.031 . . . . 0.0 113.615 170.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -16.94 39.03 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 127.217 2.207 . . . . 0.0 114.654 171.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -148.21 72.76 11.07 Favored Pre-proline 0 N--CA 1.481 1.116 0 C-N-CA 127.175 2.19 . . . . 0.0 110.386 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -72.75 168.35 24.79 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.054 2.503 . . . . 0.0 113.236 -170.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -78.93 -173.81 3.71 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.212 1.405 . . . . 0.0 110.629 166.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 91.1 p -133.93 172.54 12.67 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.898 1.679 . . . . 0.0 109.284 171.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -65.76 -23.52 66.75 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.292 -0.88 . . . . 0.0 112.453 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -68.74 -54.15 17.74 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.418 -1.426 . . . . 0.0 110.665 165.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -61.96 -48.0 82.32 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 120.843 -1.161 . . . . 0.0 112.606 -174.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 pt -60.83 -38.61 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-N 119.544 1.066 . . . . 0.0 112.207 173.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.74 -34.48 75.9 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.631 1.105 . . . . 0.0 111.712 177.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -67.81 -55.44 12.98 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.676 1.191 . . . . 0.0 112.886 178.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.9 mt -64.83 -32.54 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 O-C-N 121.463 -0.773 . . . . 0.0 111.167 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.3 -22.64 66.2 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.74 1.216 . . . . 0.0 112.214 176.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 pttm -81.86 -13.03 58.17 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 175.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -90.01 -9.28 49.21 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.503 0.721 . . . . 0.0 112.191 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 pttt -127.61 -23.3 3.47 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 114.862 1.431 . . . . 0.0 114.862 -176.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 154.35 4.53 0.11 Allowed Glycine 0 N--CA 1.471 1.033 0 CA-C-N 119.377 0.99 . . . . 0.0 115.418 151.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -84.46 -31.35 24.61 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 118.148 0.974 . . . . 0.0 111.943 -171.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.1 ptmt 26.11 50.7 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 129.802 3.241 . . . . 0.0 113.01 -172.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.8 p -88.12 140.62 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.648 1.579 . . . . 0.0 108.77 171.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.6 165.33 17.13 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 129.025 2.93 . . . . 0.0 113.309 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -25.62 68.08 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.471 1.908 . . . . 0.0 114.65 -175.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -34.45 75.93 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.823 1.249 . . . . 0.0 110.785 -178.255 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 m -87.18 -47.05 9.19 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 127.407 2.283 . . . . 0.0 110.509 -176.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.23 -28.7 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.875 -173.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.95 -37.23 72.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.176 1.79 . . . . 0.0 113.129 174.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -70.54 -23.65 62.66 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.262 1.025 . . . . 0.0 112.281 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -80.5 -40.72 25.56 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -175.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -55.4 -25.15 34.07 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 118.943 0.792 . . . . 0.0 112.629 174.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -70.15 -38.13 75.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 176.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.5 ptp -81.09 -26.66 36.07 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 mt -73.61 -59.76 2.56 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.345 1.058 . . . . 0.0 111.758 172.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 156.12 15.03 0.05 OUTLIER Glycine 0 CA--C 1.536 1.344 0 N-CA-C 117.648 1.819 . . . . 0.0 117.648 167.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.1 mt -117.49 133.23 23.27 Favored Pre-proline 0 CA--C 1.548 0.874 0 CA-C-N 119.2 1.5 . . . . 0.0 111.328 -167.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -71.74 -52.83 0.19 Allowed 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.926 3.084 . . . . 0.0 113.793 -177.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.9 p -156.35 -9.2 0.1 Allowed 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.6 m 61.78 -13.97 0.05 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.144 2.178 . . . . 0.0 115.568 -166.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -85.23 -36.69 20.79 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.753 1.621 . . . . 0.0 110.476 176.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -20.23 57.7 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 177.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 64.4 mtp85 -70.43 -42.2 71.89 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.047 1.739 . . . . 0.0 111.977 167.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -70.65 -59.17 2.98 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.392 1.877 . . . . 0.0 113.224 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.9 tp . . . . . 0 C--O 1.255 1.355 0 C-N-CA 126.593 1.957 . . . . 0.0 114.595 -166.816 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.613 0 C4'-C3'-C2' 100.374 -2.826 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.548 0 O4'-C1'-N19 110.06 2.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.491 1 O4'-C1'-N19 113.303 6.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.501 0 O4'-C1'-N19 110.604 3.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.733 0 P-O3'-C3' 123.868 3.473 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.495 0 P-O3'-C3' 123.075 2.812 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.092 0 O4'-C1'-N19 110.83 3.788 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.803 0 P-O3'-C3' 123.155 2.879 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . 0.411 ' H41' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.454 0 O4'-C1'-N19 110.87 3.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.536 1 C4'-C3'-C2' 99.016 -4.184 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.533 1 O4'-C1'-N19 111.338 4.422 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.504 0 O4'-C4'-C3' 108.765 3.165 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.405 0 P-O3'-C3' 123.984 3.57 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.385 0 C4'-C3'-C2' 99.974 -3.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.737 0 N19-C1'-C2' 108.782 -3.386 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.394 0 C3'-C2'-C1' 106.883 2.988 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.47 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.47 0 C4'-C3'-C2' 99.566 -3.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.47 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.272 0 C3'-C2'-C1' 106.563 2.759 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . 0.426 " H2'" ' C8 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.53 1 O4'-C1'-N19 112.052 5.315 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . 0.426 ' C8 ' " H2'" ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.535 2.959 2 O4'-C1'-N19 117.638 12.297 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.058 1 O4'-C1'-N19 111.878 5.098 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.804 0 O4'-C4'-C3' 109.538 3.938 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.595 0 C3'-C2'-C1' 106.158 2.47 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.542 0 C4'-C3'-C2' 100.654 -2.546 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.543 0 O4'-C1'-N19 110.469 3.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.248 0 P-O3'-C3' 123.805 3.421 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.229 0 O4'-C4'-C3' 108.239 2.639 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.045 0 P-O3'-C3' 122.599 2.416 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 . . . . . 0 N--CA 1.481 1.079 0 CA-C-O 119.517 -0.277 . . . . 0.0 111.553 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.7 ptt? 48.61 15.79 0.09 Allowed 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 118.238 2.681 . . . . 0.0 118.238 168.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 39.1 mt -54.47 171.57 0.12 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 127.642 2.377 . . . . 0.0 116.605 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.9 p -72.34 -168.11 0.39 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.102 1.761 . . . . 0.0 112.7 -178.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -48.7 -24.4 1.37 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.446 1.498 . . . . 0.0 114.72 172.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.54 41.18 0.11 Allowed Glycine 0 CA--C 1.527 0.817 0 CA-C-O 117.75 -1.583 . . . . 0.0 115.769 173.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -62.63 -13.01 26.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 121.25 2.525 . . . . 0.0 113.871 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pp -109.35 -17.39 13.81 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.692 1.197 . . . . 0.0 113.627 167.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.6 ttt -67.7 -66.01 0.62 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.948 1.299 . . . . 0.0 109.982 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.3 pttp -74.43 17.17 0.21 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.207 1.403 . . . . 0.0 113.829 -172.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -130.03 -34.34 1.69 Allowed 'General case' 0 C--O 1.234 0.289 0 C-N-CA 129.082 2.953 . . . . 0.0 111.946 -172.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -62.8 -34.15 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 119.689 1.131 . . . . 0.0 111.656 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -9.93 41.88 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -178.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -91.13 -15.99 28.52 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.559 1.943 . . . . 0.0 111.943 -175.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -105.03 -47.93 9.4 Favored 'Isoleucine or valine' 0 C--N 1.342 0.252 0 C-N-CA 124.621 1.168 . . . . 0.0 109.337 168.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 63.6 t -66.56 -35.6 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 119.982 1.265 . . . . 0.0 111.249 -172.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -78.84 -0.59 31.23 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.561 -0.712 . . . . 0.0 112.612 176.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -109.65 -13.15 14.56 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.593 1.957 . . . . 0.0 113.544 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -101.92 -89.55 0.36 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.537 0.735 . . . . 0.0 112.531 -170.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -135.67 91.24 2.69 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 122.433 1.111 . . . . 0.0 112.371 -173.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -53.53 -30.98 44.35 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.61 1.564 . . . . 0.0 113.389 170.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.42 -8.69 49.92 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.613 1.965 . . . . 0.0 114.986 177.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -145.49 76.84 12.91 Favored Pre-proline 0 N--CA 1.481 1.114 0 C-N-CA 126.681 1.992 . . . . 0.0 110.345 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -72.02 164.43 35.69 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.796 2.331 . . . . 0.0 112.643 -172.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -78.69 -174.79 4.07 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.488 1.115 . . . . 0.0 110.91 166.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.2 p -136.88 169.87 17.03 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.127 1.771 . . . . 0.0 109.949 172.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.4 p30 -53.06 -33.77 53.48 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 176.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -68.16 -53.56 24.24 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 119.982 -1.698 . . . . 0.0 110.678 169.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.34 -49.12 78.26 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 120.929 -1.107 . . . . 0.0 112.504 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.0 pt -59.64 -38.26 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-N 119.574 1.079 . . . . 0.0 112.222 174.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.94 -35.54 78.74 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.625 1.102 . . . . 0.0 111.829 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -69.26 -53.14 21.31 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.566 1.146 . . . . 0.0 112.656 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.4 HG23 ' HE3' ' A' ' 37' ' ' LYS . 2.4 mt -64.36 -32.74 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.112 0.869 . . . . 0.0 111.53 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 mp -63.11 -22.03 66.59 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.78 1.232 . . . . 0.0 112.181 176.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.3 pttt -79.43 -16.03 56.83 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 174.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -89.57 -11.22 43.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.945 0.898 . . . . 0.0 112.146 -176.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.4 ' HE3' HG23 ' A' ' 33' ' ' ILE . 13.0 ptpt -126.8 -22.32 3.89 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -173.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.46 0.92 0.06 OUTLIER Glycine 0 N--CA 1.472 1.043 0 N-CA-C 116.215 1.246 . . . . 0.0 116.215 153.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -91.45 -30.97 16.18 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.76 1.28 . . . . 0.0 113.159 -166.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt 26.66 50.05 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 129.391 3.076 . . . . 0.0 113.081 -170.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.1 p -86.7 138.45 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.729 1.612 . . . . 0.0 108.849 174.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.54 161.91 26.69 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 128.344 2.658 . . . . 0.0 112.16 177.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -59.44 -27.58 66.2 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.409 1.483 . . . . 0.0 113.513 179.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -66.53 -34.29 77.59 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.405 1.482 . . . . 0.0 111.167 -174.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.0 m -87.1 -48.85 7.73 Favored 'General case' 0 CA--C 1.509 -0.601 0 C-N-CA 128.346 2.658 . . . . 0.0 110.397 -178.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.44 -29.45 46.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.994 -172.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.04 -42.8 80.01 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 125.608 1.563 . . . . 0.0 111.175 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -70.24 -19.61 63.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.775 1.23 . . . . 0.0 112.406 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -87.94 -46.7 9.16 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.634 1.174 . . . . 0.0 113.264 -177.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -22.81 40.94 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.389 0.995 . . . . 0.0 112.557 172.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -72.22 -42.31 65.88 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.661 1.185 . . . . 0.0 112.739 172.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.2 ptm -83.35 -30.14 27.69 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.829 0.852 . . . . 0.0 113.107 -173.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.9 mp -67.65 -67.82 0.43 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.665 1.186 . . . . 0.0 111.061 173.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.18 6.46 0.03 OUTLIER Glycine 0 CA--C 1.536 1.356 0 N-CA-C 118.427 2.131 . . . . 0.0 118.427 172.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.1 mt -84.74 125.42 71.15 Favored Pre-proline 0 CA--C 1.545 0.784 0 CA-C-N 119.87 1.835 . . . . 0.0 110.838 -177.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.6 -53.35 0.36 Allowed 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.923 2.416 . . . . 0.0 110.642 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 82.7 p -161.11 -10.82 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.484 1.514 . . . . 0.0 114.988 162.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.9 m 62.36 -19.71 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.38 2.672 . . . . 0.0 115.752 -165.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -67.75 -44.43 77.53 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.584 1.554 . . . . 0.0 108.688 169.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -22.85 59.24 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -178.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -73.75 -42.3 61.28 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.426 1.49 . . . . 0.0 111.821 170.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -73.61 -58.89 2.99 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.841 1.656 . . . . 0.0 113.036 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.253 1.26 0 C-N-CA 126.127 1.771 . . . . 0.0 114.459 -167.707 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.173 0 O5'-C5'-C4' 114.822 3.302 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.974 0 O4'-C1'-N19 110.825 3.782 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.515 1 O4'-C1'-N19 112.19 5.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.917 1 O4'-C1'-N19 111.087 4.108 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.111 0 O4'-C4'-C3' 108.607 3.007 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.269 0 C5'-C4'-C3' 109.988 -3.141 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.082 1 O4'-C1'-N19 111.405 4.506 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.017 0 P-O3'-C3' 123.238 2.949 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . 0.406 " H2'" ' C8 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.526 1 O4'-C1'-N19 111.072 4.09 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . 0.407 ' H1 ' ' H41' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.225 1 C4'-C3'-C2' 99.017 -4.183 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.224 0 O4'-C1'-N19 110.868 3.836 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.297 0 O4'-C4'-C3' 108.876 3.276 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.409 0 P-O3'-C3' 123.772 3.393 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.365 0 C4'-C3'-C2' 100.044 -3.156 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.694 0 N19-C1'-C2' 108.63 -3.481 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.396 0 C3'-C2'-C1' 107.06 3.114 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.45 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.513 0 O4'-C4'-C3' 109.209 3.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.45 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.39 0 O4'-C4'-C3' 108.812 3.212 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . 0.407 ' H41' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.878 1 O4'-C1'-N19 111.903 5.129 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.89 2 O4'-C1'-N19 117.257 11.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.823 1 O4'-C1'-N19 111.438 4.548 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.29 0 O4'-C4'-C3' 108.735 3.135 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.177 0 O4'-C4'-C3' 108.707 3.107 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.207 0 P-O3'-C3' 122.855 2.629 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.394 1 O4'-C1'-N19 111.083 4.103 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.409 0 O4'-C1'-N19 110.735 3.668 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.462 0 O4'-C4'-C3' 108.394 2.794 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.153 0 P-O3'-C3' 122.516 2.347 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . 0.434 ' HA ' " H4'" ' C' ' 83' ' ' ' DG' . 63.3 m80 . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.057 0.456 . . . . 0.0 112.085 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 80.4 mmm 64.96 11.59 7.17 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.584 2.354 . . . . 0.0 116.762 163.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.5 mt -61.82 165.12 5.55 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 122.134 0.969 . . . . 0.0 113.599 172.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.7 p -73.47 -169.31 0.65 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.705 1.202 . . . . 0.0 112.513 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -48.91 -24.66 1.56 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.554 1.542 . . . . 0.0 114.699 172.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.28 44.21 0.16 Allowed Glycine 0 C--N 1.341 0.841 0 CA-C-O 117.953 -1.471 . . . . 0.0 115.864 172.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -61.41 -14.92 31.91 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.7 2.25 . . . . 0.0 113.47 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 pp -109.97 -17.21 13.66 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.716 1.206 . . . . 0.0 112.814 169.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.402 ' C ' ' H ' ' A' ' 11' ' ' LEU . 1.2 ttt -74.05 -59.17 2.84 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.914 1.686 . . . . 0.0 111.517 -175.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.4 pttt -76.86 19.26 0.3 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.91 1.284 . . . . 0.0 112.918 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' A' ' 9' ' ' MET . 3.4 mm? -128.45 -41.33 1.55 Allowed 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 129.716 3.207 . . . . 0.0 110.574 -170.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 pt -61.33 -37.75 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 118.69 0.677 . . . . 0.0 111.274 -177.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.42 -14.01 44.57 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.715 1.005 . . . . 0.0 113.715 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.7 tp10 -95.21 -19.96 19.62 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 125.972 1.709 . . . . 0.0 111.761 -170.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -98.61 -46.53 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 C-N-CA 124.813 1.245 . . . . 0.0 109.149 169.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.81 -35.44 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.593 1.088 . . . . 0.0 111.324 -173.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -79.01 -2.64 41.24 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 177.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -104.85 -17.64 14.5 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.204 1.801 . . . . 0.0 112.87 -176.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -97.32 -91.73 0.25 Allowed 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.577 0.751 . . . . 0.0 112.256 -169.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -137.18 89.26 2.42 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 125.064 1.346 . . . . 0.0 110.218 177.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.3 mtmm -59.12 -18.81 39.06 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.62 1.168 . . . . 0.0 112.754 167.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -21.47 61.57 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 127.436 2.295 . . . . 0.0 114.051 169.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.5 mtmt -148.73 74.66 10.29 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 127.819 2.448 . . . . 0.0 109.747 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -68.75 161.56 44.89 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.09 2.526 . . . . 0.0 113.011 -169.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -76.5 -172.73 2.27 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.714 1.206 . . . . 0.0 110.671 167.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 59.7 p -136.78 167.51 21.3 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 126.316 1.847 . . . . 0.0 109.457 176.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 51.3 p30 -54.66 -30.96 56.83 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 175.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -68.17 -54.45 17.88 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.0 -1.688 . . . . 0.0 110.702 168.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.71 -47.78 82.13 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 120.659 -1.275 . . . . 0.0 112.757 -173.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.1 pt -59.27 -38.24 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-N 119.518 1.053 . . . . 0.0 112.142 173.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.8 -35.46 79.93 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.647 1.112 . . . . 0.0 112.138 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -67.31 -53.11 32.66 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.651 1.18 . . . . 0.0 112.952 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.425 HG23 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -64.74 -32.42 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 O-C-N 121.567 -0.708 . . . . 0.0 111.657 -176.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.29 -22.36 66.82 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 125.174 1.39 . . . . 0.0 112.149 175.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -81.28 -14.6 57.23 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 175.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -87.57 -11.51 48.47 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.562 0.745 . . . . 0.0 111.992 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.425 ' HE3' HG23 ' A' ' 33' ' ' ILE . 14.1 ptpt -127.49 -22.73 3.6 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -173.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.45 0.5 0.07 OUTLIER Glycine 0 N--CA 1.47 0.931 0 N-CA-C 115.93 1.132 . . . . 0.0 115.93 152.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -89.48 -29.4 19.0 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.426 1.113 . . . . 0.0 112.694 -167.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt 29.03 43.37 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 130.243 3.417 . . . . 0.0 114.181 -173.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.401 ' CG2' ' HB ' ' A' ' 45' ' ' THR . 3.3 p -83.4 144.24 10.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.092 0.957 . . . . 0.0 109.132 175.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.45 165.5 14.29 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.307 2.643 . . . . 0.0 112.806 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.01 -29.5 69.74 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.494 1.518 . . . . 0.0 114.254 -175.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -68.42 -32.11 71.92 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.188 0.904 . . . . 0.0 111.747 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.401 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 2.1 m -84.15 -48.16 10.12 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 127.913 2.485 . . . . 0.0 110.174 -177.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.9 -28.98 44.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.641 -173.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.56 -33.4 72.7 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.804 1.642 . . . . 0.0 111.921 176.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -72.74 -22.5 60.85 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.734 0.814 . . . . 0.0 112.693 174.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -83.49 -44.17 14.99 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.514 0.726 . . . . 0.0 112.909 -174.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.17 -30.65 7.1 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 118.785 0.72 . . . . 0.0 112.926 172.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -72.64 -33.07 66.36 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.195 0.998 . . . . 0.0 112.853 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 23.6 ptt? -94.37 -22.74 18.13 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.861 1.059 . . . . 0.0 113.861 -176.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 mt -72.92 -63.64 1.13 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.148 0.979 . . . . 0.0 111.374 170.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 165.93 -2.78 0.05 OUTLIER Glycine 0 CA--C 1.536 1.349 0 N-CA-C 117.675 1.83 . . . . 0.0 117.675 169.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.8 mt -72.63 128.06 88.98 Favored Pre-proline 0 CA--C 1.547 0.861 0 CA-C-N 119.127 1.463 . . . . 0.0 111.074 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.73 -64.42 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 123.459 2.773 . . . . 0.0 109.887 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 77.2 p -149.04 -10.41 0.33 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.1 1.36 . . . . 0.0 114.58 164.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.9 m 59.24 -14.58 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 128.436 2.694 . . . . 0.0 116.259 -165.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -67.39 -45.21 76.87 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.421 1.489 . . . . 0.0 108.76 165.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -22.34 59.25 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -177.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -73.99 -41.93 61.19 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.543 1.537 . . . . 0.0 111.76 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -73.58 -58.38 3.35 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.441 1.496 . . . . 0.0 113.192 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.253 1.264 0 C-N-CA 126.622 1.969 . . . . 0.0 114.479 -168.031 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.823 0 C4'-C3'-C2' 100.316 -2.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.315 0 O4'-C1'-N19 110.552 3.44 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.508 1 O4'-C1'-N19 112.079 5.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.998 1 O4'-C1'-N19 111.125 4.156 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.679 0 O4'-C1'-N19 109.821 2.526 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.54 0 P-O3'-C3' 123.164 2.887 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.907 0 O4'-C1'-N19 110.487 3.358 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.015 0 P-O3'-C3' 123.165 2.888 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . 0.413 ' H41' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.574 1 O4'-C1'-N19 111.369 4.462 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.529 1 C4'-C3'-C2' 98.9 -4.3 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.39 1 O4'-C1'-N19 111.409 4.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.489 0 O4'-C4'-C3' 108.731 3.131 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.239 0 P-O3'-C3' 123.844 3.453 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.356 0 C4'-C3'-C2' 100.061 -3.139 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.679 0 N19-C1'-C2' 109.035 -3.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.408 0 C3'-C2'-C1' 107.184 3.203 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.479 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.455 0 O4'-C4'-C3' 109.145 3.545 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.479 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.064 0 O4'-C4'-C3' 108.673 3.073 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.465 1 O4'-C1'-N19 112.013 5.266 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . 0.434 " H4'" ' HA ' ' A' ' 1' ' ' HIS . . . . . . . . 0 C5'--C4' 1.535 3.002 3 O4'-C1'-N19 117.526 12.157 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.092 0 O4'-C1'-N19 110.392 3.241 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.548 0 O4'-C4'-C3' 109.349 3.749 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.477 0 O4'-C4'-C3' 108.085 2.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.29 0 O4'-C1'-N19 110.097 2.872 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.553 0 O4'-C1'-N19 110.113 2.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.369 0 P-O3'-C3' 123.904 3.503 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.996 0 O4'-C4'-C3' 108.071 2.471 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.966 0 P-O3'-C3' 122.713 2.511 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 29.4 p80 . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.856 0.36 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 17.3 tpt -83.75 -55.35 4.31 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.495 1.118 . . . . 0.0 112.073 176.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.1 mt -104.87 176.35 5.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.236 1.814 . . . . 0.0 113.385 -169.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.3 p -73.97 -169.24 0.72 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.625 1.57 . . . . 0.0 112.645 177.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -49.19 -24.88 1.91 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.78 1.632 . . . . 0.0 114.626 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.63 45.76 0.12 Allowed Glycine 0 C--N 1.34 0.8 0 CA-C-O 118.174 -1.348 . . . . 0.0 114.833 171.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.36 -19.85 38.82 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 120.038 1.919 . . . . 0.0 113.552 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pp -108.67 -17.63 13.91 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.146 1.378 . . . . 0.0 112.761 171.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -73.18 -57.33 4.1 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 126.09 1.756 . . . . 0.0 111.48 -175.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.3 pttp -76.0 15.68 0.51 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.733 1.213 . . . . 0.0 113.161 -174.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -126.32 -42.03 1.86 Allowed 'General case' 0 C--O 1.233 0.203 0 C-N-CA 129.753 3.221 . . . . 0.0 110.436 -170.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.4 pt -62.99 -35.88 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-N 118.658 0.663 . . . . 0.0 111.679 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.07 -19.04 41.05 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 178.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -94.95 -17.47 21.94 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 127.091 2.156 . . . . 0.0 111.919 -168.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -100.8 -51.16 9.87 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 C-N-CA 123.955 0.902 . . . . 0.0 108.746 167.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 93.7 t -63.87 -39.11 84.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 119.81 1.186 . . . . 0.0 111.181 -170.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -82.39 3.74 26.82 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 120.076 -0.65 . . . . 0.0 112.273 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.67 -11.39 9.42 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.312 1.845 . . . . 0.0 114.17 -177.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -91.15 -86.95 0.21 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.243 1.017 . . . . 0.0 111.621 -176.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -131.99 96.66 3.96 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 122.53 1.157 . . . . 0.0 112.243 178.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -57.81 -15.72 9.18 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.273 1.429 . . . . 0.0 113.939 171.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -102.06 -10.2 19.92 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.921 2.088 . . . . 0.0 113.747 173.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -140.6 76.09 25.14 Favored Pre-proline 0 N--CA 1.483 1.195 0 C-N-CA 125.773 1.629 . . . . 0.0 111.076 172.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.51 161.9 44.38 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.254 2.636 . . . . 0.0 112.445 -176.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -81.89 -178.01 6.82 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.642 1.177 . . . . 0.0 111.255 169.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 93.2 p -131.18 169.01 16.5 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.889 1.676 . . . . 0.0 109.866 173.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -54.33 -31.96 55.55 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 174.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -68.83 -53.82 19.29 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.001 -1.687 . . . . 0.0 110.988 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -61.81 -47.64 84.19 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 120.578 -1.326 . . . . 0.0 112.597 -174.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.5 pt -59.98 -38.38 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 119.657 1.117 . . . . 0.0 112.06 173.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.89 -34.52 76.18 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.433 1.015 . . . . 0.0 112.197 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -68.16 -54.39 18.33 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.65 1.18 . . . . 0.0 112.771 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.411 HG21 ' HE3' ' A' ' 37' ' ' LYS . 3.0 mt -63.37 -33.46 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 121.496 -0.753 . . . . 0.0 111.509 -176.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.88 -23.03 67.19 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.499 1.52 . . . . 0.0 112.332 176.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -80.95 -15.46 56.2 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -84.39 -13.59 51.77 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.505 0.722 . . . . 0.0 112.179 -178.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.411 ' HE3' HG21 ' A' ' 33' ' ' ILE . 14.2 ptpt -127.0 -23.51 3.61 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.342 1.608 . . . . 0.0 115.342 -171.003 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.63 1.7 0.07 OUTLIER Glycine 0 N--CA 1.471 0.975 0 N-CA-C 115.752 1.061 . . . . 0.0 115.752 152.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -87.42 -30.7 20.52 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.412 1.106 . . . . 0.0 112.676 -169.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ptmt 29.01 44.81 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 129.947 3.299 . . . . 0.0 113.921 -171.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -82.08 140.46 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.078 1.351 . . . . 0.0 109.002 176.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.98 165.23 20.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.355 2.262 . . . . 0.0 112.328 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -25.75 68.4 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.267 1.427 . . . . 0.0 113.904 -177.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -67.3 -36.35 81.33 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.165 0.986 . . . . 0.0 111.516 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.1 m -84.89 -48.91 8.85 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 127.481 2.312 . . . . 0.0 109.4 -175.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.91 -30.05 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.27 -174.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.11 -48.88 72.09 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.105 1.362 . . . . 0.0 110.727 176.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -69.22 -16.26 63.56 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.522 0.729 . . . . 0.0 112.938 -178.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -81.54 -47.53 12.97 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.985 0.914 . . . . 0.0 112.158 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.9 ptp180 -56.27 -23.08 34.11 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 119.066 0.848 . . . . 0.0 113.081 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -66.85 -47.46 71.87 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.723 1.209 . . . . 0.0 112.654 174.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -84.65 -25.33 28.57 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -171.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.0 -59.57 2.71 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.325 1.05 . . . . 0.0 111.868 175.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 167.42 8.6 0.03 OUTLIER Glycine 0 CA--C 1.534 1.262 0 N-CA-C 118.192 2.037 . . . . 0.0 118.192 171.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.8 mt -96.38 130.34 31.07 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 119.938 1.869 . . . . 0.0 110.928 -175.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -69.98 -58.7 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.669 2.912 . . . . 0.0 111.233 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.2 p -155.5 -4.13 0.13 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.722 1.609 . . . . 0.0 114.715 168.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 83.4 p 59.23 -10.6 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.785 2.834 . . . . 0.0 116.217 -168.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -82.17 -30.92 30.73 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 120.521 1.51 . . . . 0.0 111.057 172.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -23.73 59.07 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 174.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -72.95 -37.33 67.16 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.941 1.296 . . . . 0.0 112.417 170.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -72.85 -59.67 2.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.137 1.775 . . . . 0.0 112.88 179.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.7 tp . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.668 1.587 . . . . 0.0 114.415 -167.315 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.121 0 O4'-C1'-N19 110.483 3.353 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.564 0 O4'-C4'-C3' 108.565 2.965 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.619 1 O4'-C1'-N19 112.381 5.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.931 0 O4'-C4'-C3' 107.856 2.256 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.344 0 O4'-C1'-N19 109.87 2.588 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.49 0 P-O3'-C3' 123.591 3.242 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.357 0 O4'-C1'-N19 110.046 2.808 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.429 0 P-O3'-C3' 123.078 2.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.574 1 O4'-C1'-N19 111.174 4.217 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.57 1 C4'-C3'-C2' 98.965 -4.235 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.249 0 O4'-C4'-C3' 109.449 3.849 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.295 0 O4'-C4'-C3' 108.419 2.819 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.24 0 P-O3'-C3' 123.815 3.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.261 0 C4'-C3'-C2' 100.096 -3.104 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.782 0 N19-C1'-C2' 109.012 -3.242 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.295 0 C3'-C2'-C1' 107.244 3.246 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.478 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.699 0 P-O3'-C3' 124.087 3.656 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.478 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.544 0 O4'-C4'-C3' 108.287 2.687 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.962 1 O4'-C1'-N19 111.471 4.589 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.144 1 O4'-C1'-N19 116.125 10.407 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.72 0 N19-C1'-C2' 118.366 2.604 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.7 0 O4'-C4'-C3' 108.066 2.466 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.776 0 O4'-C4'-C3' 109.098 3.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.257 0 C4'-C3'-C2' 100.207 -2.993 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.408 0 O4'-C4'-C3' 108.436 2.836 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.917 0 P-O3'-C3' 124.44 3.95 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.752 0 P-O3'-C3' 122.945 2.704 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.768 0 P-O3'-C3' 123.389 3.074 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 53.1 m80 . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 121.019 0.438 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 56.5 tpp -139.8 -56.22 0.56 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.107 1.763 . . . . 0.0 110.887 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.6 mt -88.48 179.57 6.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.873 1.669 . . . . 0.0 112.468 175.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.5 p -71.53 -169.86 0.47 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.796 1.238 . . . . 0.0 112.502 175.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -48.7 -24.68 1.46 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.718 1.607 . . . . 0.0 114.655 173.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.2 45.83 0.11 Allowed Glycine 0 C--N 1.341 0.82 0 CA-C-O 117.954 -1.47 . . . . 0.0 115.205 170.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.59 -17.4 32.69 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.623 2.212 . . . . 0.0 113.425 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 pp -107.85 -20.06 13.32 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.526 1.13 . . . . 0.0 112.635 171.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.5 ttt -68.79 -62.66 1.29 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 126.134 1.774 . . . . 0.0 110.718 -178.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 pttp -76.67 16.36 0.52 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.098 1.359 . . . . 0.0 113.675 -171.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -127.46 -39.67 1.84 Allowed 'General case' 0 C--O 1.233 0.214 0 C-N-CA 129.375 3.07 . . . . 0.0 110.745 -171.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pt -63.07 -36.8 77.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.947 0.794 . . . . 0.0 111.447 -176.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 -16.03 44.89 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -179.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -97.57 -17.06 19.77 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 127.828 2.451 . . . . 0.0 111.773 -167.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.0 pp -101.42 -46.51 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 C-N-CA 124.981 1.312 . . . . 0.0 109.762 167.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.6 t -62.81 -42.78 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-N 119.463 1.028 . . . . 0.0 110.471 -174.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -81.41 0.19 38.64 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.659 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -96.22 -21.49 17.84 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.22 1.408 . . . . 0.0 112.622 175.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -91.8 -84.64 0.26 Allowed 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.504 1.122 . . . . 0.0 112.005 -172.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -140.1 92.42 2.54 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.573 1.149 . . . . 0.0 110.465 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -53.13 -27.76 22.44 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 160.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -22.59 63.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.611 2.765 . . . . 0.0 114.208 173.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -148.11 73.36 11.11 Favored Pre-proline 0 N--CA 1.478 0.937 0 C-N-CA 127.398 2.279 . . . . 0.0 109.878 -174.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -69.26 155.96 66.06 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.848 2.365 . . . . 0.0 112.402 -168.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -78.96 172.25 14.06 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.639 0.733 . . . . 0.0 110.423 165.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.5 p -129.09 169.01 15.26 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.491 1.516 . . . . 0.0 110.008 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.0 p30 -53.29 -34.15 56.14 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 178.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -67.64 -53.84 24.61 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 119.716 -1.865 . . . . 0.0 110.8 168.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -61.33 -49.66 76.08 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 120.807 -1.183 . . . . 0.0 112.558 -173.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.3 pt -59.22 -38.61 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-N 119.593 1.088 . . . . 0.0 112.28 173.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.92 -34.42 76.04 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.527 1.058 . . . . 0.0 112.01 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -68.36 -55.28 12.55 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.415 1.086 . . . . 0.0 112.826 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.8 -33.03 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-N 118.826 0.739 . . . . 0.0 111.201 -176.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mp -61.01 -26.37 67.56 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.048 1.339 . . . . 0.0 112.629 176.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -78.89 -13.66 59.67 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.648 0.779 . . . . 0.0 112.76 176.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -90.01 -9.6 48.04 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.553 0.741 . . . . 0.0 112.341 -177.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.5 pttt -127.86 -22.62 3.5 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -175.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 153.56 5.14 0.11 Allowed Glycine 0 N--CA 1.47 0.902 0 CA-C-N 119.65 1.114 . . . . 0.0 115.499 151.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -85.09 -20.73 29.91 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.023 0.912 . . . . 0.0 112.905 -171.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 36.52 28.38 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 130.603 3.561 . . . . 0.0 115.342 -177.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.427 ' CG2' ' HB ' ' A' ' 45' ' ' THR . 4.1 p -84.79 139.84 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-O 121.441 0.638 . . . . 0.0 109.978 -171.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.73 164.31 19.68 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.641 2.376 . . . . 0.0 112.363 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -57.1 -36.62 70.84 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.6 1.16 . . . . 0.0 113.839 -176.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -37.99 86.09 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.56 0.695 . . . . 0.0 110.54 -172.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.427 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 3.2 m -79.04 -48.82 13.7 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 127.972 2.509 . . . . 0.0 109.957 -175.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.06 -29.69 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.823 -175.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.52 -38.53 80.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.828 1.651 . . . . 0.0 111.757 178.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -64.78 -32.35 74.0 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.601 0.76 . . . . 0.0 111.396 175.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -79.52 -48.79 13.27 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 118.555 -0.736 . . . . 0.0 112.195 -171.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -53.54 -32.31 50.05 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.253 0.933 . . . . 0.0 112.286 172.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -72.37 -36.46 68.74 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.564 0.746 . . . . 0.0 112.372 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.0 ptt? -85.79 -31.69 22.21 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -175.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 mp -67.1 -61.2 2.04 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.079 0.952 . . . . 0.0 111.312 176.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 174.29 -2.63 0.03 OUTLIER Glycine 0 CA--C 1.536 1.371 0 N-CA-C 117.763 1.865 . . . . 0.0 117.763 174.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.7 mt -77.23 131.98 71.15 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 119.476 1.638 . . . . 0.0 110.251 177.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.11 -65.28 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.181 2.587 . . . . 0.0 109.873 170.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.6 p -151.03 -2.48 0.34 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.01 1.724 . . . . 0.0 114.225 163.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.5 m 57.73 -8.59 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.79 2.836 . . . . 0.0 116.026 -167.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -73.28 -40.53 64.49 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.491 1.516 . . . . 0.0 108.854 174.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -78.94 -21.53 47.11 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -71.79 -41.93 67.71 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.867 0.867 . . . . 0.0 111.981 169.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -75.27 -59.97 2.51 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.063 1.345 . . . . 0.0 112.86 -176.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.254 1.33 0 C-N-CA 125.541 1.536 . . . . 0.0 114.553 -168.087 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.752 0 C4'-C3'-C2' 100.216 -2.984 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.348 0 O4'-C1'-N19 110.118 2.898 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.573 1 O4'-C1'-N19 112.367 5.709 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.71 1 O4'-C1'-N19 111.719 4.899 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.696 0 P-O3'-C3' 123.302 3.001 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.538 0 P-O3'-C3' 122.984 2.736 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.007 0 O4'-C1'-N19 110.52 3.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.979 0 P-O3'-C3' 123.032 2.777 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.54 1 O4'-C1'-N19 111.229 4.287 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.365 1 C4'-C3'-C2' 99.004 -4.196 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.679 1 O4'-C1'-N19 112.073 5.342 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.574 0 O4'-C1'-N19 110.249 3.062 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.187 0 P-O3'-C3' 124.003 3.586 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.337 0 C4'-C3'-C2' 100.202 -2.998 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.811 0 N19-C1'-C2' 109.035 -3.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.367 0 C3'-C2'-C1' 107.019 3.085 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.461 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.541 1 C4'-C3'-C2' 98.96 -4.24 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.461 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.313 0 N19-C1'-C2' 109.079 -3.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.032 1 O4'-C1'-N19 112.388 5.735 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.573 3 O4'-C1'-N19 117.33 11.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.059 0 O4'-C1'-N19 110.987 3.984 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.356 0 C3'-C2'-C1' 105.565 2.046 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.25 0 O4'-C4'-C3' 108.335 2.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.324 0 O4'-C1'-N19 110.165 2.956 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.597 0 O4'-C4'-C3' 108.666 3.066 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.573 0 P-O3'-C3' 123.176 2.897 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 0 O4'-C4'-C3' 108.598 2.998 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.745 0 P-O3'-C3' 122.558 2.382 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.621 0.248 . . . . 0.0 110.73 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 15.7 tpt -69.02 -42.17 76.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.118 0.967 . . . . 0.0 113.467 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.3 mt -83.37 176.73 8.89 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.176 1.39 . . . . 0.0 113.257 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 48.2 p -70.28 -173.6 0.72 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.089 0.956 . . . . 0.0 112.148 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -43.06 -25.73 0.12 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.123 2.169 . . . . 0.0 115.897 170.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -172.58 40.44 0.16 Allowed Glycine 0 C--N 1.341 0.818 0 CA-C-O 117.747 -1.585 . . . . 0.0 115.657 170.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -64.5 -10.28 24.49 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 121.06 2.43 . . . . 0.0 114.127 -177.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 pp -112.64 -15.33 13.03 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.751 1.22 . . . . 0.0 113.687 166.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 3.0 ttp -71.73 -61.72 1.68 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.96 1.304 . . . . 0.0 110.489 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.7 pttp -73.62 16.37 0.21 Allowed 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -173.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.23 -46.11 1.94 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 129.632 3.173 . . . . 0.0 110.931 -171.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pp -63.98 -34.51 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.635 0.652 . . . . 0.0 112.166 -176.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.78 -17.12 51.93 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 175.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -94.68 -16.23 23.28 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.609 1.964 . . . . 0.0 111.81 -168.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.0 -46.25 9.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 C-N-CA 124.601 1.16 . . . . 0.0 109.381 169.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.1 -32.33 55.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 119.848 1.204 . . . . 0.0 111.367 -174.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -80.28 -0.95 38.76 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.495 -0.753 . . . . 0.0 112.583 175.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -110.05 -14.49 14.22 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.124 1.769 . . . . 0.0 113.07 -176.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -101.43 -96.58 0.27 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.052 0.842 . . . . 0.0 112.386 -169.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -136.74 88.33 2.36 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.886 1.274 . . . . 0.0 109.971 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -58.93 -20.46 52.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.543 0.737 . . . . 0.0 112.691 165.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -23.08 61.91 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 128.889 2.875 . . . . 0.0 114.208 169.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -148.45 69.7 10.49 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 127.649 2.379 . . . . 0.0 109.722 -174.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -72.35 165.54 32.36 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.934 2.423 . . . . 0.0 113.645 -163.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -76.02 -170.97 1.52 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.735 1.214 . . . . 0.0 111.045 165.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 60.3 p -141.47 169.02 18.4 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.726 2.01 . . . . 0.0 109.39 174.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -55.2 -32.32 62.13 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -66.5 -53.85 30.43 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 119.846 -1.784 . . . . 0.0 110.919 168.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.62 -49.02 76.85 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 120.661 -1.274 . . . . 0.0 112.758 -173.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.4 pt -59.34 -37.49 69.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-N 119.888 1.222 . . . . 0.0 112.212 173.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.35 -35.16 79.48 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.585 1.084 . . . . 0.0 112.456 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -68.41 -51.09 47.84 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.806 1.242 . . . . 0.0 113.015 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.3 mt -63.6 -35.48 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 121.829 -0.544 . . . . 0.0 110.938 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.3 mp -62.58 -23.22 66.9 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.534 1.534 . . . . 0.0 112.643 176.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 pttm -78.02 -15.11 59.22 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -83.39 -19.96 35.06 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.458 0.703 . . . . 0.0 111.801 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -89.3 -57.48 2.87 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.339 1.856 . . . . 0.0 108.735 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 155.93 7.92 0.07 OUTLIER Glycine 0 CA--C 1.529 0.937 0 CA-C-N 114.185 -1.37 . . . . 0.0 114.152 173.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -79.37 -24.42 42.67 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.492 1.146 . . . . 0.0 112.3 -175.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt 32.69 35.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 130.692 3.597 . . . . 0.0 114.586 -176.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -82.48 139.83 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -175.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.36 160.71 26.61 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.345 2.258 . . . . 0.0 112.22 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -34.9 64.48 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.726 1.211 . . . . 0.0 113.915 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.08 -31.49 72.39 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 118.735 0.698 . . . . 0.0 111.661 -173.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.8 m -83.86 -49.64 8.84 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 128.584 2.753 . . . . 0.0 109.745 -176.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.79 -26.9 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.193 -176.104 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.46 -36.16 76.32 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 126.718 2.007 . . . . 0.0 111.829 177.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -64.74 -39.04 92.96 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.982 -0.449 . . . . 0.0 111.626 172.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -73.47 -35.94 65.76 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -164.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.98 -30.84 6.51 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 170.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -71.11 -36.42 72.14 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.1 ptp -86.51 -20.62 27.78 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -175.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.2 mt -86.45 -63.4 1.32 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.295 1.438 . . . . 0.0 111.623 179.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.92 -5.55 0.04 OUTLIER Glycine 0 CA--C 1.535 1.294 0 N-CA-C 117.851 1.901 . . . . 0.0 117.851 167.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.0 mt -76.73 122.7 86.99 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 119.329 1.564 . . . . 0.0 110.871 -176.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.23 -59.41 0.08 OUTLIER 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.556 2.838 . . . . 0.0 110.729 -178.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 83.2 p -146.24 -6.8 0.55 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.798 1.639 . . . . 0.0 113.884 159.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 85.1 p 60.45 -20.43 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 129.561 3.144 . . . . 0.0 116.17 -163.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -71.1 -43.6 67.36 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.801 1.64 . . . . 0.0 109.649 172.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -23.56 60.81 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.652 0.781 . . . . 0.0 112.768 -172.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -70.23 -46.29 64.76 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.989 1.716 . . . . 0.0 111.993 167.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -72.0 -58.98 2.99 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.188 1.795 . . . . 0.0 113.194 -174.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.833 2.053 . . . . 0.0 114.437 -167.602 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.8 0 O5'-C5'-C4' 114.422 3.016 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.522 0 O4'-C1'-N19 110.518 3.398 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.747 1 O4'-C1'-N19 112.44 5.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.138 1 O4'-C1'-N19 111.292 4.365 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.724 0 O4'-C1'-N19 110.392 3.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.891 0 O5'-C5'-C4' 114.253 2.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.073 0 O4'-C1'-N19 110.572 3.465 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.091 0 P-O3'-C3' 122.682 2.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.679 1 O4'-C1'-N19 111.626 4.783 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.784 0 C4'-C3'-C2' 99.681 -3.519 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.662 0 O4'-C1'-N19 110.95 3.937 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.433 0 O4'-C4'-C3' 109.106 3.506 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.378 0 P-O3'-C3' 123.95 3.542 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.655 0 C4'-C3'-C2' 100.061 -3.139 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.661 0 O4'-C4'-C3' 108.617 3.017 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.398 0 O4'-C4'-C3' 108.481 2.881 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.488 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.285 2 C4'-C3'-C2' 99.031 -4.169 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.488 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.269 0 O4'-C4'-C3' 109.161 3.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.483 2 O4'-C1'-N19 114.313 8.142 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.148 3 O4'-C1'-N19 117.24 11.8 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 017 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.111 1 O4'-C1'-N19 111.507 4.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.309 0 C3'-C2'-C1' 105.338 1.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.38 0 O4'-C4'-C3' 108.0 2.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.262 0 C4'-C3'-C2' 100.209 -2.991 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.31 0 O4'-C1'-N19 110.02 2.775 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.119 0 P-O3'-C3' 123.663 3.303 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.215 0 O4'-C4'-C3' 108.642 3.042 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.018 0 P-O3'-C3' 122.657 2.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 120.47 0.176 . . . . 0.0 110.821 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 51.6 mtt -137.87 -49.96 0.58 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.735 1.214 . . . . 0.0 112.518 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 36.1 mt -106.12 176.64 5.1 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.669 1.588 . . . . 0.0 113.72 -172.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 54.2 p -74.25 -168.03 0.6 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.821 1.648 . . . . 0.0 112.485 179.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -49.05 -25.7 2.19 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.204 1.402 . . . . 0.0 114.378 173.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.47 45.8 0.12 Allowed Glycine 0 C--N 1.34 0.776 0 CA-C-O 118.09 -1.394 . . . . 0.0 115.021 172.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -62.84 -15.77 55.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 120.504 2.152 . . . . 0.0 113.373 -178.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pp -108.16 -18.07 13.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.111 0.964 . . . . 0.0 112.832 169.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.2 ttp -70.07 -61.78 1.64 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.411 1.484 . . . . 0.0 110.749 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.6 pttt -76.71 15.89 0.58 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.996 0.918 . . . . 0.0 113.385 -171.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -124.96 -43.4 1.98 Allowed 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 129.305 3.042 . . . . 0.0 110.631 -171.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.8 pt -58.48 -37.79 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-N 118.67 0.668 . . . . 0.0 111.553 -177.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.37 -18.53 41.7 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -105.92 -12.22 15.91 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.344 1.857 . . . . 0.0 112.738 -167.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -94.54 -48.2 13.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 124.472 1.109 . . . . 0.0 108.777 162.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 82.7 t -64.33 -37.51 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 O-C-N 120.7 -1.25 . . . . 0.0 111.167 -173.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -83.85 5.35 25.5 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 178.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -109.29 -22.9 11.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.501 1.52 . . . . 0.0 112.756 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -89.23 -85.59 0.2 Allowed 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.798 1.239 . . . . 0.0 111.665 -173.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -142.97 82.67 1.77 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.764 1.226 . . . . 0.0 110.81 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -60.22 -19.29 53.73 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 166.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -72.06 -28.3 63.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.981 2.512 . . . . 0.0 114.755 169.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.88 79.02 12.33 Favored Pre-proline 0 N--CA 1.482 1.174 0 C-N-CA 127.509 2.324 . . . . 0.0 109.6 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.37 168.29 25.15 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.881 3.054 . . . . 0.0 113.769 -167.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -81.1 -171.0 3.0 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.077 1.751 . . . . 0.0 111.704 168.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 70.0 p -139.4 173.38 11.6 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 127.61 2.364 . . . . 0.0 108.959 172.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -66.86 -27.18 67.32 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 120.182 1.355 . . . . 0.0 112.085 -175.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -65.67 -52.73 49.29 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 119.888 -1.757 . . . . 0.0 110.968 166.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -62.26 -48.46 79.83 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 120.623 -1.298 . . . . 0.0 112.372 -173.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.3 pt -59.92 -38.11 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.575 1.079 . . . . 0.0 112.104 173.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.02 -35.61 79.08 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.283 0.947 . . . . 0.0 111.881 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -68.3 -52.36 34.47 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.322 1.049 . . . . 0.0 112.816 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.419 HG21 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -64.84 -32.27 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 O-C-N 121.211 -0.93 . . . . 0.0 111.627 -178.042 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.45 -22.87 66.55 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.149 1.38 . . . . 0.0 112.369 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.1 pttt -79.86 -16.11 56.06 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 175.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -87.73 -12.26 45.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.887 0.875 . . . . 0.0 112.138 -176.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 33' ' ' ILE . 13.7 ptpt -125.92 -21.73 4.3 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -174.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.6 1.07 0.08 OUTLIER Glycine 0 N--CA 1.471 0.976 0 N-CA-C 115.672 1.029 . . . . 0.0 115.672 151.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -86.75 -25.92 24.45 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.41 1.105 . . . . 0.0 113.036 -168.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.6 ptmt 30.56 40.45 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 130.371 3.468 . . . . 0.0 114.474 -173.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.0 p -84.3 156.71 3.62 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 124.489 1.116 . . . . 0.0 109.099 175.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -109.04 169.81 8.45 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.662 2.785 . . . . 0.0 112.646 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -59.17 -32.87 70.3 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.028 1.331 . . . . 0.0 114.079 -172.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -37.53 87.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.022 0.529 . . . . 0.0 110.2 -174.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.0 m -84.31 -44.09 14.15 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 126.584 1.954 . . . . 0.0 109.941 -174.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.91 -31.18 52.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.328 -178.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.13 -36.24 72.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.815 1.646 . . . . 0.0 112.789 174.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -65.77 -27.77 68.54 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.422 0.689 . . . . 0.0 112.097 172.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -84.2 -53.69 5.33 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 124.058 0.943 . . . . 0.0 111.778 -175.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.21 -26.82 19.0 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 118.837 0.744 . . . . 0.0 112.851 174.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.3 -39.78 89.56 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.943 0.897 . . . . 0.0 113.082 175.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -92.41 -22.15 19.81 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -174.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.86 -65.16 0.8 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.49 1.116 . . . . 0.0 111.761 172.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 173.53 15.98 0.02 OUTLIER Glycine 0 CA--C 1.535 1.327 0 N-CA-C 118.024 1.97 . . . . 0.0 118.024 175.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.4 mp -120.72 135.3 24.58 Favored Pre-proline 0 CA--C 1.552 1.028 0 CA-C-N 119.408 1.604 . . . . 0.0 113.077 -166.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.29 -47.99 0.14 Allowed 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 124.333 3.355 . . . . 0.0 113.701 177.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 88.2 p -163.46 -7.75 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.903 2.081 . . . . 0.0 114.126 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.9 m 63.99 -6.59 0.25 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.515 2.726 . . . . 0.0 115.569 -162.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -81.74 -39.21 24.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.82 1.248 . . . . 0.0 110.088 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -91.19 -6.09 53.98 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.374 1.469 . . . . 0.0 114.624 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.5 mtp85 -69.29 -33.09 72.65 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 121.298 -0.876 . . . . 0.0 112.15 161.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -83.45 -63.37 1.37 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.865 2.066 . . . . 0.0 112.384 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.9 mm . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.2 1.8 . . . . 0.0 112.261 -178.061 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.76 0 C4'-C3'-C2' 100.187 -3.013 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.3 0 O4'-C1'-N19 110.221 3.026 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.548 1 O4'-C1'-N19 111.244 4.305 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.33 0 O4'-C1'-N19 110.453 3.316 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . 0.402 ' H1 ' ' N4 ' ' C' ' 87' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.544 4.136 0 O5'-C5'-C4' 114.878 3.342 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.189 0 P-O3'-C3' 123.262 2.968 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.293 0 P-O3'-C3' 123.063 2.803 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.038 0 P-O3'-C3' 123.265 2.971 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . 0.436 ' H41' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.71 1 O4'-C1'-N19 111.413 4.516 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.675 1 C4'-C3'-C2' 99.07 -4.13 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.715 1 O4'-C1'-N19 111.358 4.447 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.684 0 O4'-C4'-C3' 108.647 3.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.3 0 P-O3'-C3' 123.748 3.373 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.357 0 C4'-C3'-C2' 99.972 -3.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.733 0 N19-C1'-C2' 109.422 -2.986 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.254 0 C3'-C2'-C1' 106.855 2.968 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.477 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.411 0 C4'-C3'-C2' 99.343 -3.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.477 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.354 0 O4'-C4'-C3' 108.553 2.953 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.925 1 O4'-C1'-N19 112.678 6.098 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . 0.436 ' H1 ' ' H41' ' B' ' 72' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.545 4.244 2 O4'-C1'-N19 117.902 12.628 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 0 O4'-C1'-N19 110.383 3.229 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.452 0 C3'-C2'-C1' 105.905 2.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.656 0 O4'-C4'-C3' 108.877 3.277 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . 0.402 ' N4 ' ' H1 ' ' B' ' 68' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.325 0 C4'-C3'-C2' 100.306 -2.894 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.744 0 P-O3'-C3' 122.635 2.446 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.351 0 P-O3'-C3' 123.228 2.94 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.021 0 O4'-C4'-C3' 108.038 2.438 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.764 0 P-O3'-C3' 122.696 2.497 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 . . . . . 0 N--CA 1.484 1.272 0 N-CA-C 111.428 0.158 . . . . 0.0 111.428 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.0 mmt 43.67 41.42 3.55 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 127.968 2.507 . . . . 0.0 114.823 168.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 41.1 mt -63.38 176.54 0.79 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 127.177 2.191 . . . . 0.0 115.116 -179.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.3 p -69.91 -169.5 0.26 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.015 1.326 . . . . 0.0 112.581 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -48.44 -24.45 1.27 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.592 1.557 . . . . 0.0 114.627 172.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.67 42.09 0.13 Allowed Glycine 0 CA--C 1.527 0.823 0 CA-C-O 117.518 -1.712 . . . . 0.0 116.081 172.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.37 -12.82 23.57 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 121.431 2.615 . . . . 0.0 113.697 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 pp -112.02 -16.46 13.07 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.915 1.286 . . . . 0.0 113.242 168.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.8 ttt -69.15 -65.92 0.64 Allowed 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.211 1.405 . . . . 0.0 110.17 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.1 pttp -74.05 17.33 0.18 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.599 1.56 . . . . 0.0 113.7 -173.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -128.41 -37.54 1.81 Allowed 'General case' 0 C--O 1.233 0.219 0 C-N-CA 129.205 3.002 . . . . 0.0 111.733 -172.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.1 pt -62.95 -33.19 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.648 1.113 . . . . 0.0 111.514 -178.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.03 -11.24 39.4 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -96.94 -13.35 22.46 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.385 1.874 . . . . 0.0 111.879 -174.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.27 -46.97 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 124.91 1.284 . . . . 0.0 109.473 167.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.23 -36.58 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 119.828 1.194 . . . . 0.0 111.028 -174.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -78.43 -1.63 34.51 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -106.71 -16.67 14.43 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.63 1.572 . . . . 0.0 113.03 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -96.41 -88.93 0.27 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.874 0.87 . . . . 0.0 112.331 -172.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -138.76 90.68 2.47 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.719 1.208 . . . . 0.0 110.367 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -57.36 -20.5 29.57 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.71 0.804 . . . . 0.0 113.04 164.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -75.37 -21.66 58.14 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.832 2.453 . . . . 0.0 113.822 171.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -147.81 75.79 10.86 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 127.286 2.235 . . . . 0.0 110.2 -174.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -70.05 162.19 43.16 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.143 2.562 . . . . 0.0 113.1 -170.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -78.34 -166.43 0.84 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.33 1.452 . . . . 0.0 110.943 169.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.9 m -149.85 172.43 15.17 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.205 1.802 . . . . 0.0 109.61 173.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.411 ' CG ' ' HE ' ' A' ' 43' ' ' ARG . 23.7 p30 -62.55 -31.47 72.27 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -171.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -65.03 -50.89 64.46 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.078 -1.639 . . . . 0.0 110.67 165.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.95 -50.97 70.0 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 120.677 -1.264 . . . . 0.0 112.531 -173.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.7 pt -59.23 -37.27 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 119.363 0.983 . . . . 0.0 112.366 174.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.72 -35.6 80.29 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.403 1.001 . . . . 0.0 111.973 176.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -67.49 -53.25 30.37 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.202 1.001 . . . . 0.0 112.745 -178.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.428 HG21 ' HE3' ' A' ' 37' ' ' LYS . 2.6 mt -63.81 -32.36 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 O-C-N 121.42 -0.8 . . . . 0.0 111.449 -177.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.86 -21.65 66.55 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.031 1.332 . . . . 0.0 112.522 175.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.5 ptmt -80.84 -15.37 56.56 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 175.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -88.33 -12.31 43.81 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.821 0.849 . . . . 0.0 112.267 -177.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.428 ' HE3' HG21 ' A' ' 33' ' ' ILE . 13.9 ptpt -126.75 -22.51 3.87 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -173.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.33 1.83 0.07 OUTLIER Glycine 0 N--CA 1.469 0.899 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 152.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -88.91 -34.65 16.86 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.395 1.097 . . . . 0.0 112.017 -168.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.8 ptmt 27.12 53.61 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 129.15 2.98 . . . . 0.0 112.486 -170.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.2 p -88.16 142.76 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 126.372 1.869 . . . . 0.0 108.858 168.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.32 169.87 11.91 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 129.384 3.073 . . . . 0.0 113.291 175.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.411 ' HE ' ' CG ' ' A' ' 27' ' ' ASP . 0.7 OUTLIER -64.14 -28.85 70.04 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 125.681 1.592 . . . . 0.0 114.39 -171.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -35.14 69.7 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.795 1.18 . . . . 0.0 111.132 -175.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.2 m -77.43 -48.65 16.65 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 125.816 1.646 . . . . 0.0 108.589 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.29 -30.9 51.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.82 -175.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.67 -43.65 72.09 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 126.311 1.844 . . . . 0.0 111.594 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -66.99 -25.64 66.41 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 173.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -79.4 -46.47 17.51 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.666 0.787 . . . . 0.0 112.673 -178.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.408 ' HE ' ' HB3' ' A' ' 27' ' ' ASP . 30.8 ptt85 -51.94 -31.68 29.91 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.765 1.166 . . . . 0.0 111.821 170.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -77.89 -23.51 48.72 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 178.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.9 ptm -93.05 -26.99 17.25 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.573 1.079 . . . . 0.0 112.823 177.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.2 mp -73.73 -74.63 0.17 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.994 1.318 . . . . 0.0 111.322 172.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 176.12 14.53 0.02 OUTLIER Glycine 0 CA--C 1.537 1.44 0 N-CA-C 118.253 2.061 . . . . 0.0 118.253 178.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.9 mt -112.27 126.39 28.48 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 119.556 1.678 . . . . 0.0 111.773 -173.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.29 -70.36 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 124.143 3.229 . . . . 0.0 110.348 173.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 95.2 p -141.38 -7.05 1.02 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.41 2.284 . . . . 0.0 113.351 174.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.2 m 56.86 -1.58 0.05 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 128.488 2.715 . . . . 0.0 116.088 -161.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -82.45 -39.63 22.28 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 120.309 1.413 . . . . 0.0 110.369 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -73.44 -20.62 60.67 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.2 mtp180 -75.3 -42.54 54.47 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.678 1.191 . . . . 0.0 112.43 167.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -66.15 -58.67 4.92 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.231 1.812 . . . . 0.0 112.835 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 C--O 1.254 1.308 0 C-N-CA 125.498 1.519 . . . . 0.0 114.441 -169.432 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.719 0 C4'-C3'-C2' 100.162 -3.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.41 1 O4'-C1'-N19 111.439 4.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.801 1 O4'-C1'-N19 111.654 4.818 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C1'-N19 110.275 3.094 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.385 0 O4'-C4'-C3' 108.125 2.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.452 0 P-O3'-C3' 123.345 3.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.144 0 O4'-C1'-N19 110.787 3.734 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.082 0 P-O3'-C3' 123.498 3.165 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' ' DC' . . . . . 0.4 " H2'" ' C8 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.716 1 O4'-C1'-N19 111.141 4.176 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' ' DG' . . . . . 0.4 ' C8 ' " H2'" ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.282 1 C4'-C3'-C2' 99.002 -4.198 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.329 1 O4'-C1'-N19 111.261 4.326 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.483 0 O4'-C4'-C3' 108.96 3.36 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.158 0 P-O3'-C3' 123.64 3.283 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 0 C4'-C3'-C2' 100.292 -2.908 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.718 0 N19-C1'-C2' 109.171 -3.143 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.188 0 C3'-C2'-C1' 106.753 2.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 80' ' ' ' DA' . . . . . 0.444 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.294 0 O4'-C4'-C3' 109.299 3.699 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 81' ' ' ' DA' . . . . . 0.444 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.154 0 O4'-C4'-C3' 108.64 3.04 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 82' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.59 1 O4'-C1'-N19 111.653 4.816 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 83' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.05 2 O4'-C1'-N19 118.094 12.868 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.256 1 O4'-C1'-N19 111.849 5.061 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.396 0 C3'-C2'-C1' 105.942 2.316 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.523 0 O4'-C4'-C3' 108.374 2.774 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.432 0 P-O3'-C3' 123.145 2.871 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.756 0 O4'-C1'-N19 110.105 2.881 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.578 0 P-O3'-C3' 123.355 3.046 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.11 0 O4'-C4'-C3' 108.679 3.079 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.943 0 C4'-C3'-C2' 100.502 -2.698 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.777 HD12 HD23 ' A' ' 8' ' ' LEU . 32.4 mt . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.7 p -71.19 -168.95 0.34 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.381 1.472 . . . . 0.0 112.683 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -48.48 -25.22 1.56 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.581 1.552 . . . . 0.0 114.556 172.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.7 40.11 0.14 Allowed Glycine 0 CA--C 1.529 0.929 0 CA-C-O 117.688 -1.618 . . . . 0.0 116.063 174.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.98 -14.06 31.56 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 121.435 2.618 . . . . 0.0 113.364 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.777 HD23 HD12 ' A' ' 3' ' ' LEU . 1.8 pp -111.34 -16.87 13.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.87 1.268 . . . . 0.0 113.278 168.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 9.5 ttm -67.65 -67.05 0.49 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.351 1.46 . . . . 0.0 110.031 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.512 ' C ' HD22 ' A' ' 11' ' ' LEU . 7.0 pttp -74.45 18.76 0.15 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.59 1.556 . . . . 0.0 113.712 -172.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.512 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -128.8 -38.4 1.68 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 129.53 3.132 . . . . 0.0 111.158 -172.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -61.99 -35.57 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 CA-C-N 119.447 1.021 . . . . 0.0 111.441 -177.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.57 -13.11 28.11 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -177.191 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -91.59 -17.44 25.59 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 126.855 2.062 . . . . 0.0 111.579 -174.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.29 -46.32 9.73 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 C-N-CA 124.95 1.3 . . . . 0.0 109.727 169.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 87.9 t -64.66 -35.81 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 119.923 1.238 . . . . 0.0 111.091 -175.072 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -83.74 5.07 26.11 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -112.28 -16.28 13.0 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.471 1.909 . . . . 0.0 113.445 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -94.71 -86.83 0.28 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.152 0.981 . . . . 0.0 111.708 -173.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -139.69 85.11 2.02 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.26 1.424 . . . . 0.0 109.669 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -59.4 -17.99 35.15 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.491 1.116 . . . . 0.0 113.574 172.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -87.74 -7.95 56.67 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 126.607 1.963 . . . . 0.0 113.852 174.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -146.72 71.12 12.6 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 127.438 2.295 . . . . 0.0 110.456 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -69.37 160.49 49.6 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.874 2.383 . . . . 0.0 113.332 -168.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -76.6 -174.25 2.88 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.143 1.377 . . . . 0.0 111.004 167.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.481 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 87.9 p -134.0 169.62 16.85 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.078 1.751 . . . . 0.0 110.131 173.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -55.64 -31.34 62.25 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 176.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -68.24 -54.38 18.05 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 119.836 -1.79 . . . . 0.0 110.932 167.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.481 ' HB2' ' H ' ' A' ' 26' ' ' SER . 22.2 mm-40 -62.17 -47.48 84.32 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.793 -1.192 . . . . 0.0 112.702 -173.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 pt -59.63 -38.75 77.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.752 1.16 . . . . 0.0 112.061 172.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.2 -34.99 77.52 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.656 1.116 . . . . 0.0 112.055 176.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -68.2 -54.26 19.09 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.213 1.005 . . . . 0.0 112.819 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.453 HG22 ' HE2' ' A' ' 37' ' ' LYS . 1.8 mt -63.2 -32.89 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-N 119.063 0.847 . . . . 0.0 111.452 -177.147 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mp -63.3 -20.09 65.17 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.155 1.382 . . . . 0.0 112.855 176.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 ptmt -81.53 -14.89 56.35 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.706 0.803 . . . . 0.0 112.646 173.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -88.21 -11.73 45.87 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.247 0.619 . . . . 0.0 112.361 -176.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.453 ' HE2' HG22 ' A' ' 33' ' ' ILE . 27.2 pttt -129.06 -27.3 2.51 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -171.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.81 6.24 0.04 OUTLIER Glycine 0 N--CA 1.471 0.997 0 CA-C-N 120.592 1.542 . . . . 0.0 116.941 160.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -99.3 -39.86 8.21 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.527 1.163 . . . . 0.0 111.361 -168.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER 37.85 51.06 1.33 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 128.138 2.575 . . . . 0.0 111.776 179.617 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.664 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -91.66 139.88 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 111.592 -2.549 . . . . 0.0 109.194 171.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.09 165.61 18.37 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 128.857 2.863 . . . . 0.0 112.414 176.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.57 -26.6 68.67 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 125.589 1.555 . . . . 0.0 113.981 -177.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -34.38 76.62 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.835 0.854 . . . . 0.0 111.31 -177.012 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.0 m -84.91 -47.5 10.24 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 127.222 2.209 . . . . 0.0 109.948 -176.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.78 -28.33 42.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.949 -173.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.03 -47.39 80.43 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 125.672 1.589 . . . . 0.0 111.06 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -67.92 -18.27 64.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.106 1.362 . . . . 0.0 112.443 179.059 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -89.58 -50.35 6.13 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.48 1.512 . . . . 0.0 112.84 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -22.26 47.45 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.687 1.13 . . . . 0.0 112.144 172.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -69.49 -44.18 71.67 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.951 0.9 . . . . 0.0 112.871 170.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.9 ptp -83.31 -31.57 26.78 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -172.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 mp -65.64 -63.48 1.08 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.426 1.09 . . . . 0.0 111.205 175.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.96 8.07 0.03 OUTLIER Glycine 0 CA--C 1.536 1.372 0 N-CA-C 118.227 2.051 . . . . 0.0 118.227 171.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.5 mt -90.96 125.19 59.68 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 119.629 1.714 . . . . 0.0 111.217 -173.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.74 -53.25 0.28 Allowed 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.016 2.477 . . . . 0.0 110.78 175.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.2 p -158.89 -10.99 0.07 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 163.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 56.3 m 61.72 -18.4 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 128.293 2.637 . . . . 0.0 116.071 -164.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -67.11 -42.0 85.27 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 120.476 1.489 . . . . 0.0 109.012 168.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -25.09 54.02 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.993 0.917 . . . . 0.0 113.263 -178.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.9 mtm180 -72.2 -42.82 65.37 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.412 1.485 . . . . 0.0 112.302 169.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -69.49 -58.77 3.56 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.051 1.74 . . . . 0.0 113.229 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.8 tp . . . . . 0 C--O 1.254 1.309 0 C-N-CA 125.985 1.714 . . . . 0.0 114.43 -168.099 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.726 HD12 HD23 ' A' ' 8' ' ' LEU . 35.9 mt . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.2 p -71.29 -173.49 0.88 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.701 1.2 . . . . 0.0 112.158 170.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -51.23 -24.46 4.4 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.23 1.412 . . . . 0.0 114.791 175.001 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.77 39.12 0.21 Allowed Glycine 0 C--N 1.341 0.841 0 CA-C-O 117.61 -1.661 . . . . 0.0 115.954 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.8 -15.82 23.51 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 120.831 2.316 . . . . 0.0 113.137 177.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.726 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -108.92 -18.4 13.69 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.959 1.303 . . . . 0.0 112.795 170.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.436 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.4 ttt -73.38 -59.45 2.71 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.541 1.536 . . . . 0.0 111.255 -176.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.517 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.8 pttp -76.32 19.2 0.26 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.777 1.231 . . . . 0.0 113.005 -174.813 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.517 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -130.57 -38.93 1.3 Allowed 'General case' 0 C--O 1.233 0.223 0 C-N-CA 129.703 3.201 . . . . 0.0 110.992 -170.368 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.6 pt -64.04 -34.32 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 CA-C-N 119.07 0.85 . . . . 0.0 111.359 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.93 -13.83 43.61 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -93.22 -18.33 22.64 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.48 1.912 . . . . 0.0 111.847 -171.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.95 -48.8 10.99 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.165 0 C-N-CA 124.568 1.147 . . . . 0.0 108.933 168.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.0 t -65.55 -34.6 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 119.961 1.255 . . . . 0.0 111.407 -172.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -81.56 3.22 25.81 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.42 -7.71 9.69 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.153 1.781 . . . . 0.0 114.186 -176.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -100.53 -85.76 0.41 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.838 0.855 . . . . 0.0 112.296 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -136.88 87.77 2.31 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.913 1.285 . . . . 0.0 110.98 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -58.12 -23.82 56.45 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.959 0.904 . . . . 0.0 112.777 166.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -27.49 62.88 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 128.365 2.666 . . . . 0.0 113.914 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -148.29 75.63 10.45 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 127.122 2.169 . . . . 0.0 110.116 -170.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.2 161.48 45.83 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.14 2.56 . . . . 0.0 112.533 -170.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -78.7 -176.22 4.79 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.539 1.136 . . . . 0.0 110.964 167.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.471 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 55.1 p -137.43 169.59 17.52 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.098 1.759 . . . . 0.0 110.527 175.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -56.01 -32.1 63.68 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -67.16 -55.29 14.79 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 120.226 -1.546 . . . . 0.0 110.813 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.471 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.4 mm-40 -61.83 -49.29 76.88 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 120.786 -1.196 . . . . 0.0 112.866 -173.301 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.9 pt -59.07 -38.53 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 119.484 1.038 . . . . 0.0 112.183 173.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.56 -35.22 78.8 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.803 1.183 . . . . 0.0 111.827 176.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -68.89 -53.19 22.51 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.422 1.089 . . . . 0.0 112.947 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.455 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.8 mt -64.16 -32.86 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 O-C-N 121.321 -0.862 . . . . 0.0 111.433 -177.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.13 -24.69 67.3 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.242 1.417 . . . . 0.0 112.385 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -78.83 -15.75 57.98 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -88.35 -11.65 45.67 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.677 0.791 . . . . 0.0 112.105 -176.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.455 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.8 ptpt -126.58 -21.63 4.09 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -174.432 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.16 2.32 0.08 OUTLIER Glycine 0 N--CA 1.472 1.055 0 N-CA-C 115.992 1.157 . . . . 0.0 115.992 151.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.401 ' HB3' HD11 ' A' ' 3' ' ' LEU . 52.3 m-85 -89.0 -22.24 23.1 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.3 1.05 . . . . 0.0 113.671 -167.345 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.01 28.96 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 130.398 3.479 . . . . 0.0 115.673 -175.153 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.576 HG21 HD22 ' A' ' 8' ' ' LEU . 3.3 p -82.77 141.73 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 121.391 0.615 . . . . 0.0 109.348 -173.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.17 164.95 16.08 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.07 2.548 . . . . 0.0 112.719 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.2 -31.18 68.78 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 125.45 1.5 . . . . 0.0 114.354 -175.135 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -36.6 78.97 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.205 0.911 . . . . 0.0 110.693 -176.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.418 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 2.6 m -77.41 -47.5 19.64 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 126.492 1.917 . . . . 0.0 109.455 -176.48 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.25 -29.34 45.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.064 -175.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.06 -35.35 69.28 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.561 1.545 . . . . 0.0 112.287 178.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -67.5 -30.93 70.74 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.398 0.679 . . . . 0.0 111.841 172.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -77.08 -46.07 24.87 Favored 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 123.154 0.582 . . . . 0.0 112.423 -172.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.19 -29.5 14.2 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 175.035 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -74.0 -37.42 64.42 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.52 0.728 . . . . 0.0 112.515 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -87.28 -23.87 24.53 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -175.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.436 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.4 mt -71.41 -62.82 1.27 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.265 1.026 . . . . 0.0 111.387 169.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 165.84 3.98 0.04 OUTLIER Glycine 0 CA--C 1.537 1.464 0 N-CA-C 118.029 1.972 . . . . 0.0 118.029 170.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 28.4 mt -84.2 131.33 51.16 Favored Pre-proline 0 CA--C 1.547 0.835 0 CA-C-N 119.371 1.585 . . . . 0.0 111.169 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.6 -63.96 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.737 2.958 . . . . 0.0 110.797 172.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 85.1 p -150.69 -11.9 0.24 Allowed 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.254 1.575 . . . . 0.0 115.254 168.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 73.6 m 61.06 -13.36 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 128.456 2.702 . . . . 0.0 116.184 -166.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -69.11 -40.29 78.42 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.823 1.649 . . . . 0.0 109.263 167.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.65 -20.42 46.73 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -76.25 -38.86 55.72 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.175 1.39 . . . . 0.0 112.174 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -68.83 -58.64 3.9 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.851 1.661 . . . . 0.0 112.133 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.256 1.397 0 C-N-CA 125.596 1.558 . . . . 0.0 114.349 -169.105 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.714 HD12 HD23 ' A' ' 8' ' ' LEU . 41.8 mt . . . . . 0 CA--C 1.546 0.81 0 CA-C-O 122.645 1.212 . . . . 0.0 114.018 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.8 p -72.8 -165.5 0.22 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.444 1.498 . . . . 0.0 112.797 -176.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -50.56 -23.66 2.69 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.76 51.78 0.09 OUTLIER Glycine 0 C--N 1.341 0.816 0 CA-C-O 118.438 -1.201 . . . . 0.0 114.783 168.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -64.3 -13.34 49.31 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.096 1.948 . . . . 0.0 114.282 -177.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.714 HD23 HD12 ' A' ' 3' ' ' LEU . 1.7 pp -105.48 -19.71 13.7 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.979 0.912 . . . . 0.0 113.263 166.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.436 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.5 ttt -72.39 -59.22 2.84 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.041 1.737 . . . . 0.0 111.006 -176.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.472 ' C ' HD22 ' A' ' 11' ' ' LEU . 22.7 pttt -76.53 15.45 0.62 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.659 1.184 . . . . 0.0 113.255 -174.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.472 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.6 mm? -126.34 -39.89 2.01 Favored 'General case' 0 C--N 1.34 0.182 0 C-N-CA 129.326 3.05 . . . . 0.0 111.064 -171.224 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.4 pt -63.09 -34.04 64.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 119.084 0.856 . . . . 0.0 111.708 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.05 -17.48 40.2 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 176.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -97.48 -13.96 21.41 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 127.02 2.128 . . . . 0.0 111.913 -169.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.11 -49.22 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.782 1.233 . . . . 0.0 109.158 166.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.64 -39.41 85.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.736 1.153 . . . . 0.0 111.14 -172.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -83.07 5.26 22.97 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -113.98 -15.61 12.29 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.66 1.584 . . . . 0.0 113.508 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -89.33 -83.86 0.23 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.851 1.26 . . . . 0.0 111.552 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -136.01 95.68 3.26 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 122.702 1.239 . . . . 0.0 112.153 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -56.5 -14.21 2.92 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.783 1.633 . . . . 0.0 114.53 171.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -118.25 8.32 12.26 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.036 1.735 . . . . 0.0 114.962 171.795 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -140.58 79.13 20.46 Favored Pre-proline 0 N--CA 1.484 1.236 0 C-N-CA 125.667 1.587 . . . . 0.0 110.87 161.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -71.83 163.84 37.6 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 123.678 2.919 . . . . 0.0 113.209 -172.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -90.22 175.75 7.01 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.859 1.264 . . . . 0.0 111.157 168.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.457 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 77.7 p -129.45 169.78 14.52 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 126.256 1.822 . . . . 0.0 109.834 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.2 p30 -56.62 -34.42 67.23 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -67.64 -52.4 38.61 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 120.23 -1.544 . . . . 0.0 110.709 168.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.457 ' HB2' ' H ' ' A' ' 26' ' ' SER . 46.7 mt-10 -61.52 -50.83 71.12 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.783 -1.198 . . . . 0.0 112.462 -173.358 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.5 pt -59.46 -38.02 72.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 119.265 0.939 . . . . 0.0 112.036 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.56 -35.2 77.11 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.409 1.004 . . . . 0.0 111.79 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -69.56 -52.99 21.1 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.578 1.151 . . . . 0.0 112.796 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -64.41 -32.95 59.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 O-C-N 121.269 -0.894 . . . . 0.0 111.53 -177.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mp -63.58 -23.26 67.31 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.521 1.529 . . . . 0.0 112.207 176.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -80.03 -15.02 58.08 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -87.85 -11.76 46.87 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.68 0.792 . . . . 0.0 112.055 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.9 ptpt -127.34 -23.03 3.59 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -173.582 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.7 1.24 0.07 OUTLIER Glycine 0 N--CA 1.47 0.914 0 N-CA-C 115.948 1.139 . . . . 0.0 115.948 152.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -89.89 -27.36 19.94 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 118.43 1.115 . . . . 0.0 112.869 -167.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 29.19 40.87 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 130.426 3.491 . . . . 0.0 114.205 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.605 HG21 HD22 ' A' ' 8' ' ' LEU . 2.6 p -82.66 139.57 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.618 0.767 . . . . 0.0 108.995 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.6 158.21 31.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 127.471 2.308 . . . . 0.0 111.971 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.63 -29.69 64.75 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.398 1.479 . . . . 0.0 113.596 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -65.24 -37.42 87.19 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.003 1.321 . . . . 0.0 111.25 -175.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.3 m -82.25 -52.3 7.08 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 128.261 2.624 . . . . 0.0 109.701 -177.065 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.84 -29.27 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.027 -171.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.87 -52.55 62.66 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.377 1.471 . . . . 0.0 110.241 175.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -72.5 -9.59 58.74 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.917 -174.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.85 -45.83 11.19 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.537 1.135 . . . . 0.0 112.732 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -55.37 -24.16 28.14 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.348 0.976 . . . . 0.0 112.847 176.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.2 tt0 -62.56 -50.2 72.28 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.785 1.234 . . . . 0.0 112.937 175.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.4 ptt? -84.51 -26.29 28.2 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -169.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.436 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.2 mt -70.58 -57.65 4.52 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.622 1.169 . . . . 0.0 112.129 178.22 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.38 5.8 0.02 OUTLIER Glycine 0 CA--C 1.535 1.338 0 N-CA-C 118.194 2.038 . . . . 0.0 118.194 173.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.9 mt -107.22 134.18 20.03 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 119.411 1.606 . . . . 0.0 111.857 -169.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.43 -66.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.485 2.79 . . . . 0.0 109.842 169.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.2 p -150.08 -3.51 0.37 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.749 2.02 . . . . 0.0 113.247 167.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 52.4 m 55.4 -4.08 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 128.987 2.915 . . . . 0.0 116.235 -165.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.9 ttt85 -79.2 -42.57 25.73 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.17 1.388 . . . . 0.0 109.309 176.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -73.99 -21.04 60.15 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.736 1.215 . . . . 0.0 113.62 174.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -73.87 -41.29 62.42 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.604 1.162 . . . . 0.0 111.981 168.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -72.4 -59.72 2.59 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.85 1.66 . . . . 0.0 113.176 -178.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.254 1.335 0 C-N-CA 126.023 1.729 . . . . 0.0 114.386 -167.899 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.773 HD12 HD23 ' A' ' 8' ' ' LEU . 42.1 mt . . . . . 0 C--O 1.237 0.444 0 CA-C-O 121.695 0.76 . . . . 0.0 112.496 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.1 p -71.96 -168.55 0.39 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.882 1.273 . . . . 0.0 112.2 175.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -49.65 -25.4 2.83 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.238 1.415 . . . . 0.0 114.387 172.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.68 43.3 0.15 Allowed Glycine 0 C--N 1.341 0.835 0 CA-C-O 117.857 -1.524 . . . . 0.0 115.563 174.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -63.86 -11.13 24.82 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.625 2.213 . . . . 0.0 113.973 -179.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.773 HD23 HD12 ' A' ' 3' ' ' LEU . 1.7 pp -110.61 -17.81 13.32 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.732 1.213 . . . . 0.0 113.136 167.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.573 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.2 ttp -71.4 -63.15 1.17 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.573 1.549 . . . . 0.0 110.595 -178.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.485 ' C ' HD22 ' A' ' 11' ' ' LEU . 20.0 pttt -73.07 18.07 0.11 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.054 1.342 . . . . 0.0 113.791 -174.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.485 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -127.52 -43.72 1.57 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 129.621 3.168 . . . . 0.0 110.909 -171.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.5 pt -60.74 -36.42 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 119.082 0.855 . . . . 0.0 111.564 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.436 ' HG2' HD22 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -82.29 -18.77 41.16 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 178.428 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -96.48 -20.86 18.09 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.812 2.045 . . . . 0.0 111.908 -167.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -96.7 -50.15 11.64 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.166 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 169.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.3 t -65.02 -35.88 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 O-C-N 120.597 -1.315 . . . . 0.0 111.19 -171.064 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -80.22 -2.66 45.88 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.0 t30 -109.38 -19.57 13.22 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.721 1.609 . . . . 0.0 113.072 -175.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -91.4 -89.62 0.17 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.766 0.826 . . . . 0.0 111.734 -169.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -141.02 82.71 1.85 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.698 1.199 . . . . 0.0 110.051 -177.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.9 mtmm -60.62 -21.66 62.94 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.18 0.992 . . . . 0.0 113.261 173.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -69.79 -25.55 63.84 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 128.033 2.533 . . . . 0.0 115.04 167.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -143.1 70.81 18.42 Favored Pre-proline 0 N--CA 1.479 1.015 0 C-N-CA 127.645 2.378 . . . . 0.0 109.742 -176.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.48 166.49 29.67 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.585 2.857 . . . . 0.0 113.502 -165.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -78.68 -170.94 2.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.073 1.349 . . . . 0.0 111.011 164.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.1 m -149.88 175.94 11.19 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.389 1.476 . . . . 0.0 110.048 169.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 27.1 p30 -57.41 -31.05 65.46 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -66.86 -53.02 36.66 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.331 -1.481 . . . . 0.0 110.666 167.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.4 ' O ' HD12 ' A' ' 33' ' ' ILE . 6.4 mm-40 -66.77 -43.07 84.99 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 120.621 -1.299 . . . . 0.0 113.275 -172.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.7 pt -60.04 -40.0 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-N 120.164 1.347 . . . . 0.0 111.912 171.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.18 -34.89 77.3 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 120.06 1.3 . . . . 0.0 112.28 173.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -67.63 -53.61 26.53 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.796 1.639 . . . . 0.0 112.459 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.442 HG22 ' HE3' ' A' ' 37' ' ' LYS . 1.8 mt -66.66 -32.8 59.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 121.373 -0.83 . . . . 0.0 111.406 -179.335 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.92 -24.06 66.73 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.161 0.985 . . . . 0.0 112.131 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 pttm -80.01 -15.18 57.76 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -87.65 -12.96 43.97 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.899 0.88 . . . . 0.0 112.294 -178.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.442 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.1 ptpt -126.33 -20.51 4.42 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -173.478 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.13 -0.13 0.08 OUTLIER Glycine 0 N--CA 1.47 0.923 0 N-CA-C 115.812 1.085 . . . . 0.0 115.812 151.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -89.24 -31.47 17.87 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 118.634 1.217 . . . . 0.0 112.728 -167.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 28.55 43.69 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 130.338 3.455 . . . . 0.0 114.018 -171.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.567 HG21 HD22 ' A' ' 8' ' ' LEU . 2.7 p -81.25 142.31 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 174.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -82.92 163.55 21.02 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 128.365 2.666 . . . . 0.0 111.98 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -56.68 -36.17 69.29 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.909 1.283 . . . . 0.0 113.807 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -66.58 -32.41 73.73 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.356 1.062 . . . . 0.0 111.175 -169.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.5 m -80.93 -52.02 7.91 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.643 2.777 . . . . 0.0 109.842 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.35 -30.81 50.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.268 1.027 . . . . 0.0 110.949 -173.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.49 -37.18 74.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.107 2.163 . . . . 0.0 112.255 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.6 mtmm -79.56 -14.95 58.49 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -82.77 -40.27 20.69 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.3 ptt-85 -52.86 -26.28 14.19 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 175.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.9 -39.99 75.88 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.413 1.085 . . . . 0.0 112.957 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 23.9 ptp -80.25 -23.48 40.79 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.573 HD21 ' HG3' ' A' ' 9' ' ' MET . 4.2 mt -81.54 -61.42 1.94 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.113 1.365 . . . . 0.0 111.981 176.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.31 5.25 0.05 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 118.035 1.974 . . . . 0.0 118.035 168.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.0 mt -95.05 128.7 38.0 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 119.492 1.646 . . . . 0.0 111.452 -172.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -73.12 -49.36 0.23 Allowed 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.526 3.484 . . . . 0.0 113.445 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.3 p -139.84 -68.41 0.42 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.739 1.616 . . . . 0.0 109.88 169.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 62.8 m 121.2 -20.3 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.005 1 C-N-CA 134.351 5.06 . . . . 0.0 110.747 -164.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -74.78 -41.12 60.63 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.083 2.153 . . . . 0.0 109.697 174.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.17 -21.31 43.2 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.708 0.803 . . . . 0.0 112.948 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -69.76 -32.78 71.48 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.909 1.284 . . . . 0.0 112.055 173.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -82.46 -59.92 2.37 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.085 1.754 . . . . 0.0 113.16 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 C--O 1.253 1.25 0 C-N-CA 125.932 1.693 . . . . 0.0 114.64 -163.596 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.729 HD12 HD23 ' A' ' 8' ' ' LEU . 35.4 mt . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.1 p -71.83 -168.78 0.39 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 125.374 1.47 . . . . 0.0 112.671 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -49.04 -24.79 1.69 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.284 1.434 . . . . 0.0 114.469 173.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.92 46.25 0.12 Allowed Glycine 0 C--N 1.341 0.835 0 CA-C-O 118.228 -1.318 . . . . 0.0 115.552 170.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.21 -17.13 39.28 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.822 2.311 . . . . 0.0 113.175 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.729 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -109.33 -18.7 13.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.632 1.173 . . . . 0.0 112.582 170.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.7 ttm -71.18 -63.11 1.17 Allowed 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.586 1.555 . . . . 0.0 110.274 -175.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.497 ' C ' HD22 ' A' ' 11' ' ' LEU . 5.3 pttm -76.61 18.99 0.29 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.564 1.145 . . . . 0.0 113.547 -172.279 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.497 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.1 mm? -128.3 -39.02 1.73 Allowed 'General case' 0 C--O 1.233 0.229 0 C-N-CA 129.706 3.202 . . . . 0.0 110.726 -171.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -65.03 -35.45 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.027 0.831 . . . . 0.0 111.696 -176.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.82 -11.93 54.66 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -92.92 -17.95 23.37 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 127.297 2.239 . . . . 0.0 111.825 -170.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.15 -46.28 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 125.056 1.342 . . . . 0.0 109.671 168.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.4 t -65.99 -36.19 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-N 119.58 1.082 . . . . 0.0 111.309 -173.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -78.97 -1.19 34.19 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -107.11 -15.82 14.58 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.701 1.6 . . . . 0.0 112.998 -177.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -98.45 -93.06 0.25 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.781 0.832 . . . . 0.0 112.386 -170.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -136.38 92.09 2.74 Favored 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 124.63 1.172 . . . . 0.0 110.372 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.0 mttt -58.56 -20.38 46.18 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.737 0.815 . . . . 0.0 112.938 166.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.58 -20.46 60.61 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 127.745 2.418 . . . . 0.0 113.919 170.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -146.85 72.7 12.45 Favored Pre-proline 0 N--CA 1.477 0.877 0 C-N-CA 127.457 2.303 . . . . 0.0 109.754 -176.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.62 155.44 68.91 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.835 2.357 . . . . 0.0 112.4 -168.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -75.54 169.1 18.76 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.676 0.75 . . . . 0.0 110.19 164.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.464 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 81.1 p -124.63 168.55 12.99 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.359 1.464 . . . . 0.0 109.746 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.8 p30 -53.92 -32.13 52.54 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 175.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -67.98 -55.04 14.15 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 119.616 -1.927 . . . . 0.0 110.726 167.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.464 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.0 mm-40 -61.08 -50.05 74.85 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 120.81 -1.181 . . . . 0.0 112.784 -173.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.1 pt -59.54 -37.76 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 119.856 1.207 . . . . 0.0 112.278 173.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.54 -35.14 78.5 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.508 1.049 . . . . 0.0 111.74 177.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -68.39 -52.53 31.98 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.413 1.085 . . . . 0.0 112.7 -178.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.513 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -64.3 -32.69 58.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 121.347 -0.846 . . . . 0.0 111.621 -177.259 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -65.01 -21.67 66.88 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.631 1.572 . . . . 0.0 112.67 176.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -80.09 -15.55 56.9 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -86.39 -13.96 44.82 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 123.132 0.573 . . . . 0.0 111.926 -176.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.513 ' HE3' HG22 ' A' ' 33' ' ' ILE . 15.3 ptpt -130.15 -26.36 2.37 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 116.93 2.196 . . . . 0.0 116.93 -167.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 165.26 10.35 0.03 OUTLIER Glycine 0 N--CA 1.471 1.007 0 N-CA-C 117.126 1.61 . . . . 0.0 117.126 163.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -112.12 -36.11 5.44 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 118.895 1.347 . . . . 0.0 112.385 -167.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.27 1.4 ttpt 40.3 43.84 1.51 Allowed 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 128.33 2.652 . . . . 0.0 113.095 175.12 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.617 HG21 HD22 ' A' ' 8' ' ' LEU . 3.5 p -91.44 144.44 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.842 2.057 . . . . 0.0 109.129 177.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.54 170.73 10.25 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.612 2.765 . . . . 0.0 112.853 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -59.73 -33.84 72.15 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 125.694 1.598 . . . . 0.0 114.052 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -38.34 85.87 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.73 1.212 . . . . 0.0 111.278 -172.129 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.6 m -86.68 -47.96 8.7 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 127.137 2.175 . . . . 0.0 109.036 -172.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.15 -31.65 54.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.667 -174.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.57 -46.94 74.36 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 125.597 1.559 . . . . 0.0 111.118 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -68.06 -20.01 64.93 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.414 1.086 . . . . 0.0 112.595 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -82.78 -48.3 10.96 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.072 0.949 . . . . 0.0 112.072 178.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -54.53 -29.8 51.78 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 119.906 1.23 . . . . 0.0 112.08 171.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -71.91 -38.04 69.97 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.384 1.074 . . . . 0.0 113.364 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 15.0 ptm -84.97 -28.37 25.84 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.8 mp -69.76 -64.05 0.96 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.106 0.962 . . . . 0.0 111.478 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.47 2.59 0.03 OUTLIER Glycine 0 CA--C 1.538 1.509 0 N-CA-C 118.516 2.166 . . . . 0.0 118.516 175.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.6 mt -90.23 132.16 36.6 Favored Pre-proline 0 CA--C 1.547 0.85 0 CA-C-N 119.59 1.695 . . . . 0.0 110.912 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.73 -62.05 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.503 2.802 . . . . 0.0 110.594 173.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.4 p -151.9 -7.71 0.22 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 164.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 72.0 m 58.45 -16.45 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 127.872 2.469 . . . . 0.0 116.272 -166.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 -66.37 -43.01 87.15 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.14 1.376 . . . . 0.0 108.402 167.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -22.69 52.91 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.192 0.997 . . . . 0.0 113.587 -178.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.9 mtp180 -74.31 -42.99 58.57 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.208 1.403 . . . . 0.0 111.796 170.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -72.33 -59.24 2.83 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.497 1.519 . . . . 0.0 112.694 -176.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.784 1.634 . . . . 0.0 114.469 -169.266 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.735 HD12 HD23 ' A' ' 8' ' ' LEU . 18.4 mt . . . . . 0 N--CA 1.467 0.403 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.0 p -74.56 -170.4 1.02 Allowed 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.191 175.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.03 -26.81 1.95 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.349 1.46 . . . . 0.0 114.663 172.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -170.55 38.09 0.18 Allowed Glycine 0 C--N 1.34 0.77 0 CA-C-O 117.608 -1.662 . . . . 0.0 115.688 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.1 -13.77 19.53 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.902 2.351 . . . . 0.0 113.26 176.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.735 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -107.75 -18.56 13.79 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.176 0.99 . . . . 0.0 112.976 168.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.3 ttt -70.09 -62.62 1.31 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.633 1.573 . . . . 0.0 110.301 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.526 ' C ' HD22 ' A' ' 11' ' ' LEU . 18.3 pttt -76.78 17.06 0.44 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.04 1.336 . . . . 0.0 113.215 -172.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.526 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -129.45 -35.55 1.74 Allowed 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 129.236 3.014 . . . . 0.0 111.482 -171.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pt -61.59 -34.92 63.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 119.291 0.95 . . . . 0.0 111.312 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.0 -12.39 36.02 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -93.2 -17.89 23.18 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 127.125 2.17 . . . . 0.0 111.819 -174.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.51 -48.51 11.19 Favored 'Isoleucine or valine' 0 C--N 1.341 0.229 0 C-N-CA 124.863 1.265 . . . . 0.0 109.427 169.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 72.8 t -63.03 -39.26 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 119.671 1.123 . . . . 0.0 111.013 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -82.1 5.09 20.65 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -111.58 -15.48 13.48 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.312 1.845 . . . . 0.0 113.583 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -94.95 -86.25 0.29 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.341 1.056 . . . . 0.0 111.874 -174.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -139.7 87.95 2.21 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.85 1.26 . . . . 0.0 110.107 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -54.35 -27.63 37.42 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.441 1.096 . . . . 0.0 112.8 169.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -81.18 -12.93 59.07 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.035 2.134 . . . . 0.0 114.175 177.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -146.51 73.65 12.76 Favored Pre-proline 0 N--CA 1.481 1.11 0 C-N-CA 127.43 2.292 . . . . 0.0 110.514 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -73.11 167.95 26.01 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.07 2.513 . . . . 0.0 113.408 -169.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -88.29 -175.29 4.97 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.464 1.505 . . . . 0.0 111.619 171.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.478 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 26.6 p -139.98 171.64 13.9 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.798 2.039 . . . . 0.0 110.166 176.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.0 p-10 -48.04 -48.4 33.06 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -62.48 -48.74 78.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.293 -1.504 . . . . 0.0 110.449 174.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.478 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.9 mm-40 -63.22 -49.8 72.75 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 120.849 -1.157 . . . . 0.0 112.545 -174.252 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.6 pt -59.36 -38.16 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.322 0.964 . . . . 0.0 112.437 173.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.83 -35.85 77.58 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.387 0.994 . . . . 0.0 111.658 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -68.77 -52.83 26.17 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.502 1.121 . . . . 0.0 112.853 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.493 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -64.36 -32.65 58.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.337 -0.852 . . . . 0.0 111.793 -177.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mp -62.64 -23.81 67.28 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.504 1.522 . . . . 0.0 112.451 174.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -79.19 -15.67 57.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 176.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -86.95 -12.94 46.09 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.465 0.706 . . . . 0.0 112.08 -176.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.493 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.2 ptpt -127.56 -21.28 3.82 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -172.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.2 1.91 0.07 OUTLIER Glycine 0 N--CA 1.471 0.991 0 N-CA-C 116.05 1.18 . . . . 0.0 116.05 151.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.413 ' HB3' HD11 ' A' ' 3' ' ' LEU . 49.4 m-85 -91.29 -21.36 21.1 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.355 1.077 . . . . 0.0 113.803 -165.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.05 28.12 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 130.531 3.532 . . . . 0.0 115.62 -175.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.583 HG21 HD22 ' A' ' 8' ' ' LEU . 3.6 p -84.06 141.29 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 121.49 0.662 . . . . 0.0 109.254 -170.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.0 166.23 15.23 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 128.412 2.685 . . . . 0.0 112.562 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 44.2 ttp85 -58.77 -32.19 69.06 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 125.767 1.627 . . . . 0.0 114.263 -173.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -65.05 -39.68 93.64 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.142 0.972 . . . . 0.0 111.5 -174.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.421 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 1.9 m -77.85 -49.6 13.93 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 127.345 2.258 . . . . 0.0 108.943 -175.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -31.1 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.825 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.412 -173.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.6 -37.88 67.99 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.874 1.67 . . . . 0.0 111.961 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -68.95 -22.71 64.11 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 175.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -84.62 -47.99 9.96 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.316 1.047 . . . . 0.0 112.423 -176.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.6 ptm85 -54.78 -28.37 48.35 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.337 0.971 . . . . 0.0 112.28 171.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -72.91 -34.24 66.5 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.925 0.89 . . . . 0.0 112.914 176.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.8 ptt? -92.17 -29.39 16.5 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 mp -67.17 -63.93 0.96 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.82 0.848 . . . . 0.0 111.264 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.88 3.22 0.03 OUTLIER Glycine 0 CA--C 1.538 1.471 0 N-CA-C 118.414 2.126 . . . . 0.0 118.414 173.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 47.6 mt -79.54 128.26 75.56 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-N 119.826 1.813 . . . . 0.0 111.038 -176.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -50.29 -68.87 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 125.213 3.942 . . . . 0.0 112.34 165.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.3 m 165.66 106.64 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.174 1 C-N-CA 134.638 5.175 . . . . 0.0 105.395 167.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.6 m -42.33 -5.53 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 131.128 3.771 . . . . 0.0 119.122 -169.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -70.38 -15.76 62.89 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.972 1.309 . . . . 0.0 112.116 167.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -118.53 -11.93 9.86 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -69.07 -50.41 48.63 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.713 0.688 . . . . 0.0 112.516 169.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -74.11 -56.16 5.25 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.011 1.724 . . . . 0.0 113.267 -171.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.256 1.404 0 C-N-CA 126.291 1.836 . . . . 0.0 114.339 -167.848 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.726 HD12 HD23 ' A' ' 8' ' ' LEU . 21.2 mt . . . . . 0 CA--C 1.538 0.502 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.6 p -74.03 -168.96 0.68 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.416 1.486 . . . . 0.0 112.55 177.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -48.64 -25.05 1.57 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.82 1.648 . . . . 0.0 114.667 172.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.73 45.65 0.12 Allowed Glycine 0 C--N 1.341 0.817 0 CA-C-O 118.073 -1.404 . . . . 0.0 115.305 172.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.41 -15.19 34.48 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 120.38 2.09 . . . . 0.0 113.421 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.726 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -108.51 -19.18 13.53 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.777 1.231 . . . . 0.0 113.007 169.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.531 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.2 ttt -73.9 -58.38 3.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.077 1.751 . . . . 0.0 111.442 -174.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.447 ' C ' HD22 ' A' ' 11' ' ' LEU . 21.6 pttt -76.99 17.1 0.46 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.405 1.082 . . . . 0.0 112.971 -173.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.447 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -125.65 -43.93 1.85 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 129.908 3.283 . . . . 0.0 110.359 -170.575 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.9 pt -61.51 -36.45 73.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 118.344 0.52 . . . . 0.0 111.91 -177.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.07 -17.79 41.95 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 177.639 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -96.96 -15.45 21.12 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 127.117 2.167 . . . . 0.0 112.003 -168.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -102.04 -47.97 11.1 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 C-N-CA 124.63 1.172 . . . . 0.0 109.013 166.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.1 t -65.64 -35.77 76.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 119.903 1.229 . . . . 0.0 111.635 -172.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -82.03 4.7 21.89 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -118.95 -9.96 9.96 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.309 1.844 . . . . 0.0 114.042 -177.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -101.52 -82.62 0.47 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.97 0.908 . . . . 0.0 112.139 -174.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -139.22 84.11 1.98 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.526 1.13 . . . . 0.0 111.089 -173.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -58.31 -25.07 61.45 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.161 0.984 . . . . 0.0 113.181 171.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -16.66 56.03 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 127.152 2.181 . . . . 0.0 114.956 172.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -147.53 76.07 11.02 Favored Pre-proline 0 N--CA 1.479 1.025 0 C-N-CA 126.769 2.028 . . . . 0.0 110.126 -178.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -69.18 162.28 42.42 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.041 2.494 . . . . 0.0 112.86 -171.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -79.68 -173.13 3.65 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.731 1.212 . . . . 0.0 110.756 167.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.49 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 52.3 p -138.03 168.19 20.22 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.995 1.318 . . . . 0.0 111.154 171.376 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.2 p30 -52.1 -30.99 28.64 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 175.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -68.11 0.32 Allowed 'General case' 0 C--N 1.333 -0.124 0 O-C-N 120.322 -1.486 . . . . 0.0 110.08 165.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.49 ' HB2' ' H ' ' A' ' 26' ' ' SER . 38.1 mt-10 -57.5 -49.33 76.65 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.222 1.009 . . . . 0.0 112.86 -170.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.4 pt -59.32 -37.29 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 119.193 0.906 . . . . 0.0 112.166 174.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.15 -34.62 78.47 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.862 1.21 . . . . 0.0 111.878 175.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -68.02 -53.47 25.61 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.235 1.014 . . . . 0.0 112.604 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.482 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -63.73 -32.68 57.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 121.572 -0.705 . . . . 0.0 111.617 -176.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.98 -23.1 67.21 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.394 1.477 . . . . 0.0 112.295 175.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -80.25 -15.77 56.23 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -86.24 -13.08 47.89 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.604 0.762 . . . . 0.0 112.163 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.482 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.0 ptpt -127.17 -21.99 3.83 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -172.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.54 2.6 0.07 OUTLIER Glycine 0 N--CA 1.47 0.916 0 N-CA-C 115.97 1.148 . . . . 0.0 115.97 151.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -89.38 -21.93 22.83 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 118.265 1.032 . . . . 0.0 113.443 -167.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.49 30.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 130.368 3.467 . . . . 0.0 115.298 -176.244 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.596 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -83.0 138.43 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 121.576 0.703 . . . . 0.0 109.238 -172.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.05 159.92 28.43 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 127.72 2.408 . . . . 0.0 112.21 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.83 -29.73 63.09 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.261 1.424 . . . . 0.0 113.543 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -32.27 72.71 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.61 1.164 . . . . 0.0 111.722 -175.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.1 m -87.14 -48.64 7.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.104 2.562 . . . . 0.0 110.059 -177.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.24 -30.11 49.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.096 -174.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.21 -37.96 86.81 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.223 1.409 . . . . 0.0 111.042 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -75.34 -17.94 60.12 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.456 1.102 . . . . 0.0 112.311 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.74 -50.13 7.41 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.46 1.104 . . . . 0.0 112.635 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.81 -23.58 18.85 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 175.318 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -68.78 -43.74 75.12 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.0 1.32 . . . . 0.0 112.585 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -87.63 -28.14 22.06 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -173.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.531 HD21 ' HG3' ' A' ' 9' ' ' MET . 0.9 OUTLIER -69.26 -59.21 3.16 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.319 1.048 . . . . 0.0 111.695 177.132 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.92 4.52 0.03 OUTLIER Glycine 0 CA--C 1.534 1.257 0 N-CA-C 118.312 2.085 . . . . 0.0 118.312 170.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 35.3 mt -91.81 121.47 67.01 Favored Pre-proline 0 CA--C 1.545 0.754 0 CA-C-N 120.014 1.907 . . . . 0.0 111.047 -173.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.94 -58.07 0.16 Allowed 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.382 2.721 . . . . 0.0 110.204 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.7 p -150.81 -8.87 0.25 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 160.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 77.4 p 60.61 -15.86 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 128.878 2.871 . . . . 0.0 116.151 -166.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 63.3 ttt180 -71.61 -43.74 65.68 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.345 1.458 . . . . 0.0 109.351 167.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -22.34 61.02 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -178.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -74.69 -39.5 61.94 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.776 1.63 . . . . 0.0 112.149 169.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -74.11 -59.09 2.88 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.568 1.547 . . . . 0.0 112.931 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.725 2.01 . . . . 0.0 114.483 -167.505 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.735 HD12 HD23 ' A' ' 8' ' ' LEU . 25.6 mt . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.8 p -73.88 -170.56 0.92 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.337 1.455 . . . . 0.0 112.245 176.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -49.23 -25.44 2.29 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.589 1.555 . . . . 0.0 114.599 172.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -171.68 40.66 0.17 Allowed Glycine 0 C--N 1.343 0.918 0 CA-C-O 117.682 -1.621 . . . . 0.0 115.682 175.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.61 -13.96 26.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 120.815 2.307 . . . . 0.0 113.467 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.735 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -108.72 -18.86 13.61 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.385 1.074 . . . . 0.0 113.151 168.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.617 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.4 ttp -71.64 -61.55 1.74 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.592 1.557 . . . . 0.0 111.104 -177.541 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.453 ' C ' HD22 ' A' ' 11' ' ' LEU . 19.6 pttt -75.17 17.01 0.27 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.305 1.042 . . . . 0.0 113.193 -171.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.453 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -125.4 -45.82 1.79 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 129.82 3.248 . . . . 0.0 110.392 -169.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.0 pt -59.64 -36.85 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt -82.76 -14.6 54.18 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 174.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -90.87 -17.76 25.96 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 125.55 1.54 . . . . 0.0 112.094 -174.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.39 -45.19 11.18 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 C-N-CA 124.167 0.987 . . . . 0.0 109.32 170.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.77 -31.18 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 O-C-N 120.891 -1.131 . . . . 0.0 111.225 -174.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -79.08 -2.39 40.32 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.253 -0.905 . . . . 0.0 112.816 174.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -108.73 -14.46 14.6 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.903 1.681 . . . . 0.0 112.851 -176.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -103.4 -102.59 0.29 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.201 0.909 . . . . 0.0 112.095 -168.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -139.96 80.82 1.79 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.495 1.118 . . . . 0.0 109.896 -172.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -62.62 -17.31 60.05 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 174.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -66.09 -22.29 66.4 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 127.212 2.205 . . . . 0.0 114.623 164.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -142.6 66.22 18.06 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 128.29 2.636 . . . . 0.0 109.637 177.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -70.23 162.0 43.93 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.318 2.679 . . . . 0.0 113.424 -163.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -77.53 170.01 17.3 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.845 0.831 . . . . 0.0 111.106 166.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.482 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 89.8 p -124.69 170.31 11.11 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 126.003 1.721 . . . . 0.0 109.846 178.045 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.4 p30 -53.98 -32.65 54.68 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -68.54 -54.67 15.25 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 119.776 -1.827 . . . . 0.0 110.789 168.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.482 ' HB2' ' H ' ' A' ' 26' ' ' SER . 91.9 mt-10 -62.55 -47.85 82.06 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 120.704 -1.247 . . . . 0.0 112.714 -173.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.3 pt -58.94 -38.92 76.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-N 119.871 1.214 . . . . 0.0 112.317 172.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.8 -35.41 78.11 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.543 1.065 . . . . 0.0 111.892 176.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -68.87 -52.62 27.69 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.518 1.127 . . . . 0.0 112.74 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.7 mt -64.03 -33.18 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 118.841 0.746 . . . . 0.0 111.269 -177.364 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.13 -24.93 68.12 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.369 1.468 . . . . 0.0 112.486 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -14.82 58.26 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 176.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -86.5 -13.19 46.73 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.436 0.694 . . . . 0.0 112.017 -178.08 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.1 ptpt -126.49 -22.55 3.95 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -172.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.04 2.54 0.08 OUTLIER Glycine 0 N--CA 1.47 0.933 0 CA-C-N 119.562 1.074 . . . . 0.0 115.668 151.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -87.16 -23.12 24.92 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 118.331 1.065 . . . . 0.0 113.303 -168.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.8 30.88 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 130.351 3.461 . . . . 0.0 115.109 -175.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.567 HG21 HD22 ' A' ' 8' ' ' LEU . 3.0 p -82.07 138.55 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.56 0.695 . . . . 0.0 109.226 -174.301 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.9 161.59 24.31 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 127.894 2.478 . . . . 0.0 112.033 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.63 -27.57 67.89 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 125.386 1.474 . . . . 0.0 113.853 -178.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.28 -32.51 72.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.118 0.967 . . . . 0.0 111.956 -177.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 m -84.09 -51.35 7.15 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 128.298 2.639 . . . . 0.0 109.914 -177.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.57 -29.06 45.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.848 -172.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.6 94.65 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.303 1.441 . . . . 0.0 110.91 176.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -71.43 -16.63 62.39 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.509 0.723 . . . . 0.0 112.487 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -85.97 -51.61 6.25 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.222 1.009 . . . . 0.0 112.267 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -54.36 -25.42 24.19 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.035 0.834 . . . . 0.0 112.679 175.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -68.77 -40.32 79.77 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.331 1.452 . . . . 0.0 113.025 178.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -92.88 -25.44 18.08 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -173.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.617 HD21 ' HG3' ' A' ' 9' ' ' MET . 0.8 OUTLIER -71.2 -60.56 2.17 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.625 1.17 . . . . 0.0 112.013 177.705 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 177.17 -0.6 0.03 OUTLIER Glycine 0 CA--C 1.534 1.254 0 N-CA-C 118.141 2.016 . . . . 0.0 118.141 172.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.8 mt -86.85 129.13 53.54 Favored Pre-proline 0 CA--C 1.546 0.794 0 CA-C-N 119.518 1.659 . . . . 0.0 110.628 -177.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.41 -60.02 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.827 2.351 . . . . 0.0 110.387 174.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.5 p -153.27 -7.47 0.17 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 163.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.403 ' HA ' ' HE ' ' A' ' 61' ' ' ARG . 28.9 m 59.26 -21.55 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.977 2.511 . . . . 0.0 116.199 -164.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.7 ttt85 -67.56 -43.15 81.34 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.923 1.238 . . . . 0.0 108.585 170.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -25.6 60.41 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.15 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.403 ' HE ' ' HA ' ' A' ' 58' ' ' SER . 57.3 mtm180 -71.3 -43.47 67.05 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.197 1.399 . . . . 0.0 112.244 169.306 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -74.19 -61.04 1.99 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.682 1.593 . . . . 0.0 113.31 -176.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.1 tp . . . . . 0 C--O 1.255 1.355 0 C-N-CA 126.515 1.926 . . . . 0.0 114.593 -166.108 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.728 HD12 HD23 ' A' ' 8' ' ' LEU . 63.8 mt . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 42.9 p -72.19 -163.09 0.1 Allowed 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 125.68 1.592 . . . . 0.0 112.635 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -48.16 -25.35 1.44 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.065 1.346 . . . . 0.0 114.335 169.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 176.14 53.96 0.06 OUTLIER Glycine 0 CA--C 1.527 0.808 0 CA-C-O 118.728 -1.04 . . . . 0.0 114.276 168.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -64.87 -13.54 56.66 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.688 1.744 . . . . 0.0 114.202 -175.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.728 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -106.0 -19.7 13.65 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.218 1.007 . . . . 0.0 113.113 168.115 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.583 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.0 ttp -72.25 -60.21 2.35 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.092 1.757 . . . . 0.0 110.68 -177.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.467 ' C ' HD22 ' A' ' 11' ' ' LEU . 9.3 pttp -75.28 15.78 0.41 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.601 1.16 . . . . 0.0 113.459 -173.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.467 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.6 mm? -127.03 -41.59 1.78 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 129.404 3.082 . . . . 0.0 111.391 -170.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.0 pt -60.95 -33.83 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 119.069 0.85 . . . . 0.0 112.125 178.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -17.58 44.65 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 175.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -96.71 -13.03 23.01 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 126.439 1.896 . . . . 0.0 111.929 -170.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.28 -48.7 9.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.183 0 C-N-CA 124.482 1.113 . . . . 0.0 108.776 167.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.2 -32.49 57.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 120.282 1.401 . . . . 0.0 111.434 -172.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -78.29 -2.76 39.52 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.381 -0.824 . . . . 0.0 112.893 175.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -117.22 -9.19 11.03 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.432 1.893 . . . . 0.0 113.816 -172.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -102.66 -97.78 0.29 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.003 0.82 . . . . 0.0 112.263 -170.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -137.33 83.21 1.98 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.588 1.155 . . . . 0.0 110.219 -177.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -62.46 -17.96 60.67 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 175.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.51 ' H ' ' HD3' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -79.96 -12.48 59.72 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.814 2.046 . . . . 0.0 114.799 168.491 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -145.06 67.06 13.17 Favored Pre-proline 0 N--CA 1.48 1.075 0 C-N-CA 127.368 2.267 . . . . 0.0 109.624 175.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.15 165.44 32.7 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.956 2.437 . . . . 0.0 112.99 -164.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -77.34 -175.49 3.74 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.684 1.194 . . . . 0.0 111.416 167.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.506 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 93.2 p -136.64 170.87 15.35 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.651 1.98 . . . . 0.0 109.634 171.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.5 p30 -54.03 -32.14 53.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 172.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -67.76 -54.11 21.88 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.011 -1.681 . . . . 0.0 110.691 169.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.506 ' HB2' ' H ' ' A' ' 26' ' ' SER . 22.1 mm-40 -62.45 -47.93 81.86 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 120.812 -1.18 . . . . 0.0 112.663 -174.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.4 pt -58.97 -39.13 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.625 1.102 . . . . 0.0 112.096 173.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.78 -35.37 79.62 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.578 1.081 . . . . 0.0 111.943 176.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -69.18 -52.34 28.89 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.439 1.096 . . . . 0.0 112.819 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.3 mt -64.22 -33.65 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 O-C-N 121.437 -0.789 . . . . 0.0 111.19 -178.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -62.11 -25.65 67.84 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.238 1.415 . . . . 0.0 112.644 176.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -79.01 -15.78 57.79 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -87.21 -12.73 45.96 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 123.446 0.698 . . . . 0.0 112.144 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.0 ptpt -126.79 -21.48 4.05 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -173.185 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.79 2.21 0.07 OUTLIER Glycine 0 N--CA 1.472 1.083 0 N-CA-C 115.932 1.133 . . . . 0.0 115.932 153.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -90.42 -19.75 23.57 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 118.334 1.067 . . . . 0.0 113.43 -167.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 35.82 25.17 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 130.699 3.6 . . . . 0.0 116.095 -175.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.548 HG21 HD22 ' A' ' 8' ' ' LEU . 2.6 p -81.75 137.93 20.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -169.175 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.39 158.73 31.13 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.148 2.179 . . . . 0.0 112.093 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -55.64 -30.81 61.63 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.841 1.257 . . . . 0.0 113.243 175.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -66.37 -34.36 77.8 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.117 1.367 . . . . 0.0 111.615 -174.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.8 m -83.66 -51.91 6.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 129.036 2.934 . . . . 0.0 109.882 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.93 -30.93 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.932 -173.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.84 -34.7 77.22 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.862 1.665 . . . . 0.0 111.788 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -84.18 -9.55 58.46 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.416 1.086 . . . . 0.0 112.989 176.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -90.03 -51.37 5.5 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.82 1.248 . . . . 0.0 112.297 176.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -20.31 5.96 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 174.046 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -65.26 -42.59 93.11 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.761 1.625 . . . . 0.0 113.143 173.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -94.61 -26.33 16.41 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.583 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.1 mt -73.73 -59.69 2.6 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.404 1.082 . . . . 0.0 112.166 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.89 -8.47 0.03 OUTLIER Glycine 0 CA--C 1.533 1.213 0 N-CA-C 118.142 2.017 . . . . 0.0 118.142 167.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.4 mt -69.6 121.63 83.04 Favored Pre-proline 0 CA--C 1.542 0.642 0 CA-C-N 119.439 1.62 . . . . 0.0 110.743 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.88 -64.36 0.05 OUTLIER 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.116 2.544 . . . . 0.0 109.308 178.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.1 p -150.94 -10.17 0.24 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.122 1.369 . . . . 0.0 114.422 158.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.3 m 56.85 -17.82 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 128.389 2.676 . . . . 0.0 116.455 -163.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -67.21 -42.34 84.29 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 120.308 1.413 . . . . 0.0 108.743 166.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.81 -22.11 60.87 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -71.27 -46.49 60.8 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.643 1.577 . . . . 0.0 111.667 166.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -75.37 -59.44 2.75 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.515 1.926 . . . . 0.0 113.405 -170.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 C--O 1.253 1.285 0 C-N-CA 127.384 2.274 . . . . 0.0 114.525 -167.596 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.777 HD12 HD23 ' A' ' 8' ' ' LEU . 20.6 mt . . . . . 0 C--O 1.236 0.361 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 60.2 p -73.44 -172.59 1.21 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.035 1.334 . . . . 0.0 111.582 171.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -51.86 -23.58 5.03 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.206 1.402 . . . . 0.0 114.73 172.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.64 29.44 0.24 Allowed Glycine 0 C--N 1.34 0.781 0 CA-C-O 117.339 -1.812 . . . . 0.0 116.939 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -62.01 -10.81 10.86 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 121.784 2.792 . . . . 0.0 113.82 178.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.777 HD23 HD12 ' A' ' 3' ' ' LEU . 1.9 pp -111.18 -16.89 13.33 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.624 1.17 . . . . 0.0 113.508 166.425 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.411 ' HG3' HD11 ' A' ' 53' ' ' LEU . 6.3 ttt -68.3 -67.06 0.49 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.224 1.41 . . . . 0.0 110.339 176.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.501 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.9 pttp -73.79 15.88 0.25 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.406 1.482 . . . . 0.0 113.673 -172.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.501 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -127.4 -35.15 2.2 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 128.798 2.839 . . . . 0.0 111.822 -172.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -61.3 -29.96 46.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.471 1.032 . . . . 0.0 112.023 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.52 -9.53 23.2 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -178.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -88.74 -16.61 31.78 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 125.64 1.576 . . . . 0.0 111.56 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 pp -101.45 -51.81 9.06 Favored 'Isoleucine or valine' 0 C--N 1.342 0.265 0 C-N-CA 123.974 0.91 . . . . 0.0 108.786 168.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.7 t -63.88 -35.48 73.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 120.378 1.444 . . . . 0.0 111.325 -172.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -80.77 -0.74 39.96 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -109.9 -19.78 12.99 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.752 1.621 . . . . 0.0 112.991 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -93.82 -95.47 0.16 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.741 0.816 . . . . 0.0 112.202 -167.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -139.98 85.53 2.03 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.194 0.998 . . . . 0.0 110.971 -175.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -58.05 -22.34 49.62 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.571 1.149 . . . . 0.0 113.354 168.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 -68.79 -23.83 64.33 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.079 2.152 . . . . 0.0 114.598 169.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -147.29 70.7 11.87 Favored Pre-proline 0 N--CA 1.481 1.115 0 C-N-CA 127.67 2.388 . . . . 0.0 109.771 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -76.82 173.58 14.24 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.167 2.578 . . . . 0.0 113.772 -165.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -89.8 -175.03 4.5 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.832 1.653 . . . . 0.0 112.158 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.7 p -140.08 175.99 9.13 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 126.749 2.02 . . . . 0.0 109.515 172.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 40.3 p-10 -49.28 -47.3 46.88 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 173.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -60.01 -51.17 70.78 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.025 -1.672 . . . . 0.0 110.706 173.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.418 ' O ' HD12 ' A' ' 33' ' ' ILE . 6.8 mm-40 -66.97 -43.39 83.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 120.934 -1.104 . . . . 0.0 113.366 -174.221 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 pt -60.07 -39.87 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 120.366 1.439 . . . . 0.0 111.881 171.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.84 -35.76 77.39 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.83 1.195 . . . . 0.0 112.257 174.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -67.66 -51.68 46.99 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.713 1.605 . . . . 0.0 112.323 -178.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.488 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -67.55 -32.68 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 O-C-N 121.372 -0.83 . . . . 0.0 111.598 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mp -63.53 -23.14 67.27 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.011 1.324 . . . . 0.0 112.022 175.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -82.37 -14.27 55.53 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 176.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -85.3 -13.33 50.03 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.463 0.705 . . . . 0.0 112.135 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.488 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.8 ptpt -127.38 -21.64 3.82 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -172.405 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.28 1.37 0.09 OUTLIER Glycine 0 N--CA 1.468 0.83 0 N-CA-C 115.521 0.968 . . . . 0.0 115.521 150.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.463 ' HB3' HD11 ' A' ' 3' ' ' LEU . 54.1 m-85 -85.1 -29.47 24.84 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.405 1.102 . . . . 0.0 112.59 -169.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.3 ptmt 28.84 41.81 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 130.388 3.475 . . . . 0.0 114.185 -173.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.665 HG21 HD22 ' A' ' 8' ' ' LEU . 2.4 p -79.78 139.73 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.305 1.042 . . . . 0.0 108.244 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.71 163.68 24.32 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.103 2.161 . . . . 0.0 112.515 177.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -61.78 -30.15 70.61 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 125.545 1.538 . . . . 0.0 114.205 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -71.96 -31.12 66.0 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.62 1.1 . . . . 0.0 111.791 -175.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 m -79.45 -48.89 13.17 Favored 'General case' 0 CA--C 1.505 -0.761 0 C-N-CA 125.853 1.661 . . . . 0.0 108.848 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -64.79 -32.06 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 CA-C-N 115.003 -0.998 . . . . 0.0 110.615 -176.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.95 -36.92 67.27 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 125.218 1.407 . . . . 0.0 112.354 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -75.64 -15.17 60.36 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.954 1.302 . . . . 0.0 112.655 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -90.28 -49.54 6.48 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.249 1.42 . . . . 0.0 111.991 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -22.8 26.63 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.426 1.012 . . . . 0.0 112.963 169.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -69.15 -45.3 70.41 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.706 1.202 . . . . 0.0 112.683 171.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 13.8 ptt? -87.08 -28.98 22.22 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.917 0.887 . . . . 0.0 113.283 -170.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.411 HD11 ' HG3' ' A' ' 9' ' ' MET . 1.3 mp -67.24 -65.52 0.67 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.505 1.122 . . . . 0.0 111.088 172.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.75 6.55 0.03 OUTLIER Glycine 0 CA--C 1.537 1.407 0 N-CA-C 119.594 2.598 . . . . 0.0 119.594 169.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 59.5 mt -82.91 124.13 77.16 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 120.399 2.099 . . . . 0.0 111.839 -173.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -51.57 -60.9 0.63 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 124.967 3.778 . . . . 0.0 112.852 170.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 90.7 p -162.41 -18.43 0.04 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 165.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 60.8 m 61.41 0.56 0.46 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.464 1.905 . . . . 0.0 115.181 -163.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -85.99 -16.28 38.82 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.797 1.639 . . . . 0.0 111.681 165.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.25 -14.01 9.28 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.311 1.444 . . . . 0.0 114.36 -176.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -70.8 -45.92 63.76 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.12 1.368 . . . . 0.0 112.032 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -76.07 -56.22 4.86 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.706 1.603 . . . . 0.0 112.728 -173.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.254 1.297 0 C-N-CA 126.923 2.089 . . . . 0.0 114.529 -168.543 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.744 HD12 HD23 ' A' ' 8' ' ' LEU . 32.1 mt . . . . . 0 CA--C 1.537 0.446 0 CA-C-O 122.012 0.911 . . . . 0.0 113.334 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 38.9 p -73.44 -164.31 0.19 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.009 1.724 . . . . 0.0 112.571 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -49.06 -24.98 1.79 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.433 1.493 . . . . 0.0 114.468 169.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 178.83 51.23 0.08 OUTLIER Glycine 0 C--N 1.341 0.807 0 CA-C-O 118.598 -1.112 . . . . 0.0 114.53 169.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.64 -13.88 55.7 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.913 1.857 . . . . 0.0 113.947 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.744 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -106.37 -19.18 13.77 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.464 1.105 . . . . 0.0 113.106 167.343 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.472 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.5 ttt -72.65 -57.97 3.72 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.322 1.849 . . . . 0.0 111.196 -175.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.479 ' C ' HD22 ' A' ' 11' ' ' LEU . 9.0 pttp -77.08 15.71 0.66 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.691 1.196 . . . . 0.0 113.046 -174.202 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.479 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -126.27 -40.91 1.94 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 129.473 3.109 . . . . 0.0 110.899 -170.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 pt -61.68 -37.85 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 118.776 0.717 . . . . 0.0 111.356 -178.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.94 -16.47 50.4 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -98.25 -16.15 19.54 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 126.452 1.901 . . . . 0.0 112.016 -168.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -99.09 -43.5 11.55 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 C-N-CA 124.737 1.215 . . . . 0.0 109.379 167.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.65 -32.09 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 119.818 1.19 . . . . 0.0 111.139 -175.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -77.99 -3.92 44.43 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 121.453 -0.779 . . . . 0.0 112.92 174.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -105.33 -16.24 14.81 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.721 1.608 . . . . 0.0 112.551 -176.087 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -101.31 -97.48 0.27 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.713 0.688 . . . . 0.0 112.393 -169.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -137.01 87.8 2.31 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.391 1.077 . . . . 0.0 110.13 -177.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -59.79 -17.51 36.18 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.651 1.18 . . . . 0.0 114.163 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -93.87 -2.55 53.23 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.431 1.892 . . . . 0.0 114.595 171.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -142.57 63.94 15.06 Favored Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 127.755 2.422 . . . . 0.0 110.45 174.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -71.21 160.38 49.15 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.274 2.65 . . . . 0.0 112.743 -165.066 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -74.53 -178.59 3.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.998 0.919 . . . . 0.0 111.066 164.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.484 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 46.5 p -142.84 172.93 12.02 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.387 1.475 . . . . 0.0 109.96 172.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -55.11 -33.53 62.92 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.83 1.418 . . . . 0.0 114.83 -174.231 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.8 tp60 -67.2 -51.03 58.42 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 120.159 -1.588 . . . . 0.0 110.661 169.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.484 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.3 mm-40 -62.39 -50.56 71.04 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 120.959 -1.088 . . . . 0.0 111.949 -173.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 pt -58.97 -37.82 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.455 1.025 . . . . 0.0 112.424 174.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.86 -34.94 78.42 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.307 0.958 . . . . 0.0 112.047 177.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -69.1 -52.0 32.81 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.413 1.085 . . . . 0.0 112.659 -178.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -63.95 -32.88 58.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 O-C-N 121.413 -0.804 . . . . 0.0 111.4 -177.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.74 -22.89 67.14 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.28 1.432 . . . . 0.0 112.736 175.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.7 ptmt -81.31 -14.62 57.14 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.663 -0.648 . . . . 0.0 112.736 175.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -85.93 -14.02 46.0 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.305 0.642 . . . . 0.0 111.969 -178.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.1 ptpt -126.66 -22.23 3.95 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -171.797 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.95 1.99 0.07 OUTLIER Glycine 0 N--CA 1.47 0.961 0 N-CA-C 115.82 1.088 . . . . 0.0 115.82 151.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -87.82 -27.19 22.42 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.314 1.057 . . . . 0.0 112.839 -168.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.0 ptmt 30.49 40.51 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 130.101 3.36 . . . . 0.0 114.253 -173.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.629 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -82.51 141.43 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -82.35 166.35 19.54 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 127.433 2.293 . . . . 0.0 112.449 176.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -64.56 -24.87 67.74 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.309 1.444 . . . . 0.0 114.587 -174.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -70.28 -39.03 75.16 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.16 -0.963 . . . . 0.0 111.948 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.1 m -78.74 -45.82 20.3 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 126.588 1.955 . . . . 0.0 109.003 -175.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.47 -32.5 58.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.093 -176.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.2 -35.92 74.25 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.595 1.558 . . . . 0.0 111.949 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.0 mttm -78.54 -18.95 53.94 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.592 1.157 . . . . 0.0 112.41 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -82.01 -48.44 11.43 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.46 1.104 . . . . 0.0 112.616 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.05 -20.76 10.26 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 175.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -68.54 -46.6 69.1 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.76 1.224 . . . . 0.0 112.822 173.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -82.87 -27.14 30.97 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -173.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.472 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.3 mt -70.61 -59.77 2.64 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.476 1.11 . . . . 0.0 111.724 176.277 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.59 6.04 0.03 OUTLIER Glycine 0 CA--C 1.535 1.305 0 N-CA-C 118.714 2.246 . . . . 0.0 118.714 169.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.8 mt -90.15 126.58 56.53 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 119.898 1.849 . . . . 0.0 111.157 -173.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.48 -52.04 0.29 Allowed 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.447 2.765 . . . . 0.0 111.034 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.1 p -160.68 -10.68 0.05 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.386 1.624 . . . . 0.0 115.386 161.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.6 m 64.63 -19.5 0.08 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 128.059 2.544 . . . . 0.0 115.731 -166.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.8 ttp180 -69.13 -36.94 78.03 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.626 1.171 . . . . 0.0 109.373 171.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -24.71 33.25 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.555 1.142 . . . . 0.0 113.576 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -74.01 -40.07 63.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.212 1.405 . . . . 0.0 112.704 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -63.69 -63.48 1.16 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 126.053 1.741 . . . . 0.0 112.277 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.6 tp . . . . . 0 C--O 1.253 1.267 0 C-N-CA 126.729 2.012 . . . . 0.0 114.357 -167.715 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.796 HD12 HD23 ' A' ' 8' ' ' LEU . 34.2 mt . . . . . 0 CA--C 1.54 0.558 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.7 p -75.15 -167.33 0.6 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.196 1.799 . . . . 0.0 113.004 -177.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -48.75 -24.68 1.49 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.638 1.575 . . . . 0.0 114.697 173.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.69 44.72 0.11 Allowed Glycine 0 C--N 1.341 0.857 0 CA-C-O 117.874 -1.514 . . . . 0.0 115.745 170.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -61.87 -13.98 29.49 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.612 2.206 . . . . 0.0 113.487 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.796 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -112.33 -17.55 12.7 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.969 1.308 . . . . 0.0 113.228 168.61 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.416 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.5 ttt -72.0 -60.54 2.18 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.198 1.399 . . . . 0.0 111.166 -176.467 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.458 ' C ' HD22 ' A' ' 11' ' ' LEU . 16.3 pttt -75.17 18.86 0.17 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.378 1.071 . . . . 0.0 113.624 -174.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.458 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -126.22 -43.77 1.77 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 129.318 3.047 . . . . 0.0 110.168 -171.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.5 pt -63.19 -32.02 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 118.268 0.486 . . . . 0.0 112.078 -173.405 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.46 -14.85 23.39 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -89.86 -14.28 34.67 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.785 2.034 . . . . 0.0 111.673 -176.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -105.47 -52.38 7.54 Favored 'Isoleucine or valine' 0 C--N 1.341 0.214 0 C-N-CA 124.34 1.056 . . . . 0.0 108.72 167.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.77 -36.88 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 120.608 1.549 . . . . 0.0 111.382 -170.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -87.24 9.28 20.72 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -116.96 -24.35 7.64 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.028 1.731 . . . . 0.0 112.99 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -85.6 -79.32 0.24 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.415 1.086 . . . . 0.0 111.282 -171.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -139.2 86.7 2.15 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.561 1.144 . . . . 0.0 110.747 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -59.68 -19.37 49.15 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.278 1.031 . . . . 0.0 113.615 170.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -16.94 39.03 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 127.217 2.207 . . . . 0.0 114.654 171.244 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -148.21 72.76 11.07 Favored Pre-proline 0 N--CA 1.481 1.116 0 C-N-CA 127.175 2.19 . . . . 0.0 110.386 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -72.75 168.35 24.79 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.054 2.503 . . . . 0.0 113.236 -170.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -78.93 -173.81 3.71 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.212 1.405 . . . . 0.0 110.629 166.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.485 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 91.1 p -133.93 172.54 12.67 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.898 1.679 . . . . 0.0 109.284 171.368 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -65.76 -23.52 66.75 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.292 -0.88 . . . . 0.0 112.453 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -68.74 -54.15 17.74 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.418 -1.426 . . . . 0.0 110.665 165.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.485 ' HB2' ' H ' ' A' ' 26' ' ' SER . 19.5 mm-40 -61.96 -48.0 82.32 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 120.843 -1.161 . . . . 0.0 112.606 -174.468 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 pt -60.83 -38.61 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-N 119.544 1.066 . . . . 0.0 112.207 173.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.74 -34.48 75.9 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.631 1.105 . . . . 0.0 111.712 177.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -67.81 -55.44 12.98 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.676 1.191 . . . . 0.0 112.886 178.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.447 HG22 ' HE2' ' A' ' 37' ' ' LYS . 1.9 mt -64.83 -32.54 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 O-C-N 121.463 -0.773 . . . . 0.0 111.167 -176.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.3 -22.64 66.2 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.74 1.216 . . . . 0.0 112.214 176.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 pttm -81.86 -13.03 58.17 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 175.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -90.01 -9.28 49.21 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.503 0.721 . . . . 0.0 112.191 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.447 ' HE2' HG22 ' A' ' 33' ' ' ILE . 23.6 pttt -127.61 -23.3 3.47 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 114.862 1.431 . . . . 0.0 114.862 -176.182 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 154.35 4.53 0.11 Allowed Glycine 0 N--CA 1.471 1.033 0 CA-C-N 119.377 0.99 . . . . 0.0 115.418 151.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.48 ' HB3' HD11 ' A' ' 3' ' ' LEU . 45.2 m-85 -84.46 -31.35 24.61 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 118.148 0.974 . . . . 0.0 111.943 -171.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.1 ptmt 26.11 50.7 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 129.802 3.241 . . . . 0.0 113.01 -172.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.694 HG21 HD22 ' A' ' 8' ' ' LEU . 4.8 p -88.12 140.62 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.648 1.579 . . . . 0.0 108.77 171.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.6 165.33 17.13 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 129.025 2.93 . . . . 0.0 113.309 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -25.62 68.08 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.471 1.908 . . . . 0.0 114.65 -175.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -34.45 75.93 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.823 1.249 . . . . 0.0 110.785 -178.255 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 m -87.18 -47.05 9.19 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 127.407 2.283 . . . . 0.0 110.509 -176.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.23 -28.7 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.875 -173.293 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.95 -37.23 72.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.176 1.79 . . . . 0.0 113.129 174.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -70.54 -23.65 62.66 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.262 1.025 . . . . 0.0 112.281 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -80.5 -40.72 25.56 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -175.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -55.4 -25.15 34.07 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 118.943 0.792 . . . . 0.0 112.629 174.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -70.15 -38.13 75.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 176.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.5 ptp -81.09 -26.66 36.07 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.416 HD21 ' HG3' ' A' ' 9' ' ' MET . 2.1 mt -73.61 -59.76 2.56 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.345 1.058 . . . . 0.0 111.758 172.725 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 156.12 15.03 0.05 OUTLIER Glycine 0 CA--C 1.536 1.344 0 N-CA-C 117.648 1.819 . . . . 0.0 117.648 167.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.1 mt -117.49 133.23 23.27 Favored Pre-proline 0 CA--C 1.548 0.874 0 CA-C-N 119.2 1.5 . . . . 0.0 111.328 -167.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -71.74 -52.83 0.19 Allowed 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.926 3.084 . . . . 0.0 113.793 -177.046 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.9 p -156.35 -9.2 0.1 Allowed 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.6 m 61.78 -13.97 0.05 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.144 2.178 . . . . 0.0 115.568 -166.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -85.23 -36.69 20.79 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.753 1.621 . . . . 0.0 110.476 176.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -20.23 57.7 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 177.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 64.4 mtp85 -70.43 -42.2 71.89 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.047 1.739 . . . . 0.0 111.977 167.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -70.65 -59.17 2.98 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.392 1.877 . . . . 0.0 113.224 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.9 tp . . . . . 0 C--O 1.255 1.355 0 C-N-CA 126.593 1.957 . . . . 0.0 114.595 -166.816 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.78 HD12 HD23 ' A' ' 8' ' ' LEU . 39.1 mt . . . . . 0 CA--C 1.54 0.594 0 N-CA-C 116.605 2.076 . . . . 0.0 116.605 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.9 p -72.34 -168.11 0.39 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.102 1.761 . . . . 0.0 112.7 -178.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -48.7 -24.4 1.37 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.446 1.498 . . . . 0.0 114.72 172.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.54 41.18 0.11 Allowed Glycine 0 CA--C 1.527 0.817 0 CA-C-O 117.75 -1.583 . . . . 0.0 115.769 173.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -62.63 -13.01 26.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 121.25 2.525 . . . . 0.0 113.871 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.797 HD22 HG21 ' A' ' 41' ' ' VAL . 1.8 pp -109.35 -17.39 13.81 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.692 1.197 . . . . 0.0 113.627 167.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.6 ttt -67.7 -66.01 0.62 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.948 1.299 . . . . 0.0 109.982 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.542 ' C ' HD22 ' A' ' 11' ' ' LEU . 4.3 pttp -74.43 17.17 0.21 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.207 1.403 . . . . 0.0 113.829 -172.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.542 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -130.03 -34.34 1.69 Allowed 'General case' 0 C--O 1.234 0.289 0 C-N-CA 129.082 2.953 . . . . 0.0 111.946 -172.42 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -62.8 -34.15 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 119.689 1.131 . . . . 0.0 111.656 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -9.93 41.88 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -178.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -91.13 -15.99 28.52 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.559 1.943 . . . . 0.0 111.943 -175.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -105.03 -47.93 9.4 Favored 'Isoleucine or valine' 0 C--N 1.342 0.252 0 C-N-CA 124.621 1.168 . . . . 0.0 109.337 168.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 63.6 t -66.56 -35.6 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 119.982 1.265 . . . . 0.0 111.249 -172.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -78.84 -0.59 31.23 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.561 -0.712 . . . . 0.0 112.612 176.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -109.65 -13.15 14.56 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.593 1.957 . . . . 0.0 113.544 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -101.92 -89.55 0.36 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.537 0.735 . . . . 0.0 112.531 -170.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -135.67 91.24 2.69 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 122.433 1.111 . . . . 0.0 112.371 -173.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -53.53 -30.98 44.35 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.61 1.564 . . . . 0.0 113.389 170.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.42 -8.69 49.92 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.613 1.965 . . . . 0.0 114.986 177.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -145.49 76.84 12.91 Favored Pre-proline 0 N--CA 1.481 1.114 0 C-N-CA 126.681 1.992 . . . . 0.0 110.345 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -72.02 164.43 35.69 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.796 2.331 . . . . 0.0 112.643 -172.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -78.69 -174.79 4.07 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.488 1.115 . . . . 0.0 110.91 166.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.485 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 81.2 p -136.88 169.87 17.03 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.127 1.771 . . . . 0.0 109.949 172.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.4 p30 -53.06 -33.77 53.48 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 176.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -68.16 -53.56 24.24 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 119.982 -1.698 . . . . 0.0 110.678 169.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.485 ' HB2' ' H ' ' A' ' 26' ' ' SER . 20.3 mm-40 -61.34 -49.12 78.26 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 120.929 -1.107 . . . . 0.0 112.504 -174.355 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.0 pt -59.64 -38.26 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-N 119.574 1.079 . . . . 0.0 112.222 174.003 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.94 -35.54 78.74 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.625 1.102 . . . . 0.0 111.829 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -69.26 -53.14 21.31 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.566 1.146 . . . . 0.0 112.656 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.437 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.4 mt -64.36 -32.74 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.112 0.869 . . . . 0.0 111.53 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 mp -63.11 -22.03 66.59 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.78 1.232 . . . . 0.0 112.181 176.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.3 pttt -79.43 -16.03 56.83 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 174.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -89.57 -11.22 43.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.945 0.898 . . . . 0.0 112.146 -176.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.437 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.0 ptpt -126.8 -22.32 3.89 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -173.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.46 0.92 0.06 OUTLIER Glycine 0 N--CA 1.472 1.043 0 N-CA-C 116.215 1.246 . . . . 0.0 116.215 153.128 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.432 ' HB3' HD11 ' A' ' 3' ' ' LEU . 48.2 m-85 -91.45 -30.97 16.18 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.76 1.28 . . . . 0.0 113.159 -166.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt 26.66 50.05 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 129.391 3.076 . . . . 0.0 113.081 -170.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.797 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -86.7 138.45 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.729 1.612 . . . . 0.0 108.849 174.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.54 161.91 26.69 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 128.344 2.658 . . . . 0.0 112.16 177.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -59.44 -27.58 66.2 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.409 1.483 . . . . 0.0 113.513 179.226 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -66.53 -34.29 77.59 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.405 1.482 . . . . 0.0 111.167 -174.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.0 m -87.1 -48.85 7.73 Favored 'General case' 0 CA--C 1.509 -0.601 0 C-N-CA 128.346 2.658 . . . . 0.0 110.397 -178.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.44 -29.45 46.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.994 -172.224 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.04 -42.8 80.01 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 125.608 1.563 . . . . 0.0 111.175 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -70.24 -19.61 63.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.775 1.23 . . . . 0.0 112.406 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -87.94 -46.7 9.16 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.634 1.174 . . . . 0.0 113.264 -177.382 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -22.81 40.94 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.389 0.995 . . . . 0.0 112.557 172.104 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -72.22 -42.31 65.88 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.661 1.185 . . . . 0.0 112.739 172.132 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.2 ptm -83.35 -30.14 27.69 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.829 0.852 . . . . 0.0 113.107 -173.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.9 mp -67.65 -67.82 0.43 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.665 1.186 . . . . 0.0 111.061 173.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.18 6.46 0.03 OUTLIER Glycine 0 CA--C 1.536 1.356 0 N-CA-C 118.427 2.131 . . . . 0.0 118.427 172.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.1 mt -84.74 125.42 71.15 Favored Pre-proline 0 CA--C 1.545 0.784 0 CA-C-N 119.87 1.835 . . . . 0.0 110.838 -177.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.6 -53.35 0.36 Allowed 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.923 2.416 . . . . 0.0 110.642 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 82.7 p -161.11 -10.82 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.484 1.514 . . . . 0.0 114.988 162.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.9 m 62.36 -19.71 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.38 2.672 . . . . 0.0 115.752 -165.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -67.75 -44.43 77.53 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.584 1.554 . . . . 0.0 108.688 169.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -22.85 59.24 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -178.111 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -73.75 -42.3 61.28 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.426 1.49 . . . . 0.0 111.821 170.186 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -73.61 -58.89 2.99 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.841 1.656 . . . . 0.0 113.036 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.253 1.26 0 C-N-CA 126.127 1.771 . . . . 0.0 114.459 -167.707 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.76 HD12 HD23 ' A' ' 8' ' ' LEU . 15.5 mt . . . . . 0 CA--C 1.54 0.586 0 CA-C-O 122.134 0.969 . . . . 0.0 113.599 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.7 p -73.47 -169.31 0.65 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.705 1.202 . . . . 0.0 112.513 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -48.91 -24.66 1.56 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.554 1.542 . . . . 0.0 114.699 172.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.28 44.21 0.16 Allowed Glycine 0 C--N 1.341 0.841 0 CA-C-O 117.953 -1.471 . . . . 0.0 115.864 172.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -61.41 -14.92 31.91 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.7 2.25 . . . . 0.0 113.47 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.76 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -109.97 -17.21 13.66 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.716 1.206 . . . . 0.0 112.814 169.294 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.465 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.2 ttt -74.05 -59.17 2.84 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.914 1.686 . . . . 0.0 111.517 -175.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.486 ' C ' HD22 ' A' ' 11' ' ' LEU . 19.4 pttt -76.86 19.26 0.3 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.91 1.284 . . . . 0.0 112.918 -174.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.486 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -128.45 -41.33 1.55 Allowed 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 129.716 3.207 . . . . 0.0 110.574 -170.175 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 pt -61.33 -37.75 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 118.69 0.677 . . . . 0.0 111.274 -177.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.42 -14.01 44.57 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.715 1.005 . . . . 0.0 113.715 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.7 tp10 -95.21 -19.96 19.62 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 125.972 1.709 . . . . 0.0 111.761 -170.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -98.61 -46.53 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 C-N-CA 124.813 1.245 . . . . 0.0 109.149 169.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.81 -35.44 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.593 1.088 . . . . 0.0 111.324 -173.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -79.01 -2.64 41.24 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 177.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -104.85 -17.64 14.5 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.204 1.801 . . . . 0.0 112.87 -176.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -97.32 -91.73 0.25 Allowed 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.577 0.751 . . . . 0.0 112.256 -169.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -137.18 89.26 2.42 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 125.064 1.346 . . . . 0.0 110.218 177.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.3 mtmm -59.12 -18.81 39.06 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.62 1.168 . . . . 0.0 112.754 167.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -21.47 61.57 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 127.436 2.295 . . . . 0.0 114.051 169.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.5 mtmt -148.73 74.66 10.29 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 127.819 2.448 . . . . 0.0 109.747 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -68.75 161.56 44.89 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.09 2.526 . . . . 0.0 113.011 -169.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -76.5 -172.73 2.27 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.714 1.206 . . . . 0.0 110.671 167.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.432 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 59.7 p -136.78 167.51 21.3 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 126.316 1.847 . . . . 0.0 109.457 176.131 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 51.3 p30 -54.66 -30.96 56.83 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 175.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -68.17 -54.45 17.88 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.0 -1.688 . . . . 0.0 110.702 168.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.432 ' HB2' ' H ' ' A' ' 26' ' ' SER . 40.0 mt-10 -62.71 -47.78 82.13 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 120.659 -1.275 . . . . 0.0 112.757 -173.52 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.1 pt -59.27 -38.24 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-N 119.518 1.053 . . . . 0.0 112.142 173.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.8 -35.46 79.93 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.647 1.112 . . . . 0.0 112.138 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -67.31 -53.11 32.66 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.651 1.18 . . . . 0.0 112.952 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.478 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -64.74 -32.42 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 O-C-N 121.567 -0.708 . . . . 0.0 111.657 -176.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.29 -22.36 66.82 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 125.174 1.39 . . . . 0.0 112.149 175.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -81.28 -14.6 57.23 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 175.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -87.57 -11.51 48.47 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.562 0.745 . . . . 0.0 111.992 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.478 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.1 ptpt -127.49 -22.73 3.6 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -173.391 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.45 0.5 0.07 OUTLIER Glycine 0 N--CA 1.47 0.931 0 N-CA-C 115.93 1.132 . . . . 0.0 115.93 152.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -89.48 -29.4 19.0 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.426 1.113 . . . . 0.0 112.694 -167.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt 29.03 43.37 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 130.243 3.417 . . . . 0.0 114.181 -173.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.569 HG21 HD22 ' A' ' 8' ' ' LEU . 3.3 p -83.4 144.24 10.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.092 0.957 . . . . 0.0 109.132 175.411 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.45 165.5 14.29 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.307 2.643 . . . . 0.0 112.806 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.01 -29.5 69.74 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.494 1.518 . . . . 0.0 114.254 -175.212 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -68.42 -32.11 71.92 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.188 0.904 . . . . 0.0 111.747 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.402 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 2.1 m -84.15 -48.16 10.12 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 127.913 2.485 . . . . 0.0 110.174 -177.452 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.9 -28.98 44.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.641 -173.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.56 -33.4 72.7 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.804 1.642 . . . . 0.0 111.921 176.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -72.74 -22.5 60.85 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.734 0.814 . . . . 0.0 112.693 174.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -83.49 -44.17 14.99 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.514 0.726 . . . . 0.0 112.909 -174.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.17 -30.65 7.1 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 118.785 0.72 . . . . 0.0 112.926 172.19 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -72.64 -33.07 66.36 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.195 0.998 . . . . 0.0 112.853 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 23.6 ptt? -94.37 -22.74 18.13 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.861 1.059 . . . . 0.0 113.861 -176.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.465 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.2 mt -72.92 -63.64 1.13 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.148 0.979 . . . . 0.0 111.374 170.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 165.93 -2.78 0.05 OUTLIER Glycine 0 CA--C 1.536 1.349 0 N-CA-C 117.675 1.83 . . . . 0.0 117.675 169.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.8 mt -72.63 128.06 88.98 Favored Pre-proline 0 CA--C 1.547 0.861 0 CA-C-N 119.127 1.463 . . . . 0.0 111.074 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.73 -64.42 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 123.459 2.773 . . . . 0.0 109.887 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 77.2 p -149.04 -10.41 0.33 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.1 1.36 . . . . 0.0 114.58 164.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.9 m 59.24 -14.58 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 128.436 2.694 . . . . 0.0 116.259 -165.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -67.39 -45.21 76.87 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.421 1.489 . . . . 0.0 108.76 165.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -22.34 59.25 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -177.612 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -73.99 -41.93 61.19 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.543 1.537 . . . . 0.0 111.76 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -73.58 -58.38 3.35 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.441 1.496 . . . . 0.0 113.192 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.253 1.264 0 C-N-CA 126.622 1.969 . . . . 0.0 114.479 -168.031 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.831 HD12 HD23 ' A' ' 8' ' ' LEU . 33.1 mt . . . . . 0 CA--C 1.541 0.602 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.3 p -73.97 -169.24 0.72 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.625 1.57 . . . . 0.0 112.645 177.32 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -49.19 -24.88 1.91 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.78 1.632 . . . . 0.0 114.626 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.63 45.76 0.12 Allowed Glycine 0 C--N 1.34 0.8 0 CA-C-O 118.174 -1.348 . . . . 0.0 114.833 171.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.36 -19.85 38.82 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 120.038 1.919 . . . . 0.0 113.552 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.831 HD23 HD12 ' A' ' 3' ' ' LEU . 1.8 pp -108.67 -17.63 13.91 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.146 1.378 . . . . 0.0 112.761 171.551 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.501 ' HG3' HD21 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -73.18 -57.33 4.1 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 126.09 1.756 . . . . 0.0 111.48 -175.512 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.484 ' C ' HD22 ' A' ' 11' ' ' LEU . 8.3 pttp -76.0 15.68 0.51 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.733 1.213 . . . . 0.0 113.161 -174.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.484 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.1 mm? -126.32 -42.03 1.86 Allowed 'General case' 0 C--O 1.233 0.203 0 C-N-CA 129.753 3.221 . . . . 0.0 110.436 -170.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.4 pt -62.99 -35.88 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-N 118.658 0.663 . . . . 0.0 111.679 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.07 -19.04 41.05 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 178.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -94.95 -17.47 21.94 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 127.091 2.156 . . . . 0.0 111.919 -168.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -100.8 -51.16 9.87 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 C-N-CA 123.955 0.902 . . . . 0.0 108.746 167.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 93.7 t -63.87 -39.11 84.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 119.81 1.186 . . . . 0.0 111.181 -170.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -82.39 3.74 26.82 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 120.076 -0.65 . . . . 0.0 112.273 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.67 -11.39 9.42 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.312 1.845 . . . . 0.0 114.17 -177.225 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -91.15 -86.95 0.21 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.243 1.017 . . . . 0.0 111.621 -176.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -131.99 96.66 3.96 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 122.53 1.157 . . . . 0.0 112.243 178.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -57.81 -15.72 9.18 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.273 1.429 . . . . 0.0 113.939 171.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -102.06 -10.2 19.92 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.921 2.088 . . . . 0.0 113.747 173.563 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -140.6 76.09 25.14 Favored Pre-proline 0 N--CA 1.483 1.195 0 C-N-CA 125.773 1.629 . . . . 0.0 111.076 172.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.51 161.9 44.38 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.254 2.636 . . . . 0.0 112.445 -176.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -81.89 -178.01 6.82 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.642 1.177 . . . . 0.0 111.255 169.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.471 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 93.2 p -131.18 169.01 16.5 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.889 1.676 . . . . 0.0 109.866 173.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -54.33 -31.96 55.55 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 174.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -68.83 -53.82 19.29 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.001 -1.687 . . . . 0.0 110.988 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.471 ' HB2' ' H ' ' A' ' 26' ' ' SER . 43.6 mt-10 -61.81 -47.64 84.19 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 120.578 -1.326 . . . . 0.0 112.597 -174.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.5 pt -59.98 -38.38 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 119.657 1.117 . . . . 0.0 112.06 173.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.89 -34.52 76.18 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.433 1.015 . . . . 0.0 112.197 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -68.16 -54.39 18.33 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.65 1.18 . . . . 0.0 112.771 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.462 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.0 mt -63.37 -33.46 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 121.496 -0.753 . . . . 0.0 111.509 -176.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.88 -23.03 67.19 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.499 1.52 . . . . 0.0 112.332 176.331 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -80.95 -15.46 56.2 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -84.39 -13.59 51.77 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.505 0.722 . . . . 0.0 112.179 -178.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.462 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.2 ptpt -127.0 -23.51 3.61 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.342 1.608 . . . . 0.0 115.342 -171.003 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.63 1.7 0.07 OUTLIER Glycine 0 N--CA 1.471 0.975 0 N-CA-C 115.752 1.061 . . . . 0.0 115.752 152.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -87.42 -30.7 20.52 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.412 1.106 . . . . 0.0 112.676 -169.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ptmt 29.01 44.81 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 129.947 3.299 . . . . 0.0 113.921 -171.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.558 HG21 HD22 ' A' ' 8' ' ' LEU . 2.7 p -82.08 140.46 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.078 1.351 . . . . 0.0 109.002 176.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.98 165.23 20.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.355 2.262 . . . . 0.0 112.328 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -25.75 68.4 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.267 1.427 . . . . 0.0 113.904 -177.077 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -67.3 -36.35 81.33 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.165 0.986 . . . . 0.0 111.516 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.1 m -84.89 -48.91 8.85 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 127.481 2.312 . . . . 0.0 109.4 -175.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.91 -30.05 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.27 -174.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.11 -48.88 72.09 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.105 1.362 . . . . 0.0 110.727 176.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -69.22 -16.26 63.56 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.522 0.729 . . . . 0.0 112.938 -178.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -81.54 -47.53 12.97 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.985 0.914 . . . . 0.0 112.158 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.9 ptp180 -56.27 -23.08 34.11 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 119.066 0.848 . . . . 0.0 113.081 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -66.85 -47.46 71.87 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.723 1.209 . . . . 0.0 112.654 174.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -84.65 -25.33 28.57 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -171.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.501 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.4 mt -71.0 -59.57 2.71 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.325 1.05 . . . . 0.0 111.868 175.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 167.42 8.6 0.03 OUTLIER Glycine 0 CA--C 1.534 1.262 0 N-CA-C 118.192 2.037 . . . . 0.0 118.192 171.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.8 mt -96.38 130.34 31.07 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 119.938 1.869 . . . . 0.0 110.928 -175.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -69.98 -58.7 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.669 2.912 . . . . 0.0 111.233 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.2 p -155.5 -4.13 0.13 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.722 1.609 . . . . 0.0 114.715 168.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 83.4 p 59.23 -10.6 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.785 2.834 . . . . 0.0 116.217 -168.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -82.17 -30.92 30.73 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 120.521 1.51 . . . . 0.0 111.057 172.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -23.73 59.07 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 174.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -72.95 -37.33 67.16 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.941 1.296 . . . . 0.0 112.417 170.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -72.85 -59.67 2.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.137 1.775 . . . . 0.0 112.88 179.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.7 tp . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.668 1.587 . . . . 0.0 114.415 -167.315 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.763 HD12 HD23 ' A' ' 8' ' ' LEU . 30.6 mt . . . . . 0 CA--C 1.541 0.625 0 CA-C-O 121.579 0.704 . . . . 0.0 112.468 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.5 p -71.53 -169.86 0.47 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.796 1.238 . . . . 0.0 112.502 175.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -48.7 -24.68 1.46 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.718 1.607 . . . . 0.0 114.655 173.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.2 45.83 0.11 Allowed Glycine 0 C--N 1.341 0.82 0 CA-C-O 117.954 -1.47 . . . . 0.0 115.205 170.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.59 -17.4 32.69 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.623 2.212 . . . . 0.0 113.425 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.763 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -107.85 -20.06 13.32 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.526 1.13 . . . . 0.0 112.635 171.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.402 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.5 ttt -68.79 -62.66 1.29 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 126.134 1.774 . . . . 0.0 110.718 -178.269 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.516 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.2 pttp -76.67 16.36 0.52 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.098 1.359 . . . . 0.0 113.675 -171.098 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.516 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -127.46 -39.67 1.84 Allowed 'General case' 0 C--O 1.233 0.214 0 C-N-CA 129.375 3.07 . . . . 0.0 110.745 -171.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pt -63.07 -36.8 77.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.947 0.794 . . . . 0.0 111.447 -176.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 -16.03 44.89 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -179.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -97.57 -17.06 19.77 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 127.828 2.451 . . . . 0.0 111.773 -167.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.0 pp -101.42 -46.51 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 C-N-CA 124.981 1.312 . . . . 0.0 109.762 167.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.6 t -62.81 -42.78 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-N 119.463 1.028 . . . . 0.0 110.471 -174.028 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -81.41 0.19 38.64 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.659 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -96.22 -21.49 17.84 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.22 1.408 . . . . 0.0 112.622 175.447 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -91.8 -84.64 0.26 Allowed 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.504 1.122 . . . . 0.0 112.005 -172.606 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -140.1 92.42 2.54 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.573 1.149 . . . . 0.0 110.465 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -53.13 -27.76 22.44 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 160.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -22.59 63.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.611 2.765 . . . . 0.0 114.208 173.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -148.11 73.36 11.11 Favored Pre-proline 0 N--CA 1.478 0.937 0 C-N-CA 127.398 2.279 . . . . 0.0 109.878 -174.232 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -69.26 155.96 66.06 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.848 2.365 . . . . 0.0 112.402 -168.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -78.96 172.25 14.06 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.639 0.733 . . . . 0.0 110.423 165.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.461 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 57.5 p -129.09 169.01 15.26 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.491 1.516 . . . . 0.0 110.008 179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.0 p30 -53.29 -34.15 56.14 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 178.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -67.64 -53.84 24.61 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 119.716 -1.865 . . . . 0.0 110.8 168.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.461 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.6 mm-40 -61.33 -49.66 76.08 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 120.807 -1.183 . . . . 0.0 112.558 -173.35 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.3 pt -59.22 -38.61 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-N 119.593 1.088 . . . . 0.0 112.28 173.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.92 -34.42 76.04 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.527 1.058 . . . . 0.0 112.01 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -68.36 -55.28 12.55 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.415 1.086 . . . . 0.0 112.826 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.471 HG22 ' HE2' ' A' ' 37' ' ' LYS . 1.5 mp -63.8 -33.03 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-N 118.826 0.739 . . . . 0.0 111.201 -176.425 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mp -61.01 -26.37 67.56 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.048 1.339 . . . . 0.0 112.629 176.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -78.89 -13.66 59.67 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.648 0.779 . . . . 0.0 112.76 176.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -90.01 -9.6 48.04 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.553 0.741 . . . . 0.0 112.341 -177.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.471 ' HE2' HG22 ' A' ' 33' ' ' ILE . 23.5 pttt -127.86 -22.62 3.5 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -175.584 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 153.56 5.14 0.11 Allowed Glycine 0 N--CA 1.47 0.902 0 CA-C-N 119.65 1.114 . . . . 0.0 115.499 151.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -85.09 -20.73 29.91 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.023 0.912 . . . . 0.0 112.905 -171.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 36.52 28.38 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 130.603 3.561 . . . . 0.0 115.342 -177.402 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.539 HG21 HD22 ' A' ' 8' ' ' LEU . 4.1 p -84.79 139.84 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-O 121.441 0.638 . . . . 0.0 109.978 -171.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.73 164.31 19.68 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.641 2.376 . . . . 0.0 112.363 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -57.1 -36.62 70.84 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.6 1.16 . . . . 0.0 113.839 -176.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -37.99 86.09 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.56 0.695 . . . . 0.0 110.54 -172.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.423 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 3.2 m -79.04 -48.82 13.7 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 127.972 2.509 . . . . 0.0 109.957 -175.466 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.06 -29.69 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.823 -175.181 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.52 -38.53 80.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.828 1.651 . . . . 0.0 111.757 178.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -64.78 -32.35 74.0 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.601 0.76 . . . . 0.0 111.396 175.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -79.52 -48.79 13.27 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 118.555 -0.736 . . . . 0.0 112.195 -171.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -53.54 -32.31 50.05 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.253 0.933 . . . . 0.0 112.286 172.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -72.37 -36.46 68.74 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.564 0.746 . . . . 0.0 112.372 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.0 ptt? -85.79 -31.69 22.21 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -175.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.402 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.5 mp -67.1 -61.2 2.04 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.079 0.952 . . . . 0.0 111.312 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 174.29 -2.63 0.03 OUTLIER Glycine 0 CA--C 1.536 1.371 0 N-CA-C 117.763 1.865 . . . . 0.0 117.763 174.119 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.7 mt -77.23 131.98 71.15 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 119.476 1.638 . . . . 0.0 110.251 177.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.11 -65.28 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.181 2.587 . . . . 0.0 109.873 170.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.6 p -151.03 -2.48 0.34 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.01 1.724 . . . . 0.0 114.225 163.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.5 m 57.73 -8.59 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.79 2.836 . . . . 0.0 116.026 -167.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -73.28 -40.53 64.49 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.491 1.516 . . . . 0.0 108.854 174.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -78.94 -21.53 47.11 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -71.79 -41.93 67.71 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.867 0.867 . . . . 0.0 111.981 169.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -75.27 -59.97 2.51 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.063 1.345 . . . . 0.0 112.86 -176.187 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.254 1.33 0 C-N-CA 125.541 1.536 . . . . 0.0 114.553 -168.087 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.831 HD12 HD23 ' A' ' 8' ' ' LEU . 26.3 mt . . . . . 0 CA--C 1.534 0.354 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 48.2 p -70.28 -173.6 0.72 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.089 0.956 . . . . 0.0 112.148 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -43.06 -25.73 0.12 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.123 2.169 . . . . 0.0 115.897 170.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -172.58 40.44 0.16 Allowed Glycine 0 C--N 1.341 0.818 0 CA-C-O 117.747 -1.585 . . . . 0.0 115.657 170.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -64.5 -10.28 24.49 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 121.06 2.43 . . . . 0.0 114.127 -177.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.831 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -112.64 -15.33 13.03 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.751 1.22 . . . . 0.0 113.687 166.177 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.706 ' HG3' HD21 ' A' ' 53' ' ' LEU . 3.0 ttp -71.73 -61.72 1.68 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.96 1.304 . . . . 0.0 110.489 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.46 ' C ' HD22 ' A' ' 11' ' ' LEU . 8.7 pttp -73.62 16.37 0.21 Allowed 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -173.427 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.46 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -124.23 -46.11 1.94 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 129.632 3.173 . . . . 0.0 110.931 -171.449 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pp -63.98 -34.51 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.635 0.652 . . . . 0.0 112.166 -176.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.553 ' HG2' HD22 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -80.78 -17.12 51.93 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 175.715 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -94.68 -16.23 23.28 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.609 1.964 . . . . 0.0 111.81 -168.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.0 -46.25 9.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 C-N-CA 124.601 1.16 . . . . 0.0 109.381 169.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.1 -32.33 55.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 119.848 1.204 . . . . 0.0 111.367 -174.188 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -80.28 -0.95 38.76 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.495 -0.753 . . . . 0.0 112.583 175.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -110.05 -14.49 14.22 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.124 1.769 . . . . 0.0 113.07 -176.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -101.43 -96.58 0.27 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.052 0.842 . . . . 0.0 112.386 -169.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -136.74 88.33 2.36 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.886 1.274 . . . . 0.0 109.971 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -58.93 -20.46 52.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.543 0.737 . . . . 0.0 112.691 165.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -23.08 61.91 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 128.889 2.875 . . . . 0.0 114.208 169.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -148.45 69.7 10.49 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 127.649 2.379 . . . . 0.0 109.722 -174.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -72.35 165.54 32.36 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.934 2.423 . . . . 0.0 113.645 -163.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -76.02 -170.97 1.52 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.735 1.214 . . . . 0.0 111.045 165.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.459 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 60.3 p -141.47 169.02 18.4 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.726 2.01 . . . . 0.0 109.39 174.533 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -55.2 -32.32 62.13 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -66.5 -53.85 30.43 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 119.846 -1.784 . . . . 0.0 110.919 168.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.459 ' HB2' ' H ' ' A' ' 26' ' ' SER . 41.1 mt-10 -62.62 -49.02 76.85 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 120.661 -1.274 . . . . 0.0 112.758 -173.662 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.4 pt -59.34 -37.49 69.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-N 119.888 1.222 . . . . 0.0 112.212 173.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.35 -35.16 79.48 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.585 1.084 . . . . 0.0 112.456 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -68.41 -51.09 47.84 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.806 1.242 . . . . 0.0 113.015 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.403 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -63.6 -35.48 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 121.829 -0.544 . . . . 0.0 110.938 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.3 mp -62.58 -23.22 66.9 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.534 1.534 . . . . 0.0 112.643 176.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 pttm -78.02 -15.11 59.22 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -83.39 -19.96 35.06 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.458 0.703 . . . . 0.0 111.801 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.403 ' HE3' HG22 ' A' ' 33' ' ' ILE . 26.6 mmtt -89.3 -57.48 2.87 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.339 1.856 . . . . 0.0 108.735 -177.294 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 155.93 7.92 0.07 OUTLIER Glycine 0 CA--C 1.529 0.937 0 CA-C-N 114.185 -1.37 . . . . 0.0 114.152 173.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.406 ' HB3' HD11 ' A' ' 3' ' ' LEU . 48.6 m-85 -79.37 -24.42 42.67 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.492 1.146 . . . . 0.0 112.3 -175.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt 32.69 35.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 130.692 3.597 . . . . 0.0 114.586 -176.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.601 HG21 HD22 ' A' ' 8' ' ' LEU . 2.5 p -82.48 139.83 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -175.656 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.36 160.71 26.61 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.345 2.258 . . . . 0.0 112.22 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -34.9 64.48 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.726 1.211 . . . . 0.0 113.915 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.08 -31.49 72.39 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 118.735 0.698 . . . . 0.0 111.661 -173.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.8 m -83.86 -49.64 8.84 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 128.584 2.753 . . . . 0.0 109.745 -176.056 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.79 -26.9 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.193 -176.104 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.46 -36.16 76.32 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 126.718 2.007 . . . . 0.0 111.829 177.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -64.74 -39.04 92.96 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.982 -0.449 . . . . 0.0 111.626 172.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -73.47 -35.94 65.76 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -164.263 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.98 -30.84 6.51 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 170.454 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -71.11 -36.42 72.14 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.1 ptp -86.51 -20.62 27.78 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -175.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.706 HD21 ' HG3' ' A' ' 9' ' ' MET . 4.2 mt -86.45 -63.4 1.32 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.295 1.438 . . . . 0.0 111.623 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.92 -5.55 0.04 OUTLIER Glycine 0 CA--C 1.535 1.294 0 N-CA-C 117.851 1.901 . . . . 0.0 117.851 167.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.0 mt -76.73 122.7 86.99 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 119.329 1.564 . . . . 0.0 110.871 -176.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.23 -59.41 0.08 OUTLIER 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.556 2.838 . . . . 0.0 110.729 -178.074 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 83.2 p -146.24 -6.8 0.55 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.798 1.639 . . . . 0.0 113.884 159.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 85.1 p 60.45 -20.43 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 129.561 3.144 . . . . 0.0 116.17 -163.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -71.1 -43.6 67.36 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.801 1.64 . . . . 0.0 109.649 172.117 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -23.56 60.81 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.652 0.781 . . . . 0.0 112.768 -172.326 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -70.23 -46.29 64.76 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.989 1.716 . . . . 0.0 111.993 167.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -72.0 -58.98 2.99 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.188 1.795 . . . . 0.0 113.194 -174.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.833 2.053 . . . . 0.0 114.437 -167.602 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.732 HD12 HD23 ' A' ' 8' ' ' LEU . 36.1 mt . . . . . 0 CA--C 1.536 0.407 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 54.2 p -74.25 -168.03 0.6 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.821 1.648 . . . . 0.0 112.485 179.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -49.05 -25.7 2.19 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.204 1.402 . . . . 0.0 114.378 173.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.47 45.8 0.12 Allowed Glycine 0 C--N 1.34 0.776 0 CA-C-O 118.09 -1.394 . . . . 0.0 115.021 172.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -62.84 -15.77 55.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 120.504 2.152 . . . . 0.0 113.373 -178.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.732 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -108.16 -18.07 13.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.111 0.964 . . . . 0.0 112.832 169.103 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.516 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.2 ttp -70.07 -61.78 1.64 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.411 1.484 . . . . 0.0 110.749 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.458 ' C ' HD22 ' A' ' 11' ' ' LEU . 16.6 pttt -76.71 15.89 0.58 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.996 0.918 . . . . 0.0 113.385 -171.102 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.458 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -124.96 -43.4 1.98 Allowed 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 129.305 3.042 . . . . 0.0 110.631 -171.128 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.8 pt -58.48 -37.79 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-N 118.67 0.668 . . . . 0.0 111.553 -177.161 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.37 -18.53 41.7 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -105.92 -12.22 15.91 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.344 1.857 . . . . 0.0 112.738 -167.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -94.54 -48.2 13.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 124.472 1.109 . . . . 0.0 108.777 162.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 82.7 t -64.33 -37.51 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 O-C-N 120.7 -1.25 . . . . 0.0 111.167 -173.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -83.85 5.35 25.5 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 178.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -109.29 -22.9 11.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.501 1.52 . . . . 0.0 112.756 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -89.23 -85.59 0.2 Allowed 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.798 1.239 . . . . 0.0 111.665 -173.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -142.97 82.67 1.77 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.764 1.226 . . . . 0.0 110.81 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -60.22 -19.29 53.73 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 166.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -72.06 -28.3 63.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.981 2.512 . . . . 0.0 114.755 169.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.88 79.02 12.33 Favored Pre-proline 0 N--CA 1.482 1.174 0 C-N-CA 127.509 2.324 . . . . 0.0 109.6 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.37 168.29 25.15 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.881 3.054 . . . . 0.0 113.769 -167.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -81.1 -171.0 3.0 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.077 1.751 . . . . 0.0 111.704 168.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.478 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 70.0 p -139.4 173.38 11.6 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 127.61 2.364 . . . . 0.0 108.959 172.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -66.86 -27.18 67.32 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 120.182 1.355 . . . . 0.0 112.085 -175.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -65.67 -52.73 49.29 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 119.888 -1.757 . . . . 0.0 110.968 166.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.478 ' HB2' ' H ' ' A' ' 26' ' ' SER . 42.5 mt-10 -62.26 -48.46 79.83 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 120.623 -1.298 . . . . 0.0 112.372 -173.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.3 pt -59.92 -38.11 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.575 1.079 . . . . 0.0 112.104 173.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.02 -35.61 79.08 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.283 0.947 . . . . 0.0 111.881 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -68.3 -52.36 34.47 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.322 1.049 . . . . 0.0 112.816 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.464 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -64.84 -32.27 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 O-C-N 121.211 -0.93 . . . . 0.0 111.627 -178.042 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.45 -22.87 66.55 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.149 1.38 . . . . 0.0 112.369 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.1 pttt -79.86 -16.11 56.06 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 175.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -87.73 -12.26 45.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.887 0.875 . . . . 0.0 112.138 -176.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.464 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.7 ptpt -125.92 -21.73 4.3 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -174.067 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.6 1.07 0.08 OUTLIER Glycine 0 N--CA 1.471 0.976 0 N-CA-C 115.672 1.029 . . . . 0.0 115.672 151.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -86.75 -25.92 24.45 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.41 1.105 . . . . 0.0 113.036 -168.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.6 ptmt 30.56 40.45 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 130.371 3.468 . . . . 0.0 114.474 -173.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.566 HG21 HD22 ' A' ' 8' ' ' LEU . 4.0 p -84.3 156.71 3.62 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 124.489 1.116 . . . . 0.0 109.099 175.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -109.04 169.81 8.45 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.662 2.785 . . . . 0.0 112.646 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -59.17 -32.87 70.3 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.028 1.331 . . . . 0.0 114.079 -172.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -37.53 87.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.022 0.529 . . . . 0.0 110.2 -174.251 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.0 m -84.31 -44.09 14.15 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 126.584 1.954 . . . . 0.0 109.941 -174.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.91 -31.18 52.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.328 -178.546 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.13 -36.24 72.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.815 1.646 . . . . 0.0 112.789 174.174 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -65.77 -27.77 68.54 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.422 0.689 . . . . 0.0 112.097 172.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -84.2 -53.69 5.33 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 124.058 0.943 . . . . 0.0 111.778 -175.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.21 -26.82 19.0 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 118.837 0.744 . . . . 0.0 112.851 174.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.3 -39.78 89.56 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.943 0.897 . . . . 0.0 113.082 175.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -92.41 -22.15 19.81 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -174.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.516 HD21 ' HG3' ' A' ' 9' ' ' MET . 0.8 OUTLIER -71.86 -65.16 0.8 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.49 1.116 . . . . 0.0 111.761 172.223 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 173.53 15.98 0.02 OUTLIER Glycine 0 CA--C 1.535 1.327 0 N-CA-C 118.024 1.97 . . . . 0.0 118.024 175.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.4 mp -120.72 135.3 24.58 Favored Pre-proline 0 CA--C 1.552 1.028 0 CA-C-N 119.408 1.604 . . . . 0.0 113.077 -166.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.29 -47.99 0.14 Allowed 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 124.333 3.355 . . . . 0.0 113.701 177.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 88.2 p -163.46 -7.75 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.903 2.081 . . . . 0.0 114.126 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.9 m 63.99 -6.59 0.25 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.515 2.726 . . . . 0.0 115.569 -162.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -81.74 -39.21 24.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.82 1.248 . . . . 0.0 110.088 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -91.19 -6.09 53.98 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.374 1.469 . . . . 0.0 114.624 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.5 mtp85 -69.29 -33.09 72.65 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 121.298 -0.876 . . . . 0.0 112.15 161.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -83.45 -63.37 1.37 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.865 2.066 . . . . 0.0 112.384 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.9 mm . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.2 1.8 . . . . 0.0 112.261 -178.061 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.784 HD12 HD23 ' A' ' 8' ' ' LEU . 41.1 mt . . . . . 0 CA--C 1.541 0.609 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.3 p -69.91 -169.5 0.26 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.015 1.326 . . . . 0.0 112.581 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -48.44 -24.45 1.27 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.592 1.557 . . . . 0.0 114.627 172.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.67 42.09 0.13 Allowed Glycine 0 CA--C 1.527 0.823 0 CA-C-O 117.518 -1.712 . . . . 0.0 116.081 172.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.37 -12.82 23.57 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 121.431 2.615 . . . . 0.0 113.697 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.784 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -112.02 -16.46 13.07 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.915 1.286 . . . . 0.0 113.242 168.863 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.44 ' HG3' HD11 ' A' ' 53' ' ' LEU . 5.8 ttt -69.15 -65.92 0.64 Allowed 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.211 1.405 . . . . 0.0 110.17 178.642 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.518 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.1 pttp -74.05 17.33 0.18 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.599 1.56 . . . . 0.0 113.7 -173.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.518 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -128.41 -37.54 1.81 Allowed 'General case' 0 C--O 1.233 0.219 0 C-N-CA 129.205 3.002 . . . . 0.0 111.733 -172.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.1 pt -62.95 -33.19 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.648 1.113 . . . . 0.0 111.514 -178.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.03 -11.24 39.4 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -96.94 -13.35 22.46 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.385 1.874 . . . . 0.0 111.879 -174.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.27 -46.97 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 124.91 1.284 . . . . 0.0 109.473 167.018 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.23 -36.58 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 119.828 1.194 . . . . 0.0 111.028 -174.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -78.43 -1.63 34.51 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -106.71 -16.67 14.43 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.63 1.572 . . . . 0.0 113.03 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -96.41 -88.93 0.27 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.874 0.87 . . . . 0.0 112.331 -172.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -138.76 90.68 2.47 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.719 1.208 . . . . 0.0 110.367 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -57.36 -20.5 29.57 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.71 0.804 . . . . 0.0 113.04 164.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -75.37 -21.66 58.14 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.832 2.453 . . . . 0.0 113.822 171.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -147.81 75.79 10.86 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 127.286 2.235 . . . . 0.0 110.2 -174.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -70.05 162.19 43.16 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.143 2.562 . . . . 0.0 113.1 -170.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -78.34 -166.43 0.84 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.33 1.452 . . . . 0.0 110.943 169.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.489 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 67.9 m -149.85 172.43 15.17 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.205 1.802 . . . . 0.0 109.61 173.583 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.4 ' CG ' ' HE ' ' A' ' 43' ' ' ARG . 23.7 p30 -62.55 -31.47 72.27 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -171.196 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -65.03 -50.89 64.46 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.078 -1.639 . . . . 0.0 110.67 165.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.489 ' HB2' ' H ' ' A' ' 26' ' ' SER . 46.1 mt-10 -61.95 -50.97 70.0 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 120.677 -1.264 . . . . 0.0 112.531 -173.064 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.7 pt -59.23 -37.27 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 119.363 0.983 . . . . 0.0 112.366 174.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.72 -35.6 80.29 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.403 1.001 . . . . 0.0 111.973 176.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -67.49 -53.25 30.37 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.202 1.001 . . . . 0.0 112.745 -178.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.478 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.6 mt -63.81 -32.36 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 O-C-N 121.42 -0.8 . . . . 0.0 111.449 -177.129 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.86 -21.65 66.55 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.031 1.332 . . . . 0.0 112.522 175.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.5 ptmt -80.84 -15.37 56.56 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 175.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -88.33 -12.31 43.81 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.821 0.849 . . . . 0.0 112.267 -177.123 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.478 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.9 ptpt -126.75 -22.51 3.87 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -173.246 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.33 1.83 0.07 OUTLIER Glycine 0 N--CA 1.469 0.899 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 152.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.444 ' HB3' HD11 ' A' ' 3' ' ' LEU . 47.7 m-85 -88.91 -34.65 16.86 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.395 1.097 . . . . 0.0 112.017 -168.768 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.8 ptmt 27.12 53.61 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 129.15 2.98 . . . . 0.0 112.486 -170.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.671 HG21 HD22 ' A' ' 8' ' ' LEU . 4.2 p -88.16 142.76 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 126.372 1.869 . . . . 0.0 108.858 168.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.32 169.87 11.91 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 129.384 3.073 . . . . 0.0 113.291 175.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.4 ' HE ' ' CG ' ' A' ' 27' ' ' ASP . 0.7 OUTLIER -64.14 -28.85 70.04 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 125.681 1.592 . . . . 0.0 114.39 -171.96 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -35.14 69.7 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.795 1.18 . . . . 0.0 111.132 -175.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.2 m -77.43 -48.65 16.65 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 125.816 1.646 . . . . 0.0 108.589 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.29 -30.9 51.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.82 -175.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.67 -43.65 72.09 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 126.311 1.844 . . . . 0.0 111.594 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -66.99 -25.64 66.41 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 173.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -79.4 -46.47 17.51 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.666 0.787 . . . . 0.0 112.673 -178.147 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 30.8 ptt85 -51.94 -31.68 29.91 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.765 1.166 . . . . 0.0 111.821 170.309 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -77.89 -23.51 48.72 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 178.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.9 ptm -93.05 -26.99 17.25 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.573 1.079 . . . . 0.0 112.823 177.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.44 HD11 ' HG3' ' A' ' 9' ' ' MET . 2.2 mp -73.73 -74.63 0.17 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.994 1.318 . . . . 0.0 111.322 172.054 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 176.12 14.53 0.02 OUTLIER Glycine 0 CA--C 1.537 1.44 0 N-CA-C 118.253 2.061 . . . . 0.0 118.253 178.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.9 mt -112.27 126.39 28.48 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 119.556 1.678 . . . . 0.0 111.773 -173.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.29 -70.36 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 124.143 3.229 . . . . 0.0 110.348 173.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 95.2 p -141.38 -7.05 1.02 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.41 2.284 . . . . 0.0 113.351 174.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.2 m 56.86 -1.58 0.05 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 128.488 2.715 . . . . 0.0 116.088 -161.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -82.45 -39.63 22.28 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 120.309 1.413 . . . . 0.0 110.369 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -73.44 -20.62 60.67 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.2 mtp180 -75.3 -42.54 54.47 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.678 1.191 . . . . 0.0 112.43 167.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -66.15 -58.67 4.92 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.231 1.812 . . . . 0.0 112.835 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 C--O 1.254 1.308 0 C-N-CA 125.498 1.519 . . . . 0.0 114.441 -169.432 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 63.9 mtt 52.5 37.33 22.64 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.951 2.1 . . . . 0.0 114.091 175.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.777 HD12 HD23 ' A' ' 8' ' ' LEU . 32.4 mt -65.71 174.16 2.47 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.729 2.012 . . . . 0.0 115.107 -178.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.7 p -71.19 -168.95 0.34 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.381 1.472 . . . . 0.0 112.683 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -48.48 -25.22 1.56 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.581 1.552 . . . . 0.0 114.556 172.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.7 40.11 0.14 Allowed Glycine 0 CA--C 1.529 0.929 0 CA-C-O 117.688 -1.618 . . . . 0.0 116.063 174.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.98 -14.06 31.56 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 121.435 2.618 . . . . 0.0 113.364 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.777 HD23 HD12 ' A' ' 3' ' ' LEU . 1.8 pp -111.34 -16.87 13.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.87 1.268 . . . . 0.0 113.278 168.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 9.5 ttm -67.65 -67.05 0.49 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.351 1.46 . . . . 0.0 110.031 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.512 ' C ' HD22 ' A' ' 11' ' ' LEU . 7.0 pttp -74.45 18.76 0.15 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.59 1.556 . . . . 0.0 113.712 -172.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.512 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -128.8 -38.4 1.68 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 129.53 3.132 . . . . 0.0 111.158 -172.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -61.99 -35.57 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 CA-C-N 119.447 1.021 . . . . 0.0 111.441 -177.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.57 -13.11 28.11 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -177.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -91.59 -17.44 25.59 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 126.855 2.062 . . . . 0.0 111.579 -174.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.29 -46.32 9.73 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 C-N-CA 124.95 1.3 . . . . 0.0 109.727 169.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 87.9 t -64.66 -35.81 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 119.923 1.238 . . . . 0.0 111.091 -175.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -83.74 5.07 26.11 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -112.28 -16.28 13.0 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.471 1.909 . . . . 0.0 113.445 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -94.71 -86.83 0.28 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.152 0.981 . . . . 0.0 111.708 -173.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -139.69 85.11 2.02 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.26 1.424 . . . . 0.0 109.669 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -59.4 -17.99 35.15 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.491 1.116 . . . . 0.0 113.574 172.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -87.74 -7.95 56.67 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 126.607 1.963 . . . . 0.0 113.852 174.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -146.72 71.12 12.6 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 127.438 2.295 . . . . 0.0 110.456 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -69.37 160.49 49.6 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.874 2.383 . . . . 0.0 113.332 -168.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -76.6 -174.25 2.88 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.143 1.377 . . . . 0.0 111.004 167.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.481 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 87.9 p -134.0 169.62 16.85 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.078 1.751 . . . . 0.0 110.131 173.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -55.64 -31.34 62.25 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 176.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -68.24 -54.38 18.05 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 119.836 -1.79 . . . . 0.0 110.932 167.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.481 ' HB2' ' H ' ' A' ' 26' ' ' SER . 22.2 mm-40 -62.17 -47.48 84.32 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.793 -1.192 . . . . 0.0 112.702 -173.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 pt -59.63 -38.75 77.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.752 1.16 . . . . 0.0 112.061 172.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.2 -34.99 77.52 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.656 1.116 . . . . 0.0 112.055 176.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -68.2 -54.26 19.09 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.213 1.005 . . . . 0.0 112.819 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.453 HG22 ' HE2' ' A' ' 37' ' ' LYS . 1.8 mt -63.2 -32.89 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-N 119.063 0.847 . . . . 0.0 111.452 -177.147 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mp -63.3 -20.09 65.17 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.155 1.382 . . . . 0.0 112.855 176.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 ptmt -81.53 -14.89 56.35 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.706 0.803 . . . . 0.0 112.646 173.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -88.21 -11.73 45.87 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.247 0.619 . . . . 0.0 112.361 -176.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.453 ' HE2' HG22 ' A' ' 33' ' ' ILE . 27.2 pttt -129.06 -27.3 2.51 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -171.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.81 6.24 0.04 OUTLIER Glycine 0 N--CA 1.471 0.997 0 CA-C-N 120.592 1.542 . . . . 0.0 116.941 160.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -99.3 -39.86 8.21 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.527 1.163 . . . . 0.0 111.361 -168.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER 37.85 51.06 1.33 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 128.138 2.575 . . . . 0.0 111.776 179.617 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.664 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -91.66 139.88 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 111.592 -2.549 . . . . 0.0 109.194 171.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.09 165.61 18.37 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 128.857 2.863 . . . . 0.0 112.414 176.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.57 -26.6 68.67 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 125.589 1.555 . . . . 0.0 113.981 -177.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -34.38 76.62 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.835 0.854 . . . . 0.0 111.31 -177.012 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.0 m -84.91 -47.5 10.24 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 127.222 2.209 . . . . 0.0 109.948 -176.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.78 -28.33 42.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.949 -173.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.03 -47.39 80.43 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 125.672 1.589 . . . . 0.0 111.06 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -67.92 -18.27 64.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.106 1.362 . . . . 0.0 112.443 179.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -89.58 -50.35 6.13 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.48 1.512 . . . . 0.0 112.84 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -22.26 47.45 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.687 1.13 . . . . 0.0 112.144 172.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -69.49 -44.18 71.67 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.951 0.9 . . . . 0.0 112.871 170.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.9 ptp -83.31 -31.57 26.78 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -172.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 mp -65.64 -63.48 1.08 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.426 1.09 . . . . 0.0 111.205 175.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.96 8.07 0.03 OUTLIER Glycine 0 CA--C 1.536 1.372 0 N-CA-C 118.227 2.051 . . . . 0.0 118.227 171.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.5 mt -90.96 125.19 59.68 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 119.629 1.714 . . . . 0.0 111.217 -173.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.74 -53.25 0.28 Allowed 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.016 2.477 . . . . 0.0 110.78 175.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.2 p -158.89 -10.99 0.07 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 163.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 56.3 m 61.72 -18.4 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 128.293 2.637 . . . . 0.0 116.071 -164.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -67.11 -42.0 85.27 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 120.476 1.489 . . . . 0.0 109.012 168.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -25.09 54.02 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.993 0.917 . . . . 0.0 113.263 -178.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.9 mtm180 -72.2 -42.82 65.37 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.412 1.485 . . . . 0.0 112.302 169.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -69.49 -58.77 3.56 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.051 1.74 . . . . 0.0 113.229 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.8 tp . . . . . 0 C--O 1.254 1.309 0 C-N-CA 125.985 1.714 . . . . 0.0 114.43 -168.099 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.666 0 C4'-C3'-C2' 100.046 -3.154 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.455 0 O4'-C1'-N19 110.714 3.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.62 1 O4'-C1'-N19 111.801 5.001 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.967 0 O4'-C1'-N19 110.786 3.733 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.751 0 O4'-C1'-N19 110.063 2.829 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.728 0 P-O3'-C3' 123.214 2.928 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.146 0 O4'-C1'-N19 110.747 3.683 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.176 0 P-O3'-C3' 122.937 2.697 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.528 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.778 1 O4'-C1'-N19 112.199 5.498 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.502 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.535 1 C4'-C3'-C2' 99.054 -4.146 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.409 -3.363 0 O4'-C1'-N19 110.765 3.707 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.464 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.298 0 O4'-C4'-C3' 109.084 3.484 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.464 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.143 0 P-O3'-C3' 123.453 3.127 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.097 0 C4'-C3'-C2' 100.129 -3.071 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.177 0 N19-C1'-C2' 109.051 -3.218 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.063 0 C3'-C2'-C1' 106.388 2.634 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.48 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.339 0 P-O3'-C3' 123.951 3.542 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.48 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.326 0 C3'-C2'-C1' 106.029 2.378 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.502 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.683 1 O4'-C1'-N19 111.89 5.112 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.528 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.171 2 O4'-C1'-N19 117.526 12.158 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.607 0 C5'-C4'-C3' 110.89 -2.54 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.591 0 N19-C1'-C2' 110.437 -2.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.871 0 O4'-C4'-C3' 108.975 3.375 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.134 0 P-O3'-C3' 123.288 2.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.756 0 O4'-C4'-C3' 108.101 2.501 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.286 0 P-O3'-C3' 123.701 3.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.105 0 O4'-C4'-C3' 108.226 2.626 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.953 0 P-O3'-C3' 122.425 2.271 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.5 p80 . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.765 0.316 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -137.12 -37.48 0.64 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.974 1.31 . . . . 0.0 112.402 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.726 HD12 HD23 ' A' ' 8' ' ' LEU . 35.9 mt -93.07 177.78 5.95 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.755 1.622 . . . . 0.0 113.639 178.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.2 p -71.29 -173.49 0.88 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.701 1.2 . . . . 0.0 112.158 170.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -51.23 -24.46 4.4 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.23 1.412 . . . . 0.0 114.791 175.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.77 39.12 0.21 Allowed Glycine 0 C--N 1.341 0.841 0 CA-C-O 117.61 -1.661 . . . . 0.0 115.954 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.8 -15.82 23.51 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 120.831 2.316 . . . . 0.0 113.137 177.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.726 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -108.92 -18.4 13.69 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.959 1.303 . . . . 0.0 112.795 170.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.436 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.4 ttt -73.38 -59.45 2.71 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.541 1.536 . . . . 0.0 111.255 -176.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.517 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.8 pttp -76.32 19.2 0.26 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.777 1.231 . . . . 0.0 113.005 -174.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.517 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -130.57 -38.93 1.3 Allowed 'General case' 0 C--O 1.233 0.223 0 C-N-CA 129.703 3.201 . . . . 0.0 110.992 -170.368 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.6 pt -64.04 -34.32 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 CA-C-N 119.07 0.85 . . . . 0.0 111.359 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.93 -13.83 43.61 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -93.22 -18.33 22.64 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.48 1.912 . . . . 0.0 111.847 -171.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.95 -48.8 10.99 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.165 0 C-N-CA 124.568 1.147 . . . . 0.0 108.933 168.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.0 t -65.55 -34.6 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 119.961 1.255 . . . . 0.0 111.407 -172.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -81.56 3.22 25.81 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.42 -7.71 9.69 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.153 1.781 . . . . 0.0 114.186 -176.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -100.53 -85.76 0.41 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.838 0.855 . . . . 0.0 112.296 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -136.88 87.77 2.31 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.913 1.285 . . . . 0.0 110.98 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -58.12 -23.82 56.45 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.959 0.904 . . . . 0.0 112.777 166.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -27.49 62.88 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 128.365 2.666 . . . . 0.0 113.914 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -148.29 75.63 10.45 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 127.122 2.169 . . . . 0.0 110.116 -170.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.2 161.48 45.83 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.14 2.56 . . . . 0.0 112.533 -170.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -78.7 -176.22 4.79 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.539 1.136 . . . . 0.0 110.964 167.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.471 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 55.1 p -137.43 169.59 17.52 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.098 1.759 . . . . 0.0 110.527 175.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -56.01 -32.1 63.68 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -67.16 -55.29 14.79 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 120.226 -1.546 . . . . 0.0 110.813 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.471 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.4 mm-40 -61.83 -49.29 76.88 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 120.786 -1.196 . . . . 0.0 112.866 -173.301 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.9 pt -59.07 -38.53 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 119.484 1.038 . . . . 0.0 112.183 173.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.56 -35.22 78.8 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.803 1.183 . . . . 0.0 111.827 176.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -68.89 -53.19 22.51 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.422 1.089 . . . . 0.0 112.947 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.455 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.8 mt -64.16 -32.86 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 O-C-N 121.321 -0.862 . . . . 0.0 111.433 -177.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.13 -24.69 67.3 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.242 1.417 . . . . 0.0 112.385 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -78.83 -15.75 57.98 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -88.35 -11.65 45.67 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.677 0.791 . . . . 0.0 112.105 -176.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.455 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.8 ptpt -126.58 -21.63 4.09 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -174.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.16 2.32 0.08 OUTLIER Glycine 0 N--CA 1.472 1.055 0 N-CA-C 115.992 1.157 . . . . 0.0 115.992 151.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.401 ' HB3' HD11 ' A' ' 3' ' ' LEU . 52.3 m-85 -89.0 -22.24 23.1 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.3 1.05 . . . . 0.0 113.671 -167.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.01 28.96 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 130.398 3.479 . . . . 0.0 115.673 -175.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.576 HG21 HD22 ' A' ' 8' ' ' LEU . 3.3 p -82.77 141.73 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 121.391 0.615 . . . . 0.0 109.348 -173.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.17 164.95 16.08 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.07 2.548 . . . . 0.0 112.719 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.2 -31.18 68.78 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 125.45 1.5 . . . . 0.0 114.354 -175.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -36.6 78.97 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.205 0.911 . . . . 0.0 110.693 -176.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.418 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 2.6 m -77.41 -47.5 19.64 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 126.492 1.917 . . . . 0.0 109.455 -176.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.25 -29.34 45.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.064 -175.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.06 -35.35 69.28 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.561 1.545 . . . . 0.0 112.287 178.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -67.5 -30.93 70.74 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.398 0.679 . . . . 0.0 111.841 172.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -77.08 -46.07 24.87 Favored 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 123.154 0.582 . . . . 0.0 112.423 -172.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.19 -29.5 14.2 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 175.035 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -74.0 -37.42 64.42 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.52 0.728 . . . . 0.0 112.515 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -87.28 -23.87 24.53 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -175.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.436 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.4 mt -71.41 -62.82 1.27 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.265 1.026 . . . . 0.0 111.387 169.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 165.84 3.98 0.04 OUTLIER Glycine 0 CA--C 1.537 1.464 0 N-CA-C 118.029 1.972 . . . . 0.0 118.029 170.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 28.4 mt -84.2 131.33 51.16 Favored Pre-proline 0 CA--C 1.547 0.835 0 CA-C-N 119.371 1.585 . . . . 0.0 111.169 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.6 -63.96 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.737 2.958 . . . . 0.0 110.797 172.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 85.1 p -150.69 -11.9 0.24 Allowed 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.254 1.575 . . . . 0.0 115.254 168.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 73.6 m 61.06 -13.36 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 128.456 2.702 . . . . 0.0 116.184 -166.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -69.11 -40.29 78.42 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.823 1.649 . . . . 0.0 109.263 167.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.65 -20.42 46.73 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -76.25 -38.86 55.72 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.175 1.39 . . . . 0.0 112.174 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -68.83 -58.64 3.9 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.851 1.661 . . . . 0.0 112.133 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.256 1.397 0 C-N-CA 125.596 1.558 . . . . 0.0 114.349 -169.105 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.665 0 C4'-C3'-C2' 100.134 -3.066 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.484 0 O4'-C1'-N19 110.735 3.669 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.91 1 O4'-C1'-N19 112.631 6.039 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.363 0 O4'-C1'-N19 110.758 3.697 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.661 0 P-O3'-C3' 122.691 2.493 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.476 0 P-O3'-C3' 122.86 2.633 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.137 0 O4'-C1'-N19 110.449 3.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.331 0 P-O3'-C3' 123.191 2.909 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.505 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.54 1 O4'-C1'-N19 111.232 4.29 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.484 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.472 1 C4'-C3'-C2' 99.054 -4.146 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.652 1 O4'-C1'-N19 111.397 4.496 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.415 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.674 0 O4'-C4'-C3' 108.638 3.038 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.415 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.402 0 P-O3'-C3' 124.002 3.585 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.383 0 C4'-C3'-C2' 100.038 -3.162 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.176 0 N19-C1'-C2' 109.415 -2.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.426 0 C3'-C2'-C1' 106.763 2.902 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.506 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.328 0 C4'-C3'-C2' 99.523 -3.677 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.506 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.382 0 C3'-C2'-C1' 106.685 2.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.484 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.658 1 O4'-C1'-N19 113.118 6.648 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.505 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.574 2 O4'-C1'-N19 117.357 11.946 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.361 1 O4'-C1'-N19 111.101 4.126 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.394 0 C3'-C2'-C1' 105.686 2.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.593 0 O4'-C4'-C3' 108.312 2.712 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.097 0 C4'-C3'-C2' 100.043 -3.157 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.334 0 O4'-C4'-C3' 108.504 2.904 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.348 0 P-O3'-C3' 123.811 3.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.393 0 O4'-C4'-C3' 108.64 3.04 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.984 0 C4'-C3'-C2' 100.781 -2.419 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 121.193 0.52 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -72.9 72.32 1.1 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.555 1.542 . . . . 0.0 111.461 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.714 HD12 HD23 ' A' ' 8' ' ' LEU . 41.8 mt -48.55 176.51 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 128.197 2.599 . . . . 0.0 114.018 158.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.8 p -72.8 -165.5 0.22 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.444 1.498 . . . . 0.0 112.797 -176.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -50.56 -23.66 2.69 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.76 51.78 0.09 OUTLIER Glycine 0 C--N 1.341 0.816 0 CA-C-O 118.438 -1.201 . . . . 0.0 114.783 168.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -64.3 -13.34 49.31 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.096 1.948 . . . . 0.0 114.282 -177.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.714 HD23 HD12 ' A' ' 3' ' ' LEU . 1.7 pp -105.48 -19.71 13.7 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.979 0.912 . . . . 0.0 113.263 166.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.436 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.5 ttt -72.39 -59.22 2.84 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.041 1.737 . . . . 0.0 111.006 -176.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.472 ' C ' HD22 ' A' ' 11' ' ' LEU . 22.7 pttt -76.53 15.45 0.62 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.659 1.184 . . . . 0.0 113.255 -174.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.472 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.6 mm? -126.34 -39.89 2.01 Favored 'General case' 0 C--N 1.34 0.182 0 C-N-CA 129.326 3.05 . . . . 0.0 111.064 -171.224 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.4 pt -63.09 -34.04 64.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 119.084 0.856 . . . . 0.0 111.708 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.05 -17.48 40.2 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 176.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -97.48 -13.96 21.41 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 127.02 2.128 . . . . 0.0 111.913 -169.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.11 -49.22 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.782 1.233 . . . . 0.0 109.158 166.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.64 -39.41 85.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.736 1.153 . . . . 0.0 111.14 -172.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -83.07 5.26 22.97 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -113.98 -15.61 12.29 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.66 1.584 . . . . 0.0 113.508 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -89.33 -83.86 0.23 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.851 1.26 . . . . 0.0 111.552 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -136.01 95.68 3.26 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 122.702 1.239 . . . . 0.0 112.153 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -56.5 -14.21 2.92 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.783 1.633 . . . . 0.0 114.53 171.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -118.25 8.32 12.26 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.036 1.735 . . . . 0.0 114.962 171.795 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -140.58 79.13 20.46 Favored Pre-proline 0 N--CA 1.484 1.236 0 C-N-CA 125.667 1.587 . . . . 0.0 110.87 161.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -71.83 163.84 37.6 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 123.678 2.919 . . . . 0.0 113.209 -172.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -90.22 175.75 7.01 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.859 1.264 . . . . 0.0 111.157 168.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.457 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 77.7 p -129.45 169.78 14.52 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 126.256 1.822 . . . . 0.0 109.834 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.2 p30 -56.62 -34.42 67.23 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -67.64 -52.4 38.61 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 120.23 -1.544 . . . . 0.0 110.709 168.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.457 ' HB2' ' H ' ' A' ' 26' ' ' SER . 46.7 mt-10 -61.52 -50.83 71.12 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.783 -1.198 . . . . 0.0 112.462 -173.358 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.5 pt -59.46 -38.02 72.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 119.265 0.939 . . . . 0.0 112.036 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.56 -35.2 77.11 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.409 1.004 . . . . 0.0 111.79 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -69.56 -52.99 21.1 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.578 1.151 . . . . 0.0 112.796 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -64.41 -32.95 59.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 O-C-N 121.269 -0.894 . . . . 0.0 111.53 -177.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mp -63.58 -23.26 67.31 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.521 1.529 . . . . 0.0 112.207 176.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -80.03 -15.02 58.08 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -87.85 -11.76 46.87 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.68 0.792 . . . . 0.0 112.055 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.9 ptpt -127.34 -23.03 3.59 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -173.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.7 1.24 0.07 OUTLIER Glycine 0 N--CA 1.47 0.914 0 N-CA-C 115.948 1.139 . . . . 0.0 115.948 152.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -89.89 -27.36 19.94 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 118.43 1.115 . . . . 0.0 112.869 -167.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 29.19 40.87 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 130.426 3.491 . . . . 0.0 114.205 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.605 HG21 HD22 ' A' ' 8' ' ' LEU . 2.6 p -82.66 139.57 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.618 0.767 . . . . 0.0 108.995 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.6 158.21 31.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 127.471 2.308 . . . . 0.0 111.971 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.63 -29.69 64.75 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.398 1.479 . . . . 0.0 113.596 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -65.24 -37.42 87.19 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.003 1.321 . . . . 0.0 111.25 -175.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.3 m -82.25 -52.3 7.08 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 128.261 2.624 . . . . 0.0 109.701 -177.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.84 -29.27 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.027 -171.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.87 -52.55 62.66 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.377 1.471 . . . . 0.0 110.241 175.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -72.5 -9.59 58.74 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.917 -174.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.85 -45.83 11.19 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.537 1.135 . . . . 0.0 112.732 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -55.37 -24.16 28.14 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.348 0.976 . . . . 0.0 112.847 176.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.2 tt0 -62.56 -50.2 72.28 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.785 1.234 . . . . 0.0 112.937 175.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.4 ptt? -84.51 -26.29 28.2 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -169.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.436 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.2 mt -70.58 -57.65 4.52 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.622 1.169 . . . . 0.0 112.129 178.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.38 5.8 0.02 OUTLIER Glycine 0 CA--C 1.535 1.338 0 N-CA-C 118.194 2.038 . . . . 0.0 118.194 173.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.9 mt -107.22 134.18 20.03 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 119.411 1.606 . . . . 0.0 111.857 -169.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.43 -66.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.485 2.79 . . . . 0.0 109.842 169.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.2 p -150.08 -3.51 0.37 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.749 2.02 . . . . 0.0 113.247 167.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 52.4 m 55.4 -4.08 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 128.987 2.915 . . . . 0.0 116.235 -165.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.9 ttt85 -79.2 -42.57 25.73 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.17 1.388 . . . . 0.0 109.309 176.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -73.99 -21.04 60.15 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.736 1.215 . . . . 0.0 113.62 174.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -73.87 -41.29 62.42 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.604 1.162 . . . . 0.0 111.981 168.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -72.4 -59.72 2.59 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.85 1.66 . . . . 0.0 113.176 -178.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.254 1.335 0 C-N-CA 126.023 1.729 . . . . 0.0 114.386 -167.899 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.155 0 O4'-C1'-N19 110.073 2.841 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.451 0 O4'-C1'-N19 110.566 3.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 1 O4'-C1'-N19 111.081 4.101 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.812 0 O4'-C1'-N19 110.878 3.847 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.325 0 O4'-C1'-N19 109.924 2.654 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.576 0 P-O3'-C3' 123.898 3.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.234 0 P-O3'-C3' 123.135 2.862 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.142 0 P-O3'-C3' 122.994 2.745 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.729 1 O4'-C1'-N19 111.139 4.174 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.407 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.449 1 C4'-C3'-C2' 98.817 -4.383 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.51 1 O4'-C1'-N19 111.079 4.099 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.427 " H2'" ' H72' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.432 0 O4'-C4'-C3' 108.829 3.229 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.427 ' H72' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.188 0 P-O3'-C3' 123.761 3.384 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.331 0 C4'-C3'-C2' 99.888 -3.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.69 0 N19-C1'-C2' 109.339 -3.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.3 0 C3'-C2'-C1' 107.002 3.073 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.544 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.349 0 O4'-C4'-C3' 109.374 3.774 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.544 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.411 -3.197 0 O4'-C4'-C3' 108.91 3.31 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.407 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.679 0 P-O3'-C3' 123.272 2.977 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.065 1 O4'-C1'-N19 115.393 9.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.776 0 O4'-C1'-N19 110.865 3.831 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.599 0 O4'-C4'-C3' 109.104 3.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.5 0 O4'-C4'-C3' 109.038 3.438 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.222 0 C4'-C3'-C2' 100.309 -2.891 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.666 0 O4'-C1'-N19 109.905 2.631 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.407 0 P-O3'-C3' 123.523 3.185 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.203 0 P-O3'-C3' 123.291 2.992 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.98 0 P-O3'-C3' 122.724 2.52 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 39.7 m80 . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 17.2 tpt 59.44 -59.72 0.05 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.428 2.291 . . . . 0.0 112.365 -157.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.773 HD12 HD23 ' A' ' 8' ' ' LEU . 42.1 mt -104.24 -179.83 4.06 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 127.843 2.457 . . . . 0.0 112.496 173.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.1 p -71.96 -168.55 0.39 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.882 1.273 . . . . 0.0 112.2 175.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -49.65 -25.4 2.83 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.238 1.415 . . . . 0.0 114.387 172.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.68 43.3 0.15 Allowed Glycine 0 C--N 1.341 0.835 0 CA-C-O 117.857 -1.524 . . . . 0.0 115.563 174.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -63.86 -11.13 24.82 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.625 2.213 . . . . 0.0 113.973 -179.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.773 HD23 HD12 ' A' ' 3' ' ' LEU . 1.7 pp -110.61 -17.81 13.32 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.732 1.213 . . . . 0.0 113.136 167.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.573 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.2 ttp -71.4 -63.15 1.17 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.573 1.549 . . . . 0.0 110.595 -178.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.485 ' C ' HD22 ' A' ' 11' ' ' LEU . 20.0 pttt -73.07 18.07 0.11 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.054 1.342 . . . . 0.0 113.791 -174.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.485 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -127.52 -43.72 1.57 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 129.621 3.168 . . . . 0.0 110.909 -171.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.5 pt -60.74 -36.42 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 119.082 0.855 . . . . 0.0 111.564 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.436 ' HG2' HD22 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -82.29 -18.77 41.16 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 178.428 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -96.48 -20.86 18.09 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.812 2.045 . . . . 0.0 111.908 -167.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -96.7 -50.15 11.64 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.166 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 169.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.3 t -65.02 -35.88 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 O-C-N 120.597 -1.315 . . . . 0.0 111.19 -171.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -80.22 -2.66 45.88 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.0 t30 -109.38 -19.57 13.22 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.721 1.609 . . . . 0.0 113.072 -175.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -91.4 -89.62 0.17 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.766 0.826 . . . . 0.0 111.734 -169.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -141.02 82.71 1.85 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.698 1.199 . . . . 0.0 110.051 -177.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.9 mtmm -60.62 -21.66 62.94 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.18 0.992 . . . . 0.0 113.261 173.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -69.79 -25.55 63.84 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 128.033 2.533 . . . . 0.0 115.04 167.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -143.1 70.81 18.42 Favored Pre-proline 0 N--CA 1.479 1.015 0 C-N-CA 127.645 2.378 . . . . 0.0 109.742 -176.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.48 166.49 29.67 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.585 2.857 . . . . 0.0 113.502 -165.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -78.68 -170.94 2.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.073 1.349 . . . . 0.0 111.011 164.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.1 m -149.88 175.94 11.19 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.389 1.476 . . . . 0.0 110.048 169.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 27.1 p30 -57.41 -31.05 65.46 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -66.86 -53.02 36.66 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.331 -1.481 . . . . 0.0 110.666 167.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.4 ' O ' HD12 ' A' ' 33' ' ' ILE . 6.4 mm-40 -66.77 -43.07 84.99 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 120.621 -1.299 . . . . 0.0 113.275 -172.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.7 pt -60.04 -40.0 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-N 120.164 1.347 . . . . 0.0 111.912 171.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.18 -34.89 77.3 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 120.06 1.3 . . . . 0.0 112.28 173.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -67.63 -53.61 26.53 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.796 1.639 . . . . 0.0 112.459 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.442 HG22 ' HE3' ' A' ' 37' ' ' LYS . 1.8 mt -66.66 -32.8 59.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 121.373 -0.83 . . . . 0.0 111.406 -179.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.92 -24.06 66.73 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.161 0.985 . . . . 0.0 112.131 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 pttm -80.01 -15.18 57.76 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -87.65 -12.96 43.97 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.899 0.88 . . . . 0.0 112.294 -178.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.442 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.1 ptpt -126.33 -20.51 4.42 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -173.478 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.13 -0.13 0.08 OUTLIER Glycine 0 N--CA 1.47 0.923 0 N-CA-C 115.812 1.085 . . . . 0.0 115.812 151.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -89.24 -31.47 17.87 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 118.634 1.217 . . . . 0.0 112.728 -167.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 28.55 43.69 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 130.338 3.455 . . . . 0.0 114.018 -171.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.567 HG21 HD22 ' A' ' 8' ' ' LEU . 2.7 p -81.25 142.31 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 174.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -82.92 163.55 21.02 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 128.365 2.666 . . . . 0.0 111.98 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -56.68 -36.17 69.29 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.909 1.283 . . . . 0.0 113.807 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -66.58 -32.41 73.73 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.356 1.062 . . . . 0.0 111.175 -169.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.5 m -80.93 -52.02 7.91 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.643 2.777 . . . . 0.0 109.842 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.35 -30.81 50.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.268 1.027 . . . . 0.0 110.949 -173.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.49 -37.18 74.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.107 2.163 . . . . 0.0 112.255 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.6 mtmm -79.56 -14.95 58.49 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -82.77 -40.27 20.69 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.3 ptt-85 -52.86 -26.28 14.19 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 175.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.9 -39.99 75.88 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.413 1.085 . . . . 0.0 112.957 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 23.9 ptp -80.25 -23.48 40.79 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.573 HD21 ' HG3' ' A' ' 9' ' ' MET . 4.2 mt -81.54 -61.42 1.94 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.113 1.365 . . . . 0.0 111.981 176.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.31 5.25 0.05 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 118.035 1.974 . . . . 0.0 118.035 168.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.0 mt -95.05 128.7 38.0 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 119.492 1.646 . . . . 0.0 111.452 -172.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -73.12 -49.36 0.23 Allowed 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.526 3.484 . . . . 0.0 113.445 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.3 p -139.84 -68.41 0.42 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.739 1.616 . . . . 0.0 109.88 169.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 62.8 m 121.2 -20.3 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.005 1 C-N-CA 134.351 5.06 . . . . 0.0 110.747 -164.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -74.78 -41.12 60.63 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.083 2.153 . . . . 0.0 109.697 174.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.17 -21.31 43.2 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.708 0.803 . . . . 0.0 112.948 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -69.76 -32.78 71.48 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.909 1.284 . . . . 0.0 112.055 173.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -82.46 -59.92 2.37 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.085 1.754 . . . . 0.0 113.16 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 C--O 1.253 1.25 0 C-N-CA 125.932 1.693 . . . . 0.0 114.64 -163.596 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.582 0 C4'-C3'-C2' 100.018 -3.182 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.537 0 N19-C1'-C2' 109.325 -3.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.8 1 O4'-C1'-N19 111.742 4.927 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.979 0 O4'-C1'-N19 110.626 3.533 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.026 0 O5'-C5'-C4' 114.485 3.061 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.412 0 P-O3'-C3' 124.052 3.627 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.117 0 O4'-C1'-N19 110.771 3.714 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.258 0 P-O3'-C3' 123.336 3.03 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.5 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.536 0 O4'-C1'-N19 110.978 3.973 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.515 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.175 0 C4'-C3'-C2' 99.293 -3.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.409 -3.376 0 O4'-C1'-N19 110.638 3.547 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.401 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.442 0 O4'-C4'-C3' 108.977 3.377 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.401 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.27 0 P-O3'-C3' 123.911 3.509 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.356 0 C4'-C3'-C2' 99.955 -3.245 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.692 0 N19-C1'-C2' 108.953 -3.279 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.415 0 C3'-C2'-C1' 106.956 3.04 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.544 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.426 0 O4'-C4'-C3' 109.213 3.613 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.544 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.128 0 O4'-C4'-C3' 108.217 2.617 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.515 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.324 1 O4'-C1'-N19 112.836 6.295 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.5 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.433 2 O4'-C1'-N19 116.719 11.148 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.853 0 O4'-C1'-N19 110.876 3.845 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.528 0 O4'-C4'-C3' 109.122 3.522 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.438 0 O4'-C4'-C3' 109.17 3.57 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.99 0 C4'-C3'-C2' 100.315 -2.885 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.566 0 O4'-C1'-N19 109.889 2.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.232 0 P-O3'-C3' 123.567 3.223 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.124 0 P-O3'-C3' 122.684 2.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.948 0 P-O3'-C3' 122.632 2.444 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 111.363 0.135 . . . . 0.0 111.363 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.2 mmt 48.76 37.08 8.99 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 127.036 2.134 . . . . 0.0 114.962 169.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.729 HD12 HD23 ' A' ' 8' ' ' LEU . 35.4 mt -64.62 173.06 2.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.494 1.918 . . . . 0.0 115.258 -177.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.1 p -71.83 -168.78 0.39 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 125.374 1.47 . . . . 0.0 112.671 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -49.04 -24.79 1.69 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.284 1.434 . . . . 0.0 114.469 173.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.92 46.25 0.12 Allowed Glycine 0 C--N 1.341 0.835 0 CA-C-O 118.228 -1.318 . . . . 0.0 115.552 170.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.21 -17.13 39.28 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.822 2.311 . . . . 0.0 113.175 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.729 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -109.33 -18.7 13.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.632 1.173 . . . . 0.0 112.582 170.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.7 ttm -71.18 -63.11 1.17 Allowed 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.586 1.555 . . . . 0.0 110.274 -175.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.497 ' C ' HD22 ' A' ' 11' ' ' LEU . 5.3 pttm -76.61 18.99 0.29 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.564 1.145 . . . . 0.0 113.547 -172.279 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.497 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.1 mm? -128.3 -39.02 1.73 Allowed 'General case' 0 C--O 1.233 0.229 0 C-N-CA 129.706 3.202 . . . . 0.0 110.726 -171.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -65.03 -35.45 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.027 0.831 . . . . 0.0 111.696 -176.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.82 -11.93 54.66 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -92.92 -17.95 23.37 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 127.297 2.239 . . . . 0.0 111.825 -170.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.15 -46.28 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 125.056 1.342 . . . . 0.0 109.671 168.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.4 t -65.99 -36.19 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-N 119.58 1.082 . . . . 0.0 111.309 -173.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -78.97 -1.19 34.19 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -107.11 -15.82 14.58 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.701 1.6 . . . . 0.0 112.998 -177.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -98.45 -93.06 0.25 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.781 0.832 . . . . 0.0 112.386 -170.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -136.38 92.09 2.74 Favored 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 124.63 1.172 . . . . 0.0 110.372 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.0 mttt -58.56 -20.38 46.18 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.737 0.815 . . . . 0.0 112.938 166.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.58 -20.46 60.61 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 127.745 2.418 . . . . 0.0 113.919 170.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -146.85 72.7 12.45 Favored Pre-proline 0 N--CA 1.477 0.877 0 C-N-CA 127.457 2.303 . . . . 0.0 109.754 -176.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.62 155.44 68.91 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.835 2.357 . . . . 0.0 112.4 -168.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -75.54 169.1 18.76 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.676 0.75 . . . . 0.0 110.19 164.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.464 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 81.1 p -124.63 168.55 12.99 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.359 1.464 . . . . 0.0 109.746 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.8 p30 -53.92 -32.13 52.54 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 175.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -67.98 -55.04 14.15 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 119.616 -1.927 . . . . 0.0 110.726 167.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.464 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.0 mm-40 -61.08 -50.05 74.85 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 120.81 -1.181 . . . . 0.0 112.784 -173.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.1 pt -59.54 -37.76 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 119.856 1.207 . . . . 0.0 112.278 173.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.54 -35.14 78.5 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.508 1.049 . . . . 0.0 111.74 177.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -68.39 -52.53 31.98 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.413 1.085 . . . . 0.0 112.7 -178.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.513 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -64.3 -32.69 58.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 121.347 -0.846 . . . . 0.0 111.621 -177.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -65.01 -21.67 66.88 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.631 1.572 . . . . 0.0 112.67 176.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -80.09 -15.55 56.9 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -86.39 -13.96 44.82 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 123.132 0.573 . . . . 0.0 111.926 -176.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.513 ' HE3' HG22 ' A' ' 33' ' ' ILE . 15.3 ptpt -130.15 -26.36 2.37 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 116.93 2.196 . . . . 0.0 116.93 -167.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 165.26 10.35 0.03 OUTLIER Glycine 0 N--CA 1.471 1.007 0 N-CA-C 117.126 1.61 . . . . 0.0 117.126 163.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -112.12 -36.11 5.44 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 118.895 1.347 . . . . 0.0 112.385 -167.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.27 1.4 ttpt 40.3 43.84 1.51 Allowed 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 128.33 2.652 . . . . 0.0 113.095 175.12 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.617 HG21 HD22 ' A' ' 8' ' ' LEU . 3.5 p -91.44 144.44 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.842 2.057 . . . . 0.0 109.129 177.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.444 ' H ' ' P ' ' C' ' 84' ' ' ' DT' . . . -89.54 170.73 10.25 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.612 2.765 . . . . 0.0 112.853 176.341 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -59.73 -33.84 72.15 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 125.694 1.598 . . . . 0.0 114.052 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -38.34 85.87 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.73 1.212 . . . . 0.0 111.278 -172.129 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.6 m -86.68 -47.96 8.7 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 127.137 2.175 . . . . 0.0 109.036 -172.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.15 -31.65 54.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.667 -174.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.57 -46.94 74.36 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 125.597 1.559 . . . . 0.0 111.118 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -68.06 -20.01 64.93 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.414 1.086 . . . . 0.0 112.595 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -82.78 -48.3 10.96 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.072 0.949 . . . . 0.0 112.072 178.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -54.53 -29.8 51.78 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 119.906 1.23 . . . . 0.0 112.08 171.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -71.91 -38.04 69.97 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.384 1.074 . . . . 0.0 113.364 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 15.0 ptm -84.97 -28.37 25.84 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.8 mp -69.76 -64.05 0.96 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.106 0.962 . . . . 0.0 111.478 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.47 2.59 0.03 OUTLIER Glycine 0 CA--C 1.538 1.509 0 N-CA-C 118.516 2.166 . . . . 0.0 118.516 175.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.6 mt -90.23 132.16 36.6 Favored Pre-proline 0 CA--C 1.547 0.85 0 CA-C-N 119.59 1.695 . . . . 0.0 110.912 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.73 -62.05 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.503 2.802 . . . . 0.0 110.594 173.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.4 p -151.9 -7.71 0.22 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 164.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 72.0 m 58.45 -16.45 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 127.872 2.469 . . . . 0.0 116.272 -166.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 -66.37 -43.01 87.15 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.14 1.376 . . . . 0.0 108.402 167.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -22.69 52.91 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.192 0.997 . . . . 0.0 113.587 -178.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.9 mtp180 -74.31 -42.99 58.57 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.208 1.403 . . . . 0.0 111.796 170.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -72.33 -59.24 2.83 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.497 1.519 . . . . 0.0 112.694 -176.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.784 1.634 . . . . 0.0 114.469 -169.266 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.645 0 C4'-C3'-C2' 100.049 -3.151 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.578 0 O4'-C4'-C3' 108.492 2.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.66 1 O4'-C1'-N19 111.74 4.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.817 1 O4'-C1'-N19 111.037 4.046 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . 0.424 ' H1 ' ' N4 ' ' C' ' 87' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.277 0 P-O3'-C3' 123.411 3.092 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.632 0 P-O3'-C3' 123.161 2.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.892 0 O4'-C1'-N19 110.592 3.49 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.053 0 P-O3'-C3' 123.157 2.881 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.519 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.535 1 O4'-C1'-N19 111.355 4.444 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.507 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.341 1 C4'-C3'-C2' 99.062 -4.138 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.314 0 O4'-C1'-N19 110.653 3.567 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.407 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.506 0 O4'-C4'-C3' 108.722 3.122 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.407 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.197 0 P-O3'-C3' 123.74 3.367 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.344 0 C4'-C3'-C2' 100.14 -3.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.754 0 N19-C1'-C2' 109.064 -3.21 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.236 0 C3'-C2'-C1' 106.946 3.033 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.539 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.217 0 O4'-C4'-C3' 109.497 3.897 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.539 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.221 0 O4'-C4'-C3' 108.92 3.32 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.507 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.788 1 O4'-C1'-N19 111.873 5.091 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.519 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.297 2 O4'-C1'-N19 118.03 12.788 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . 0.444 ' P ' ' H ' ' A' ' 42' ' ' ALA . . . . . . . . 0 C5'--C4' 1.536 3.153 1 O4'-C1'-N19 111.171 4.213 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.569 0 C3'-C2'-C1' 105.601 2.072 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.545 0 O4'-C4'-C3' 109.172 3.572 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . 0.424 ' N4 ' ' H1 ' ' B' ' 68' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.234 0 C4'-C3'-C2' 99.685 -3.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.741 0 O4'-C4'-C3' 108.38 2.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.08 0 P-O3'-C3' 123.343 3.036 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.348 0 O4'-C4'-C3' 108.287 2.687 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.187 0 P-O3'-C3' 122.559 2.382 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 . . . . . 0 N--CA 1.484 1.262 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 96.0 mmm -111.5 -28.08 8.32 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -160.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.735 HD12 HD23 ' A' ' 8' ' ' LEU . 18.4 mt -79.25 165.08 23.6 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -160.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.0 p -74.56 -170.4 1.02 Allowed 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.191 175.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.03 -26.81 1.95 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.349 1.46 . . . . 0.0 114.663 172.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -170.55 38.09 0.18 Allowed Glycine 0 C--N 1.34 0.77 0 CA-C-O 117.608 -1.662 . . . . 0.0 115.688 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.1 -13.77 19.53 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.902 2.351 . . . . 0.0 113.26 176.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.735 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -107.75 -18.56 13.79 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.176 0.99 . . . . 0.0 112.976 168.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.3 ttt -70.09 -62.62 1.31 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.633 1.573 . . . . 0.0 110.301 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.526 ' C ' HD22 ' A' ' 11' ' ' LEU . 18.3 pttt -76.78 17.06 0.44 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.04 1.336 . . . . 0.0 113.215 -172.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.526 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -129.45 -35.55 1.74 Allowed 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 129.236 3.014 . . . . 0.0 111.482 -171.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pt -61.59 -34.92 63.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 119.291 0.95 . . . . 0.0 111.312 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.0 -12.39 36.02 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -93.2 -17.89 23.18 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 127.125 2.17 . . . . 0.0 111.819 -174.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.51 -48.51 11.19 Favored 'Isoleucine or valine' 0 C--N 1.341 0.229 0 C-N-CA 124.863 1.265 . . . . 0.0 109.427 169.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 72.8 t -63.03 -39.26 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 119.671 1.123 . . . . 0.0 111.013 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -82.1 5.09 20.65 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -111.58 -15.48 13.48 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.312 1.845 . . . . 0.0 113.583 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -94.95 -86.25 0.29 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.341 1.056 . . . . 0.0 111.874 -174.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -139.7 87.95 2.21 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.85 1.26 . . . . 0.0 110.107 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -54.35 -27.63 37.42 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.441 1.096 . . . . 0.0 112.8 169.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -81.18 -12.93 59.07 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.035 2.134 . . . . 0.0 114.175 177.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -146.51 73.65 12.76 Favored Pre-proline 0 N--CA 1.481 1.11 0 C-N-CA 127.43 2.292 . . . . 0.0 110.514 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -73.11 167.95 26.01 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.07 2.513 . . . . 0.0 113.408 -169.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -88.29 -175.29 4.97 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.464 1.505 . . . . 0.0 111.619 171.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.478 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 26.6 p -139.98 171.64 13.9 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.798 2.039 . . . . 0.0 110.166 176.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.0 p-10 -48.04 -48.4 33.06 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -62.48 -48.74 78.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.293 -1.504 . . . . 0.0 110.449 174.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.478 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.9 mm-40 -63.22 -49.8 72.75 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 120.849 -1.157 . . . . 0.0 112.545 -174.252 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.6 pt -59.36 -38.16 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.322 0.964 . . . . 0.0 112.437 173.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.83 -35.85 77.58 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.387 0.994 . . . . 0.0 111.658 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -68.77 -52.83 26.17 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.502 1.121 . . . . 0.0 112.853 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.493 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -64.36 -32.65 58.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.337 -0.852 . . . . 0.0 111.793 -177.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mp -62.64 -23.81 67.28 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.504 1.522 . . . . 0.0 112.451 174.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -79.19 -15.67 57.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 176.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -86.95 -12.94 46.09 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.465 0.706 . . . . 0.0 112.08 -176.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.493 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.2 ptpt -127.56 -21.28 3.82 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -172.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.2 1.91 0.07 OUTLIER Glycine 0 N--CA 1.471 0.991 0 N-CA-C 116.05 1.18 . . . . 0.0 116.05 151.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.413 ' HB3' HD11 ' A' ' 3' ' ' LEU . 49.4 m-85 -91.29 -21.36 21.1 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.355 1.077 . . . . 0.0 113.803 -165.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.05 28.12 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 130.531 3.532 . . . . 0.0 115.62 -175.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.583 HG21 HD22 ' A' ' 8' ' ' LEU . 3.6 p -84.06 141.29 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 121.49 0.662 . . . . 0.0 109.254 -170.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.0 166.23 15.23 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 128.412 2.685 . . . . 0.0 112.562 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 44.2 ttp85 -58.77 -32.19 69.06 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 125.767 1.627 . . . . 0.0 114.263 -173.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -65.05 -39.68 93.64 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.142 0.972 . . . . 0.0 111.5 -174.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.421 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 1.9 m -77.85 -49.6 13.93 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 127.345 2.258 . . . . 0.0 108.943 -175.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -31.1 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.825 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.412 -173.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.6 -37.88 67.99 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.874 1.67 . . . . 0.0 111.961 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -68.95 -22.71 64.11 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 175.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -84.62 -47.99 9.96 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.316 1.047 . . . . 0.0 112.423 -176.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.6 ptm85 -54.78 -28.37 48.35 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.337 0.971 . . . . 0.0 112.28 171.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -72.91 -34.24 66.5 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.925 0.89 . . . . 0.0 112.914 176.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.8 ptt? -92.17 -29.39 16.5 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 mp -67.17 -63.93 0.96 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.82 0.848 . . . . 0.0 111.264 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.88 3.22 0.03 OUTLIER Glycine 0 CA--C 1.538 1.471 0 N-CA-C 118.414 2.126 . . . . 0.0 118.414 173.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 47.6 mt -79.54 128.26 75.56 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-N 119.826 1.813 . . . . 0.0 111.038 -176.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -50.29 -68.87 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 125.213 3.942 . . . . 0.0 112.34 165.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.3 m 165.66 106.64 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.174 1 C-N-CA 134.638 5.175 . . . . 0.0 105.395 167.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.6 m -42.33 -5.53 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 131.128 3.771 . . . . 0.0 119.122 -169.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -70.38 -15.76 62.89 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.972 1.309 . . . . 0.0 112.116 167.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -118.53 -11.93 9.86 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -69.07 -50.41 48.63 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.713 0.688 . . . . 0.0 112.516 169.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -74.11 -56.16 5.25 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.011 1.724 . . . . 0.0 113.267 -171.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.256 1.404 0 C-N-CA 126.291 1.836 . . . . 0.0 114.339 -167.848 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.825 0 C4'-C3'-C2' 100.19 -3.01 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.514 0 O4'-C4'-C3' 108.261 2.661 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 1 O4'-C1'-N19 112.119 5.399 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.388 0 O4'-C1'-N19 110.099 2.874 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.445 0 P-O3'-C3' 122.805 2.587 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.177 0 P-O3'-C3' 122.979 2.733 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.054 0 O4'-C1'-N19 110.566 3.458 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.273 0 P-O3'-C3' 123.1 2.834 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.507 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.58 1 O4'-C1'-N19 111.323 4.404 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.492 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.555 1 C4'-C3'-C2' 99.097 -4.103 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.243 0 O4'-C1'-N19 110.876 3.845 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.343 0 O4'-C4'-C3' 108.901 3.301 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.249 0 P-O3'-C3' 123.588 3.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.345 0 C4'-C3'-C2' 99.803 -3.397 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.643 0 N19-C1'-C2' 108.848 -3.345 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.429 0 C3'-C2'-C1' 106.797 2.926 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.526 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.432 0 O4'-C4'-C3' 109.31 3.71 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.526 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.535 3.055 0 O4'-C4'-C3' 108.458 2.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.492 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.241 1 O4'-C1'-N19 111.951 5.189 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.507 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.542 3.822 2 O4'-C1'-N19 117.801 12.502 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.061 1 O4'-C1'-N19 111.229 4.286 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.296 0 C3'-C2'-C1' 105.589 2.064 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.315 0 O4'-C4'-C3' 108.706 3.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.125 0 P-O3'-C3' 123.219 2.933 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.494 0 O4'-C4'-C3' 108.384 2.784 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.881 0 P-O3'-C3' 123.569 3.224 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.052 0 O4'-C4'-C3' 108.354 2.754 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.85 0 P-O3'-C3' 122.548 2.373 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 52.1 p-80 . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 121.033 0.444 . . . . 0.0 111.702 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 60.0 ttm -138.23 -40.0 0.53 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.27 1.428 . . . . 0.0 113.223 -174.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.726 HD12 HD23 ' A' ' 8' ' ' LEU . 21.2 mt -74.7 171.74 13.38 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.811 1.244 . . . . 0.0 114.141 -176.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.6 p -74.03 -168.96 0.68 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.416 1.486 . . . . 0.0 112.55 177.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -48.64 -25.05 1.57 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.82 1.648 . . . . 0.0 114.667 172.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.73 45.65 0.12 Allowed Glycine 0 C--N 1.341 0.817 0 CA-C-O 118.073 -1.404 . . . . 0.0 115.305 172.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.41 -15.19 34.48 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 120.38 2.09 . . . . 0.0 113.421 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.726 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -108.51 -19.18 13.53 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.777 1.231 . . . . 0.0 113.007 169.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.531 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.2 ttt -73.9 -58.38 3.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.077 1.751 . . . . 0.0 111.442 -174.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.447 ' C ' HD22 ' A' ' 11' ' ' LEU . 21.6 pttt -76.99 17.1 0.46 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.405 1.082 . . . . 0.0 112.971 -173.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.447 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -125.65 -43.93 1.85 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 129.908 3.283 . . . . 0.0 110.359 -170.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.9 pt -61.51 -36.45 73.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 118.344 0.52 . . . . 0.0 111.91 -177.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.07 -17.79 41.95 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 177.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -96.96 -15.45 21.12 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 127.117 2.167 . . . . 0.0 112.003 -168.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -102.04 -47.97 11.1 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 C-N-CA 124.63 1.172 . . . . 0.0 109.013 166.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.1 t -65.64 -35.77 76.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 119.903 1.229 . . . . 0.0 111.635 -172.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -82.03 4.7 21.89 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -118.95 -9.96 9.96 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.309 1.844 . . . . 0.0 114.042 -177.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -101.52 -82.62 0.47 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.97 0.908 . . . . 0.0 112.139 -174.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -139.22 84.11 1.98 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.526 1.13 . . . . 0.0 111.089 -173.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -58.31 -25.07 61.45 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.161 0.984 . . . . 0.0 113.181 171.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -16.66 56.03 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 127.152 2.181 . . . . 0.0 114.956 172.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -147.53 76.07 11.02 Favored Pre-proline 0 N--CA 1.479 1.025 0 C-N-CA 126.769 2.028 . . . . 0.0 110.126 -178.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -69.18 162.28 42.42 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.041 2.494 . . . . 0.0 112.86 -171.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -79.68 -173.13 3.65 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.731 1.212 . . . . 0.0 110.756 167.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.49 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 52.3 p -138.03 168.19 20.22 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.995 1.318 . . . . 0.0 111.154 171.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.2 p30 -52.1 -30.99 28.64 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 175.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -68.11 0.32 Allowed 'General case' 0 C--N 1.333 -0.124 0 O-C-N 120.322 -1.486 . . . . 0.0 110.08 165.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.49 ' HB2' ' H ' ' A' ' 26' ' ' SER . 38.1 mt-10 -57.5 -49.33 76.65 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.222 1.009 . . . . 0.0 112.86 -170.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.4 pt -59.32 -37.29 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 119.193 0.906 . . . . 0.0 112.166 174.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.15 -34.62 78.47 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.862 1.21 . . . . 0.0 111.878 175.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -68.02 -53.47 25.61 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.235 1.014 . . . . 0.0 112.604 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.482 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -63.73 -32.68 57.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 121.572 -0.705 . . . . 0.0 111.617 -176.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.98 -23.1 67.21 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.394 1.477 . . . . 0.0 112.295 175.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -80.25 -15.77 56.23 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -86.24 -13.08 47.89 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.604 0.762 . . . . 0.0 112.163 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.482 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.0 ptpt -127.17 -21.99 3.83 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -172.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.54 2.6 0.07 OUTLIER Glycine 0 N--CA 1.47 0.916 0 N-CA-C 115.97 1.148 . . . . 0.0 115.97 151.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -89.38 -21.93 22.83 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 118.265 1.032 . . . . 0.0 113.443 -167.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.49 30.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 130.368 3.467 . . . . 0.0 115.298 -176.244 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.596 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -83.0 138.43 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 121.576 0.703 . . . . 0.0 109.238 -172.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.05 159.92 28.43 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 127.72 2.408 . . . . 0.0 112.21 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.83 -29.73 63.09 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.261 1.424 . . . . 0.0 113.543 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -32.27 72.71 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.61 1.164 . . . . 0.0 111.722 -175.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.1 m -87.14 -48.64 7.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.104 2.562 . . . . 0.0 110.059 -177.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.24 -30.11 49.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.096 -174.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.21 -37.96 86.81 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.223 1.409 . . . . 0.0 111.042 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -75.34 -17.94 60.12 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.456 1.102 . . . . 0.0 112.311 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.74 -50.13 7.41 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.46 1.104 . . . . 0.0 112.635 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.81 -23.58 18.85 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 175.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -68.78 -43.74 75.12 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.0 1.32 . . . . 0.0 112.585 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -87.63 -28.14 22.06 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -173.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.531 HD21 ' HG3' ' A' ' 9' ' ' MET . 0.9 OUTLIER -69.26 -59.21 3.16 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.319 1.048 . . . . 0.0 111.695 177.132 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.92 4.52 0.03 OUTLIER Glycine 0 CA--C 1.534 1.257 0 N-CA-C 118.312 2.085 . . . . 0.0 118.312 170.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 35.3 mt -91.81 121.47 67.01 Favored Pre-proline 0 CA--C 1.545 0.754 0 CA-C-N 120.014 1.907 . . . . 0.0 111.047 -173.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.94 -58.07 0.16 Allowed 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.382 2.721 . . . . 0.0 110.204 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.7 p -150.81 -8.87 0.25 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 160.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 77.4 p 60.61 -15.86 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 128.878 2.871 . . . . 0.0 116.151 -166.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 63.3 ttt180 -71.61 -43.74 65.68 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.345 1.458 . . . . 0.0 109.351 167.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -22.34 61.02 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -178.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -74.69 -39.5 61.94 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.776 1.63 . . . . 0.0 112.149 169.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -74.11 -59.09 2.88 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.568 1.547 . . . . 0.0 112.931 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.725 2.01 . . . . 0.0 114.483 -167.505 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.602 0 C4'-C3'-C2' 100.199 -3.001 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.401 0 O4'-C1'-N19 110.239 3.049 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.537 1 O4'-C1'-N19 112.072 5.34 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.859 0 O4'-C1'-N19 110.533 3.416 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.538 0 P-O3'-C3' 122.795 2.579 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.247 0 P-O3'-C3' 123.116 2.846 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 1 O4'-C1'-N19 111.01 4.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.356 0 P-O3'-C3' 122.997 2.747 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.476 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.643 1 O4'-C1'-N19 111.072 4.09 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.495 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.72 1 O4'-C4'-C3' 109.627 4.027 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.196 0 P-O3'-C3' 124.37 3.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.468 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.682 0 O4'-C4'-C3' 108.838 3.238 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.468 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.339 0 P-O3'-C3' 123.592 3.243 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.2 0 C4'-C3'-C2' 99.799 -3.401 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.729 0 N19-C1'-C2' 109.277 -3.077 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.317 0 C3'-C2'-C1' 106.82 2.943 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.519 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.333 0 C4'-C3'-C2' 99.697 -3.503 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.519 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.611 0 O4'-C4'-C3' 108.593 2.993 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.495 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.543 3.952 1 O4'-C1'-N19 111.58 4.725 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.476 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.337 2 O4'-C1'-N19 116.432 10.79 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.666 0 N19-C1'-C2' 118.19 2.494 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.557 0 O4'-C4'-C3' 108.337 2.737 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.571 0 O4'-C4'-C3' 109.311 3.711 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.154 0 P-O3'-C3' 122.967 2.723 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.332 0 O4'-C4'-C3' 108.536 2.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.836 0 P-O3'-C3' 123.46 3.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.879 0 O4'-C4'-C3' 108.424 2.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.801 0 P-O3'-C3' 122.691 2.492 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.3 p-80 . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 121.231 0.539 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 28.1 ttt -147.39 -46.72 0.17 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.268 1.427 . . . . 0.0 112.444 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.735 HD12 HD23 ' A' ' 8' ' ' LEU . 25.6 mt -72.73 171.39 12.68 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -171.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.8 p -73.88 -170.56 0.92 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.337 1.455 . . . . 0.0 112.245 176.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -49.23 -25.44 2.29 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.589 1.555 . . . . 0.0 114.599 172.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -171.68 40.66 0.17 Allowed Glycine 0 C--N 1.343 0.918 0 CA-C-O 117.682 -1.621 . . . . 0.0 115.682 175.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.61 -13.96 26.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 120.815 2.307 . . . . 0.0 113.467 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.735 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -108.72 -18.86 13.61 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.385 1.074 . . . . 0.0 113.151 168.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.617 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.4 ttp -71.64 -61.55 1.74 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.592 1.557 . . . . 0.0 111.104 -177.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.453 ' C ' HD22 ' A' ' 11' ' ' LEU . 19.6 pttt -75.17 17.01 0.27 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.305 1.042 . . . . 0.0 113.193 -171.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.453 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -125.4 -45.82 1.79 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 129.82 3.248 . . . . 0.0 110.392 -169.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.0 pt -59.64 -36.85 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt -82.76 -14.6 54.18 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 174.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -90.87 -17.76 25.96 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 125.55 1.54 . . . . 0.0 112.094 -174.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.39 -45.19 11.18 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 C-N-CA 124.167 0.987 . . . . 0.0 109.32 170.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.77 -31.18 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 O-C-N 120.891 -1.131 . . . . 0.0 111.225 -174.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -79.08 -2.39 40.32 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.253 -0.905 . . . . 0.0 112.816 174.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -108.73 -14.46 14.6 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.903 1.681 . . . . 0.0 112.851 -176.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -103.4 -102.59 0.29 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.201 0.909 . . . . 0.0 112.095 -168.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -139.96 80.82 1.79 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.495 1.118 . . . . 0.0 109.896 -172.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -62.62 -17.31 60.05 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 174.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -66.09 -22.29 66.4 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 127.212 2.205 . . . . 0.0 114.623 164.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -142.6 66.22 18.06 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 128.29 2.636 . . . . 0.0 109.637 177.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -70.23 162.0 43.93 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.318 2.679 . . . . 0.0 113.424 -163.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -77.53 170.01 17.3 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.845 0.831 . . . . 0.0 111.106 166.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.482 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 89.8 p -124.69 170.31 11.11 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 126.003 1.721 . . . . 0.0 109.846 178.045 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.4 p30 -53.98 -32.65 54.68 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -68.54 -54.67 15.25 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 119.776 -1.827 . . . . 0.0 110.789 168.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.482 ' HB2' ' H ' ' A' ' 26' ' ' SER . 91.9 mt-10 -62.55 -47.85 82.06 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 120.704 -1.247 . . . . 0.0 112.714 -173.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.3 pt -58.94 -38.92 76.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-N 119.871 1.214 . . . . 0.0 112.317 172.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.8 -35.41 78.11 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.543 1.065 . . . . 0.0 111.892 176.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -68.87 -52.62 27.69 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.518 1.127 . . . . 0.0 112.74 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.7 mt -64.03 -33.18 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 118.841 0.746 . . . . 0.0 111.269 -177.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.13 -24.93 68.12 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.369 1.468 . . . . 0.0 112.486 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -14.82 58.26 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 176.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -86.5 -13.19 46.73 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.436 0.694 . . . . 0.0 112.017 -178.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.1 ptpt -126.49 -22.55 3.95 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -172.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.04 2.54 0.08 OUTLIER Glycine 0 N--CA 1.47 0.933 0 CA-C-N 119.562 1.074 . . . . 0.0 115.668 151.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -87.16 -23.12 24.92 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 118.331 1.065 . . . . 0.0 113.303 -168.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.8 30.88 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 130.351 3.461 . . . . 0.0 115.109 -175.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.567 HG21 HD22 ' A' ' 8' ' ' LEU . 3.0 p -82.07 138.55 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.56 0.695 . . . . 0.0 109.226 -174.301 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.9 161.59 24.31 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 127.894 2.478 . . . . 0.0 112.033 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.63 -27.57 67.89 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 125.386 1.474 . . . . 0.0 113.853 -178.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.28 -32.51 72.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.118 0.967 . . . . 0.0 111.956 -177.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 m -84.09 -51.35 7.15 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 128.298 2.639 . . . . 0.0 109.914 -177.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.57 -29.06 45.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.848 -172.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.6 94.65 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.303 1.441 . . . . 0.0 110.91 176.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -71.43 -16.63 62.39 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.509 0.723 . . . . 0.0 112.487 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -85.97 -51.61 6.25 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.222 1.009 . . . . 0.0 112.267 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -54.36 -25.42 24.19 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.035 0.834 . . . . 0.0 112.679 175.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -68.77 -40.32 79.77 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.331 1.452 . . . . 0.0 113.025 178.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -92.88 -25.44 18.08 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -173.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.617 HD21 ' HG3' ' A' ' 9' ' ' MET . 0.8 OUTLIER -71.2 -60.56 2.17 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.625 1.17 . . . . 0.0 112.013 177.705 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 177.17 -0.6 0.03 OUTLIER Glycine 0 CA--C 1.534 1.254 0 N-CA-C 118.141 2.016 . . . . 0.0 118.141 172.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.8 mt -86.85 129.13 53.54 Favored Pre-proline 0 CA--C 1.546 0.794 0 CA-C-N 119.518 1.659 . . . . 0.0 110.628 -177.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.41 -60.02 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.827 2.351 . . . . 0.0 110.387 174.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.5 p -153.27 -7.47 0.17 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 163.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.403 ' HA ' ' HE ' ' A' ' 61' ' ' ARG . 28.9 m 59.26 -21.55 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.977 2.511 . . . . 0.0 116.199 -164.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.7 ttt85 -67.56 -43.15 81.34 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.923 1.238 . . . . 0.0 108.585 170.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -25.6 60.41 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.403 ' HE ' ' HA ' ' A' ' 58' ' ' SER . 57.3 mtm180 -71.3 -43.47 67.05 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.197 1.399 . . . . 0.0 112.244 169.306 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -74.19 -61.04 1.99 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.682 1.593 . . . . 0.0 113.31 -176.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.1 tp . . . . . 0 C--O 1.255 1.355 0 C-N-CA 126.515 1.926 . . . . 0.0 114.593 -166.108 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.793 0 C4'-C3'-C2' 100.425 -2.775 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.451 0 N19-C1'-C2' 109.71 -2.806 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.586 1 O4'-C1'-N19 112.198 5.497 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.899 0 O4'-C4'-C3' 108.365 2.765 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.734 0 O4'-C1'-N19 109.871 2.588 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.903 0 P-O3'-C3' 123.293 2.994 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.227 0 O4'-C1'-N19 110.137 2.921 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.101 0 P-O3'-C3' 122.919 2.682 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.497 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.684 1 O4'-C1'-N19 111.464 4.58 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.479 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.536 0 C4'-C3'-C2' 99.214 -3.986 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.259 0 O4'-C1'-N19 110.886 3.857 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.425 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.426 0 O4'-C4'-C3' 108.875 3.275 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.425 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.185 0 P-O3'-C3' 123.8 3.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.203 0 C4'-C3'-C2' 100.022 -3.178 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.706 0 N19-C1'-C2' 108.677 -3.452 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.107 0 C3'-C2'-C1' 106.674 2.839 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.469 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.538 0 C4'-C3'-C2' 99.637 -3.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.469 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.415 0 C3'-C2'-C1' 106.629 2.807 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.479 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.389 1 O4'-C1'-N19 112.565 5.956 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.497 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.522 2 O4'-C1'-N19 117.244 11.805 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.102 0 O4'-C1'-N19 109.935 2.668 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.69 0 N19-C1'-C2' 110.757 -2.152 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.717 0 O4'-C4'-C3' 109.147 3.547 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.296 0 P-O3'-C3' 122.911 2.675 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.796 0 O4'-C1'-N19 110.174 2.968 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.347 0 P-O3'-C3' 124.343 3.869 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.044 0 P-O3'-C3' 122.843 2.619 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.137 0 P-O3'-C3' 122.61 2.425 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 9.5 p-80 . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.2 mmt -127.75 -22.12 3.62 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.728 HD12 HD23 ' A' ' 8' ' ' LEU . 63.8 mt -123.73 -172.94 2.63 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.986 1.714 . . . . 0.0 113.23 -169.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 42.9 p -72.19 -163.09 0.1 Allowed 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 125.68 1.592 . . . . 0.0 112.635 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -48.16 -25.35 1.44 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.065 1.346 . . . . 0.0 114.335 169.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 176.14 53.96 0.06 OUTLIER Glycine 0 CA--C 1.527 0.808 0 CA-C-O 118.728 -1.04 . . . . 0.0 114.276 168.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -64.87 -13.54 56.66 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.688 1.744 . . . . 0.0 114.202 -175.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.728 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -106.0 -19.7 13.65 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.218 1.007 . . . . 0.0 113.113 168.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.583 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.0 ttp -72.25 -60.21 2.35 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.092 1.757 . . . . 0.0 110.68 -177.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.467 ' C ' HD22 ' A' ' 11' ' ' LEU . 9.3 pttp -75.28 15.78 0.41 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.601 1.16 . . . . 0.0 113.459 -173.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.467 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.6 mm? -127.03 -41.59 1.78 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 129.404 3.082 . . . . 0.0 111.391 -170.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.0 pt -60.95 -33.83 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 119.069 0.85 . . . . 0.0 112.125 178.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -17.58 44.65 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 175.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -96.71 -13.03 23.01 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 126.439 1.896 . . . . 0.0 111.929 -170.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.28 -48.7 9.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.183 0 C-N-CA 124.482 1.113 . . . . 0.0 108.776 167.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.2 -32.49 57.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 120.282 1.401 . . . . 0.0 111.434 -172.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -78.29 -2.76 39.52 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.381 -0.824 . . . . 0.0 112.893 175.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -117.22 -9.19 11.03 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.432 1.893 . . . . 0.0 113.816 -172.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -102.66 -97.78 0.29 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.003 0.82 . . . . 0.0 112.263 -170.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -137.33 83.21 1.98 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.588 1.155 . . . . 0.0 110.219 -177.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -62.46 -17.96 60.67 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 175.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.51 ' H ' ' HD3' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -79.96 -12.48 59.72 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.814 2.046 . . . . 0.0 114.799 168.491 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -145.06 67.06 13.17 Favored Pre-proline 0 N--CA 1.48 1.075 0 C-N-CA 127.368 2.267 . . . . 0.0 109.624 175.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.15 165.44 32.7 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.956 2.437 . . . . 0.0 112.99 -164.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -77.34 -175.49 3.74 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.684 1.194 . . . . 0.0 111.416 167.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.506 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 93.2 p -136.64 170.87 15.35 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.651 1.98 . . . . 0.0 109.634 171.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.5 p30 -54.03 -32.14 53.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 172.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -67.76 -54.11 21.88 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.011 -1.681 . . . . 0.0 110.691 169.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.506 ' HB2' ' H ' ' A' ' 26' ' ' SER . 22.1 mm-40 -62.45 -47.93 81.86 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 120.812 -1.18 . . . . 0.0 112.663 -174.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.4 pt -58.97 -39.13 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.625 1.102 . . . . 0.0 112.096 173.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.78 -35.37 79.62 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.578 1.081 . . . . 0.0 111.943 176.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -69.18 -52.34 28.89 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.439 1.096 . . . . 0.0 112.819 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.3 mt -64.22 -33.65 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 O-C-N 121.437 -0.789 . . . . 0.0 111.19 -178.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -62.11 -25.65 67.84 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.238 1.415 . . . . 0.0 112.644 176.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -79.01 -15.78 57.79 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -87.21 -12.73 45.96 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 123.446 0.698 . . . . 0.0 112.144 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.0 ptpt -126.79 -21.48 4.05 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -173.185 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.79 2.21 0.07 OUTLIER Glycine 0 N--CA 1.472 1.083 0 N-CA-C 115.932 1.133 . . . . 0.0 115.932 153.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -90.42 -19.75 23.57 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 118.334 1.067 . . . . 0.0 113.43 -167.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 35.82 25.17 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 130.699 3.6 . . . . 0.0 116.095 -175.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.548 HG21 HD22 ' A' ' 8' ' ' LEU . 2.6 p -81.75 137.93 20.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -169.175 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.39 158.73 31.13 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.148 2.179 . . . . 0.0 112.093 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -55.64 -30.81 61.63 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.841 1.257 . . . . 0.0 113.243 175.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -66.37 -34.36 77.8 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.117 1.367 . . . . 0.0 111.615 -174.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.8 m -83.66 -51.91 6.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 129.036 2.934 . . . . 0.0 109.882 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.93 -30.93 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.932 -173.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.84 -34.7 77.22 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.862 1.665 . . . . 0.0 111.788 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -84.18 -9.55 58.46 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.416 1.086 . . . . 0.0 112.989 176.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -90.03 -51.37 5.5 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.82 1.248 . . . . 0.0 112.297 176.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -20.31 5.96 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 174.046 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -65.26 -42.59 93.11 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.761 1.625 . . . . 0.0 113.143 173.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -94.61 -26.33 16.41 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.583 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.1 mt -73.73 -59.69 2.6 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.404 1.082 . . . . 0.0 112.166 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.89 -8.47 0.03 OUTLIER Glycine 0 CA--C 1.533 1.213 0 N-CA-C 118.142 2.017 . . . . 0.0 118.142 167.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.4 mt -69.6 121.63 83.04 Favored Pre-proline 0 CA--C 1.542 0.642 0 CA-C-N 119.439 1.62 . . . . 0.0 110.743 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.88 -64.36 0.05 OUTLIER 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.116 2.544 . . . . 0.0 109.308 178.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.1 p -150.94 -10.17 0.24 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.122 1.369 . . . . 0.0 114.422 158.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.3 m 56.85 -17.82 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 128.389 2.676 . . . . 0.0 116.455 -163.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -67.21 -42.34 84.29 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 120.308 1.413 . . . . 0.0 108.743 166.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.81 -22.11 60.87 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -71.27 -46.49 60.8 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.643 1.577 . . . . 0.0 111.667 166.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -75.37 -59.44 2.75 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.515 1.926 . . . . 0.0 113.405 -170.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 C--O 1.253 1.285 0 C-N-CA 127.384 2.274 . . . . 0.0 114.525 -167.596 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.633 0 C4'-C3'-C2' 100.396 -2.804 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.492 1 O4'-C1'-N19 111.133 4.166 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.61 1 O4'-C1'-N19 111.872 5.09 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.944 0 O4'-C1'-N19 110.038 2.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.107 0 P-O3'-C3' 123.609 3.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.703 0 P-O3'-C3' 122.893 2.661 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.145 0 O4'-C1'-N19 110.755 3.694 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.503 0 P-O3'-C3' 123.075 2.812 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.523 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.531 0 O4'-C1'-N19 110.571 3.464 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.409 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.073 1 C4'-C3'-C2' 99.076 -4.124 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.276 1 O4'-C1'-N19 111.371 4.463 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.485 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.496 0 O4'-C4'-C3' 108.806 3.206 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.485 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.314 0 P-O3'-C3' 123.459 3.132 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.411 0 C4'-C3'-C2' 99.774 -3.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.705 0 N19-C1'-C2' 109.288 -3.07 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.281 0 C3'-C2'-C1' 106.731 2.879 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.489 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.127 0 C4'-C3'-C2' 99.586 -3.614 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.489 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.309 0 C3'-C2'-C1' 106.408 2.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.409 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.416 0 P-O3'-C3' 123.468 3.14 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.523 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.953 1 O4'-C1'-N19 115.781 9.976 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.26 1 O4'-C1'-N19 111.03 4.038 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.583 0 O4'-C4'-C3' 108.961 3.361 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.173 0 O4'-C4'-C3' 108.742 3.142 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.976 0 C4'-C3'-C2' 100.134 -3.066 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C4'-C3' 108.379 2.779 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.261 0 P-O3'-C3' 124.111 3.676 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.912 0 O4'-C4'-C3' 108.291 2.691 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.739 0 P-O3'-C3' 122.596 2.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 . . . . . 0 N--CA 1.484 1.235 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -117.99 -27.51 6.13 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 -160.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.777 HD12 HD23 ' A' ' 8' ' ' LEU . 20.6 mt -86.56 169.14 13.04 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -174.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 60.2 p -73.44 -172.59 1.21 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.035 1.334 . . . . 0.0 111.582 171.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -51.86 -23.58 5.03 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.206 1.402 . . . . 0.0 114.73 172.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.64 29.44 0.24 Allowed Glycine 0 C--N 1.34 0.781 0 CA-C-O 117.339 -1.812 . . . . 0.0 116.939 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -62.01 -10.81 10.86 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 121.784 2.792 . . . . 0.0 113.82 178.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.777 HD23 HD12 ' A' ' 3' ' ' LEU . 1.9 pp -111.18 -16.89 13.33 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.624 1.17 . . . . 0.0 113.508 166.425 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.411 ' HG3' HD11 ' A' ' 53' ' ' LEU . 6.3 ttt -68.3 -67.06 0.49 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.224 1.41 . . . . 0.0 110.339 176.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.501 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.9 pttp -73.79 15.88 0.25 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.406 1.482 . . . . 0.0 113.673 -172.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.501 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -127.4 -35.15 2.2 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 128.798 2.839 . . . . 0.0 111.822 -172.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -61.3 -29.96 46.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.471 1.032 . . . . 0.0 112.023 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.52 -9.53 23.2 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -178.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -88.74 -16.61 31.78 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 125.64 1.576 . . . . 0.0 111.56 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 pp -101.45 -51.81 9.06 Favored 'Isoleucine or valine' 0 C--N 1.342 0.265 0 C-N-CA 123.974 0.91 . . . . 0.0 108.786 168.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.7 t -63.88 -35.48 73.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 120.378 1.444 . . . . 0.0 111.325 -172.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -80.77 -0.74 39.96 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -109.9 -19.78 12.99 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.752 1.621 . . . . 0.0 112.991 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -93.82 -95.47 0.16 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.741 0.816 . . . . 0.0 112.202 -167.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -139.98 85.53 2.03 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.194 0.998 . . . . 0.0 110.971 -175.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -58.05 -22.34 49.62 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.571 1.149 . . . . 0.0 113.354 168.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 -68.79 -23.83 64.33 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.079 2.152 . . . . 0.0 114.598 169.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -147.29 70.7 11.87 Favored Pre-proline 0 N--CA 1.481 1.115 0 C-N-CA 127.67 2.388 . . . . 0.0 109.771 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -76.82 173.58 14.24 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.167 2.578 . . . . 0.0 113.772 -165.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -89.8 -175.03 4.5 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.832 1.653 . . . . 0.0 112.158 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.7 p -140.08 175.99 9.13 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 126.749 2.02 . . . . 0.0 109.515 172.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 40.3 p-10 -49.28 -47.3 46.88 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 173.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -60.01 -51.17 70.78 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.025 -1.672 . . . . 0.0 110.706 173.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.418 ' O ' HD12 ' A' ' 33' ' ' ILE . 6.8 mm-40 -66.97 -43.39 83.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 120.934 -1.104 . . . . 0.0 113.366 -174.221 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 pt -60.07 -39.87 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 120.366 1.439 . . . . 0.0 111.881 171.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.84 -35.76 77.39 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.83 1.195 . . . . 0.0 112.257 174.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -67.66 -51.68 46.99 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.713 1.605 . . . . 0.0 112.323 -178.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.488 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -67.55 -32.68 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 O-C-N 121.372 -0.83 . . . . 0.0 111.598 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mp -63.53 -23.14 67.27 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.011 1.324 . . . . 0.0 112.022 175.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -82.37 -14.27 55.53 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 176.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -85.3 -13.33 50.03 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.463 0.705 . . . . 0.0 112.135 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.488 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.8 ptpt -127.38 -21.64 3.82 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -172.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.28 1.37 0.09 OUTLIER Glycine 0 N--CA 1.468 0.83 0 N-CA-C 115.521 0.968 . . . . 0.0 115.521 150.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.463 ' HB3' HD11 ' A' ' 3' ' ' LEU . 54.1 m-85 -85.1 -29.47 24.84 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.405 1.102 . . . . 0.0 112.59 -169.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.3 ptmt 28.84 41.81 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 130.388 3.475 . . . . 0.0 114.185 -173.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.665 HG21 HD22 ' A' ' 8' ' ' LEU . 2.4 p -79.78 139.73 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.305 1.042 . . . . 0.0 108.244 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.71 163.68 24.32 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.103 2.161 . . . . 0.0 112.515 177.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -61.78 -30.15 70.61 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 125.545 1.538 . . . . 0.0 114.205 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -71.96 -31.12 66.0 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.62 1.1 . . . . 0.0 111.791 -175.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 m -79.45 -48.89 13.17 Favored 'General case' 0 CA--C 1.505 -0.761 0 C-N-CA 125.853 1.661 . . . . 0.0 108.848 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -64.79 -32.06 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 CA-C-N 115.003 -0.998 . . . . 0.0 110.615 -176.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.95 -36.92 67.27 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 125.218 1.407 . . . . 0.0 112.354 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -75.64 -15.17 60.36 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.954 1.302 . . . . 0.0 112.655 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -90.28 -49.54 6.48 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.249 1.42 . . . . 0.0 111.991 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -22.8 26.63 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.426 1.012 . . . . 0.0 112.963 169.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -69.15 -45.3 70.41 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.706 1.202 . . . . 0.0 112.683 171.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 13.8 ptt? -87.08 -28.98 22.22 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.917 0.887 . . . . 0.0 113.283 -170.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.411 HD11 ' HG3' ' A' ' 9' ' ' MET . 1.3 mp -67.24 -65.52 0.67 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.505 1.122 . . . . 0.0 111.088 172.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.75 6.55 0.03 OUTLIER Glycine 0 CA--C 1.537 1.407 0 N-CA-C 119.594 2.598 . . . . 0.0 119.594 169.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 59.5 mt -82.91 124.13 77.16 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 120.399 2.099 . . . . 0.0 111.839 -173.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -51.57 -60.9 0.63 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 124.967 3.778 . . . . 0.0 112.852 170.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 90.7 p -162.41 -18.43 0.04 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 165.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 60.8 m 61.41 0.56 0.46 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.464 1.905 . . . . 0.0 115.181 -163.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -85.99 -16.28 38.82 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.797 1.639 . . . . 0.0 111.681 165.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.25 -14.01 9.28 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.311 1.444 . . . . 0.0 114.36 -176.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -70.8 -45.92 63.76 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.12 1.368 . . . . 0.0 112.032 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -76.07 -56.22 4.86 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.706 1.603 . . . . 0.0 112.728 -173.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.254 1.297 0 C-N-CA 126.923 2.089 . . . . 0.0 114.529 -168.543 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.694 0 C4'-C3'-C2' 100.2 -3.0 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.548 0 O4'-C1'-N19 110.881 3.851 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.154 1 O4'-C1'-N19 112.273 5.592 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.53 0 O4'-C4'-C3' 108.689 3.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . 0.466 ' H1 ' ' N4 ' ' C' ' 87' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.533 2.729 0 O5'-C5'-C4' 113.637 2.455 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.128 0 P-O3'-C3' 123.899 3.5 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.861 0 O4'-C1'-N19 110.611 3.513 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.981 0 P-O3'-C3' 122.971 2.726 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.54 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.137 1 O4'-C1'-N19 111.434 4.542 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.429 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.265 1 C4'-C3'-C2' 98.954 -4.246 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.408 -3.45 0 O4'-C1'-N19 110.79 3.737 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.438 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.174 0 O4'-C4'-C3' 108.991 3.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.438 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.179 0 P-O3'-C3' 123.411 3.093 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.163 0 C4'-C3'-C2' 99.814 -3.386 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.639 0 N19-C1'-C2' 108.539 -3.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.32 0 C3'-C2'-C1' 107.086 3.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.456 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.268 0 C4'-C3'-C2' 99.602 -3.598 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.456 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.54 0 P-O3'-C3' 122.526 2.355 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.429 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.554 1 O4'-C1'-N19 113.744 7.43 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.54 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.689 2 O4'-C1'-N19 117.836 12.544 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.31 1 O4'-C1'-N19 111.288 4.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.307 0 C3'-C2'-C1' 105.624 2.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.387 0 O4'-C4'-C3' 108.642 3.042 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . 0.466 ' N4 ' ' H1 ' ' B' ' 68' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.16 0 C4'-C3'-C2' 100.118 -3.082 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.378 0 O4'-C4'-C3' 108.411 2.811 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.847 0 O4'-C4'-C3' 108.558 2.958 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.275 0 O4'-C4'-C3' 108.572 2.972 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.804 0 P-O3'-C3' 122.694 2.495 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.8 p80 . . . . . 0 N--CA 1.483 1.204 0 CA-C-O 120.891 0.377 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 50.5 mtt -131.86 -47.6 0.95 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.905 1.282 . . . . 0.0 112.428 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.744 HD12 HD23 ' A' ' 8' ' ' LEU . 32.1 mt -100.32 177.91 4.91 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.541 1.536 . . . . 0.0 113.334 -174.33 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 38.9 p -73.44 -164.31 0.19 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.009 1.724 . . . . 0.0 112.571 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -49.06 -24.98 1.79 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.433 1.493 . . . . 0.0 114.468 169.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 178.83 51.23 0.08 OUTLIER Glycine 0 C--N 1.341 0.807 0 CA-C-O 118.598 -1.112 . . . . 0.0 114.53 169.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.64 -13.88 55.7 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.913 1.857 . . . . 0.0 113.947 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.744 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -106.37 -19.18 13.77 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.464 1.105 . . . . 0.0 113.106 167.343 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.472 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.5 ttt -72.65 -57.97 3.72 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.322 1.849 . . . . 0.0 111.196 -175.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.479 ' C ' HD22 ' A' ' 11' ' ' LEU . 9.0 pttp -77.08 15.71 0.66 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.691 1.196 . . . . 0.0 113.046 -174.202 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.479 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -126.27 -40.91 1.94 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 129.473 3.109 . . . . 0.0 110.899 -170.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 pt -61.68 -37.85 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 118.776 0.717 . . . . 0.0 111.356 -178.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.94 -16.47 50.4 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -98.25 -16.15 19.54 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 126.452 1.901 . . . . 0.0 112.016 -168.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -99.09 -43.5 11.55 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 C-N-CA 124.737 1.215 . . . . 0.0 109.379 167.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.65 -32.09 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 119.818 1.19 . . . . 0.0 111.139 -175.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -77.99 -3.92 44.43 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 121.453 -0.779 . . . . 0.0 112.92 174.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -105.33 -16.24 14.81 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.721 1.608 . . . . 0.0 112.551 -176.087 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -101.31 -97.48 0.27 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.713 0.688 . . . . 0.0 112.393 -169.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -137.01 87.8 2.31 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.391 1.077 . . . . 0.0 110.13 -177.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -59.79 -17.51 36.18 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.651 1.18 . . . . 0.0 114.163 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -93.87 -2.55 53.23 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.431 1.892 . . . . 0.0 114.595 171.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -142.57 63.94 15.06 Favored Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 127.755 2.422 . . . . 0.0 110.45 174.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -71.21 160.38 49.15 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.274 2.65 . . . . 0.0 112.743 -165.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -74.53 -178.59 3.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.998 0.919 . . . . 0.0 111.066 164.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.484 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 46.5 p -142.84 172.93 12.02 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.387 1.475 . . . . 0.0 109.96 172.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -55.11 -33.53 62.92 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.83 1.418 . . . . 0.0 114.83 -174.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.8 tp60 -67.2 -51.03 58.42 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 120.159 -1.588 . . . . 0.0 110.661 169.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.484 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.3 mm-40 -62.39 -50.56 71.04 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 120.959 -1.088 . . . . 0.0 111.949 -173.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 pt -58.97 -37.82 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.455 1.025 . . . . 0.0 112.424 174.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.86 -34.94 78.42 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.307 0.958 . . . . 0.0 112.047 177.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -69.1 -52.0 32.81 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.413 1.085 . . . . 0.0 112.659 -178.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -63.95 -32.88 58.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 O-C-N 121.413 -0.804 . . . . 0.0 111.4 -177.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.74 -22.89 67.14 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.28 1.432 . . . . 0.0 112.736 175.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.7 ptmt -81.31 -14.62 57.14 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.663 -0.648 . . . . 0.0 112.736 175.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -85.93 -14.02 46.0 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.305 0.642 . . . . 0.0 111.969 -178.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.1 ptpt -126.66 -22.23 3.95 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -171.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.95 1.99 0.07 OUTLIER Glycine 0 N--CA 1.47 0.961 0 N-CA-C 115.82 1.088 . . . . 0.0 115.82 151.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -87.82 -27.19 22.42 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.314 1.057 . . . . 0.0 112.839 -168.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.0 ptmt 30.49 40.51 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 130.101 3.36 . . . . 0.0 114.253 -173.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.629 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -82.51 141.43 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.412 ' H ' ' P ' ' C' ' 84' ' ' ' DT' . . . -82.35 166.35 19.54 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 127.433 2.293 . . . . 0.0 112.449 176.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -64.56 -24.87 67.74 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.309 1.444 . . . . 0.0 114.587 -174.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -70.28 -39.03 75.16 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.16 -0.963 . . . . 0.0 111.948 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.1 m -78.74 -45.82 20.3 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 126.588 1.955 . . . . 0.0 109.003 -175.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.47 -32.5 58.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.093 -176.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.2 -35.92 74.25 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.595 1.558 . . . . 0.0 111.949 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.0 mttm -78.54 -18.95 53.94 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.592 1.157 . . . . 0.0 112.41 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -82.01 -48.44 11.43 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.46 1.104 . . . . 0.0 112.616 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.05 -20.76 10.26 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 175.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -68.54 -46.6 69.1 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.76 1.224 . . . . 0.0 112.822 173.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -82.87 -27.14 30.97 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -173.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.472 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.3 mt -70.61 -59.77 2.64 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.476 1.11 . . . . 0.0 111.724 176.277 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.59 6.04 0.03 OUTLIER Glycine 0 CA--C 1.535 1.305 0 N-CA-C 118.714 2.246 . . . . 0.0 118.714 169.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.8 mt -90.15 126.58 56.53 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 119.898 1.849 . . . . 0.0 111.157 -173.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.48 -52.04 0.29 Allowed 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.447 2.765 . . . . 0.0 111.034 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.1 p -160.68 -10.68 0.05 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.386 1.624 . . . . 0.0 115.386 161.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.6 m 64.63 -19.5 0.08 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 128.059 2.544 . . . . 0.0 115.731 -166.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.8 ttp180 -69.13 -36.94 78.03 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.626 1.171 . . . . 0.0 109.373 171.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -24.71 33.25 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.555 1.142 . . . . 0.0 113.576 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -74.01 -40.07 63.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.212 1.405 . . . . 0.0 112.704 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -63.69 -63.48 1.16 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 126.053 1.741 . . . . 0.0 112.277 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.6 tp . . . . . 0 C--O 1.253 1.267 0 C-N-CA 126.729 2.012 . . . . 0.0 114.357 -167.715 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.758 0 O5'-C5'-C4' 114.267 2.905 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.482 1 O4'-C1'-N19 112.17 5.462 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.659 1 O4'-C1'-N19 111.731 4.914 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.971 0 O4'-C1'-N19 110.714 3.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . 0.46 ' H1 ' ' N4 ' ' C' ' 87' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.081 0 P-O3'-C3' 123.314 3.012 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.151 0 P-O3'-C3' 123.163 2.885 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.931 1 O4'-C1'-N19 111.143 4.179 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.251 0 P-O3'-C3' 123.215 2.929 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.497 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.582 1 O4'-C1'-N19 111.013 4.016 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.468 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.381 1 C4'-C3'-C2' 98.956 -4.244 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.275 1 O4'-C1'-N19 111.306 4.382 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.479 " H2'" ' H72' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.401 0 O4'-C4'-C3' 108.857 3.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.479 ' H72' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.217 0 P-O3'-C3' 123.578 3.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.317 0 C4'-C3'-C2' 99.847 -3.353 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.761 0 N19-C1'-C2' 108.707 -3.433 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.208 0 O4'-C1'-N19 110.246 3.058 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.547 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.418 0 P-O3'-C3' 123.747 3.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.547 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.362 0 O4'-C4'-C3' 108.649 3.049 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.468 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.744 0 O4'-C1'-N19 110.893 3.867 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.497 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.096 2 O4'-C1'-N19 117.474 12.093 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . 0.412 ' P ' ' H ' ' A' ' 42' ' ' ALA . . . . . . . . 0 C5'--C4' 1.536 3.165 0 O4'-C1'-N19 110.393 3.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.659 0 O4'-C4'-C3' 109.361 3.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.551 0 O4'-C4'-C3' 108.443 2.843 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . 0.46 ' N4 ' ' H1 ' ' B' ' 68' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.222 0 P-O3'-C3' 123.116 2.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.985 0 O4'-C1'-N19 110.891 3.864 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.503 0 P-O3'-C3' 122.978 2.732 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 0 O4'-C4'-C3' 108.345 2.745 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.927 0 P-O3'-C3' 122.799 2.583 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 119.767 -0.158 . . . . 0.0 111.041 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 10.5 ttt 57.07 15.9 2.64 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 117.384 2.365 . . . . 0.0 117.384 156.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.796 HD12 HD23 ' A' ' 8' ' ' LEU . 34.2 mt -61.63 170.41 1.95 Allowed 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 -175.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.7 p -75.15 -167.33 0.6 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.196 1.799 . . . . 0.0 113.004 -177.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -48.75 -24.68 1.49 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.638 1.575 . . . . 0.0 114.697 173.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.69 44.72 0.11 Allowed Glycine 0 C--N 1.341 0.857 0 CA-C-O 117.874 -1.514 . . . . 0.0 115.745 170.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -61.87 -13.98 29.49 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.612 2.206 . . . . 0.0 113.487 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.796 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -112.33 -17.55 12.7 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.969 1.308 . . . . 0.0 113.228 168.61 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.416 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.5 ttt -72.0 -60.54 2.18 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.198 1.399 . . . . 0.0 111.166 -176.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.458 ' C ' HD22 ' A' ' 11' ' ' LEU . 16.3 pttt -75.17 18.86 0.17 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.378 1.071 . . . . 0.0 113.624 -174.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.458 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -126.22 -43.77 1.77 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 129.318 3.047 . . . . 0.0 110.168 -171.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.5 pt -63.19 -32.02 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 118.268 0.486 . . . . 0.0 112.078 -173.405 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.46 -14.85 23.39 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -89.86 -14.28 34.67 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.785 2.034 . . . . 0.0 111.673 -176.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -105.47 -52.38 7.54 Favored 'Isoleucine or valine' 0 C--N 1.341 0.214 0 C-N-CA 124.34 1.056 . . . . 0.0 108.72 167.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.77 -36.88 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 120.608 1.549 . . . . 0.0 111.382 -170.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -87.24 9.28 20.72 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -116.96 -24.35 7.64 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.028 1.731 . . . . 0.0 112.99 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -85.6 -79.32 0.24 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.415 1.086 . . . . 0.0 111.282 -171.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -139.2 86.7 2.15 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.561 1.144 . . . . 0.0 110.747 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -59.68 -19.37 49.15 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.278 1.031 . . . . 0.0 113.615 170.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -16.94 39.03 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 127.217 2.207 . . . . 0.0 114.654 171.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -148.21 72.76 11.07 Favored Pre-proline 0 N--CA 1.481 1.116 0 C-N-CA 127.175 2.19 . . . . 0.0 110.386 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -72.75 168.35 24.79 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.054 2.503 . . . . 0.0 113.236 -170.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -78.93 -173.81 3.71 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.212 1.405 . . . . 0.0 110.629 166.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.485 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 91.1 p -133.93 172.54 12.67 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.898 1.679 . . . . 0.0 109.284 171.368 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -65.76 -23.52 66.75 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.292 -0.88 . . . . 0.0 112.453 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -68.74 -54.15 17.74 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.418 -1.426 . . . . 0.0 110.665 165.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.485 ' HB2' ' H ' ' A' ' 26' ' ' SER . 19.5 mm-40 -61.96 -48.0 82.32 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 120.843 -1.161 . . . . 0.0 112.606 -174.468 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 pt -60.83 -38.61 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-N 119.544 1.066 . . . . 0.0 112.207 173.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.74 -34.48 75.9 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.631 1.105 . . . . 0.0 111.712 177.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -67.81 -55.44 12.98 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.676 1.191 . . . . 0.0 112.886 178.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.447 HG22 ' HE2' ' A' ' 37' ' ' LYS . 1.9 mt -64.83 -32.54 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 O-C-N 121.463 -0.773 . . . . 0.0 111.167 -176.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.3 -22.64 66.2 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.74 1.216 . . . . 0.0 112.214 176.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 pttm -81.86 -13.03 58.17 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 175.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -90.01 -9.28 49.21 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.503 0.721 . . . . 0.0 112.191 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.447 ' HE2' HG22 ' A' ' 33' ' ' ILE . 23.6 pttt -127.61 -23.3 3.47 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 114.862 1.431 . . . . 0.0 114.862 -176.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 154.35 4.53 0.11 Allowed Glycine 0 N--CA 1.471 1.033 0 CA-C-N 119.377 0.99 . . . . 0.0 115.418 151.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.48 ' HB3' HD11 ' A' ' 3' ' ' LEU . 45.2 m-85 -84.46 -31.35 24.61 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 118.148 0.974 . . . . 0.0 111.943 -171.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.1 ptmt 26.11 50.7 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 129.802 3.241 . . . . 0.0 113.01 -172.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.694 HG21 HD22 ' A' ' 8' ' ' LEU . 4.8 p -88.12 140.62 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.648 1.579 . . . . 0.0 108.77 171.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.6 165.33 17.13 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 129.025 2.93 . . . . 0.0 113.309 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -25.62 68.08 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.471 1.908 . . . . 0.0 114.65 -175.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -34.45 75.93 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.823 1.249 . . . . 0.0 110.785 -178.255 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 m -87.18 -47.05 9.19 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 127.407 2.283 . . . . 0.0 110.509 -176.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.23 -28.7 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.875 -173.293 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.95 -37.23 72.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.176 1.79 . . . . 0.0 113.129 174.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -70.54 -23.65 62.66 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.262 1.025 . . . . 0.0 112.281 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -80.5 -40.72 25.56 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -175.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -55.4 -25.15 34.07 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 118.943 0.792 . . . . 0.0 112.629 174.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -70.15 -38.13 75.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 176.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.5 ptp -81.09 -26.66 36.07 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.416 HD21 ' HG3' ' A' ' 9' ' ' MET . 2.1 mt -73.61 -59.76 2.56 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.345 1.058 . . . . 0.0 111.758 172.725 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 156.12 15.03 0.05 OUTLIER Glycine 0 CA--C 1.536 1.344 0 N-CA-C 117.648 1.819 . . . . 0.0 117.648 167.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.1 mt -117.49 133.23 23.27 Favored Pre-proline 0 CA--C 1.548 0.874 0 CA-C-N 119.2 1.5 . . . . 0.0 111.328 -167.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -71.74 -52.83 0.19 Allowed 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.926 3.084 . . . . 0.0 113.793 -177.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.9 p -156.35 -9.2 0.1 Allowed 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.6 m 61.78 -13.97 0.05 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.144 2.178 . . . . 0.0 115.568 -166.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -85.23 -36.69 20.79 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.753 1.621 . . . . 0.0 110.476 176.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -20.23 57.7 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 177.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 64.4 mtp85 -70.43 -42.2 71.89 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.047 1.739 . . . . 0.0 111.977 167.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -70.65 -59.17 2.98 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.392 1.877 . . . . 0.0 113.224 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.9 tp . . . . . 0 C--O 1.255 1.355 0 C-N-CA 126.593 1.957 . . . . 0.0 114.595 -166.816 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.613 0 C4'-C3'-C2' 100.374 -2.826 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.548 0 O4'-C1'-N19 110.06 2.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.491 1 O4'-C1'-N19 113.303 6.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.501 0 O4'-C1'-N19 110.604 3.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.733 0 P-O3'-C3' 123.868 3.473 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.495 0 P-O3'-C3' 123.075 2.812 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.092 0 O4'-C1'-N19 110.83 3.788 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.803 0 P-O3'-C3' 123.155 2.879 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.52 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.454 0 O4'-C1'-N19 110.87 3.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.466 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.536 1 C4'-C3'-C2' 99.016 -4.184 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.533 1 O4'-C1'-N19 111.338 4.422 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.447 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.504 0 O4'-C4'-C3' 108.765 3.165 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.447 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.405 0 P-O3'-C3' 123.984 3.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.385 0 C4'-C3'-C2' 99.974 -3.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.737 0 N19-C1'-C2' 108.782 -3.386 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.394 0 C3'-C2'-C1' 106.883 2.988 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.5 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.47 0 C4'-C3'-C2' 99.566 -3.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.5 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.272 0 C3'-C2'-C1' 106.563 2.759 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.466 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.53 1 O4'-C1'-N19 112.052 5.315 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.52 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.535 2.959 2 O4'-C1'-N19 117.638 12.297 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.058 1 O4'-C1'-N19 111.878 5.098 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.804 0 O4'-C4'-C3' 109.538 3.938 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.595 0 C3'-C2'-C1' 106.158 2.47 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.542 0 C4'-C3'-C2' 100.654 -2.546 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.543 0 O4'-C1'-N19 110.469 3.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.248 0 P-O3'-C3' 123.805 3.421 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.229 0 O4'-C4'-C3' 108.239 2.639 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.045 0 P-O3'-C3' 122.599 2.416 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 . . . . . 0 N--CA 1.481 1.079 0 CA-C-O 119.517 -0.277 . . . . 0.0 111.553 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.7 ptt? 48.61 15.79 0.09 Allowed 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 118.238 2.681 . . . . 0.0 118.238 168.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.78 HD12 HD23 ' A' ' 8' ' ' LEU . 39.1 mt -54.47 171.57 0.12 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 127.642 2.377 . . . . 0.0 116.605 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.9 p -72.34 -168.11 0.39 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.102 1.761 . . . . 0.0 112.7 -178.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -48.7 -24.4 1.37 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.446 1.498 . . . . 0.0 114.72 172.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.54 41.18 0.11 Allowed Glycine 0 CA--C 1.527 0.817 0 CA-C-O 117.75 -1.583 . . . . 0.0 115.769 173.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -62.63 -13.01 26.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 121.25 2.525 . . . . 0.0 113.871 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.797 HD22 HG21 ' A' ' 41' ' ' VAL . 1.8 pp -109.35 -17.39 13.81 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.692 1.197 . . . . 0.0 113.627 167.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.6 ttt -67.7 -66.01 0.62 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.948 1.299 . . . . 0.0 109.982 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.542 ' C ' HD22 ' A' ' 11' ' ' LEU . 4.3 pttp -74.43 17.17 0.21 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.207 1.403 . . . . 0.0 113.829 -172.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.542 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -130.03 -34.34 1.69 Allowed 'General case' 0 C--O 1.234 0.289 0 C-N-CA 129.082 2.953 . . . . 0.0 111.946 -172.42 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -62.8 -34.15 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 119.689 1.131 . . . . 0.0 111.656 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -9.93 41.88 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -178.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -91.13 -15.99 28.52 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.559 1.943 . . . . 0.0 111.943 -175.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -105.03 -47.93 9.4 Favored 'Isoleucine or valine' 0 C--N 1.342 0.252 0 C-N-CA 124.621 1.168 . . . . 0.0 109.337 168.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 63.6 t -66.56 -35.6 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 119.982 1.265 . . . . 0.0 111.249 -172.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -78.84 -0.59 31.23 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.561 -0.712 . . . . 0.0 112.612 176.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -109.65 -13.15 14.56 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.593 1.957 . . . . 0.0 113.544 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -101.92 -89.55 0.36 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.537 0.735 . . . . 0.0 112.531 -170.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -135.67 91.24 2.69 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 122.433 1.111 . . . . 0.0 112.371 -173.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -53.53 -30.98 44.35 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.61 1.564 . . . . 0.0 113.389 170.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.42 -8.69 49.92 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.613 1.965 . . . . 0.0 114.986 177.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -145.49 76.84 12.91 Favored Pre-proline 0 N--CA 1.481 1.114 0 C-N-CA 126.681 1.992 . . . . 0.0 110.345 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -72.02 164.43 35.69 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.796 2.331 . . . . 0.0 112.643 -172.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -78.69 -174.79 4.07 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.488 1.115 . . . . 0.0 110.91 166.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.485 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 81.2 p -136.88 169.87 17.03 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.127 1.771 . . . . 0.0 109.949 172.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.4 p30 -53.06 -33.77 53.48 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 176.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -68.16 -53.56 24.24 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 119.982 -1.698 . . . . 0.0 110.678 169.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.485 ' HB2' ' H ' ' A' ' 26' ' ' SER . 20.3 mm-40 -61.34 -49.12 78.26 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 120.929 -1.107 . . . . 0.0 112.504 -174.355 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.0 pt -59.64 -38.26 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-N 119.574 1.079 . . . . 0.0 112.222 174.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.94 -35.54 78.74 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.625 1.102 . . . . 0.0 111.829 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -69.26 -53.14 21.31 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.566 1.146 . . . . 0.0 112.656 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.437 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.4 mt -64.36 -32.74 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.112 0.869 . . . . 0.0 111.53 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 mp -63.11 -22.03 66.59 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.78 1.232 . . . . 0.0 112.181 176.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.3 pttt -79.43 -16.03 56.83 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 174.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -89.57 -11.22 43.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.945 0.898 . . . . 0.0 112.146 -176.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.437 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.0 ptpt -126.8 -22.32 3.89 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -173.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.46 0.92 0.06 OUTLIER Glycine 0 N--CA 1.472 1.043 0 N-CA-C 116.215 1.246 . . . . 0.0 116.215 153.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.432 ' HB3' HD11 ' A' ' 3' ' ' LEU . 48.2 m-85 -91.45 -30.97 16.18 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.76 1.28 . . . . 0.0 113.159 -166.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt 26.66 50.05 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 129.391 3.076 . . . . 0.0 113.081 -170.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.797 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -86.7 138.45 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.729 1.612 . . . . 0.0 108.849 174.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.54 161.91 26.69 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 128.344 2.658 . . . . 0.0 112.16 177.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -59.44 -27.58 66.2 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.409 1.483 . . . . 0.0 113.513 179.226 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -66.53 -34.29 77.59 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.405 1.482 . . . . 0.0 111.167 -174.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.0 m -87.1 -48.85 7.73 Favored 'General case' 0 CA--C 1.509 -0.601 0 C-N-CA 128.346 2.658 . . . . 0.0 110.397 -178.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.44 -29.45 46.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.994 -172.224 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.04 -42.8 80.01 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 125.608 1.563 . . . . 0.0 111.175 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -70.24 -19.61 63.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.775 1.23 . . . . 0.0 112.406 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -87.94 -46.7 9.16 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.634 1.174 . . . . 0.0 113.264 -177.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -22.81 40.94 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.389 0.995 . . . . 0.0 112.557 172.104 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -72.22 -42.31 65.88 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.661 1.185 . . . . 0.0 112.739 172.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.2 ptm -83.35 -30.14 27.69 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.829 0.852 . . . . 0.0 113.107 -173.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.9 mp -67.65 -67.82 0.43 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.665 1.186 . . . . 0.0 111.061 173.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.18 6.46 0.03 OUTLIER Glycine 0 CA--C 1.536 1.356 0 N-CA-C 118.427 2.131 . . . . 0.0 118.427 172.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.1 mt -84.74 125.42 71.15 Favored Pre-proline 0 CA--C 1.545 0.784 0 CA-C-N 119.87 1.835 . . . . 0.0 110.838 -177.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.6 -53.35 0.36 Allowed 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.923 2.416 . . . . 0.0 110.642 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 82.7 p -161.11 -10.82 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.484 1.514 . . . . 0.0 114.988 162.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.9 m 62.36 -19.71 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.38 2.672 . . . . 0.0 115.752 -165.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -67.75 -44.43 77.53 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.584 1.554 . . . . 0.0 108.688 169.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -22.85 59.24 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -178.111 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -73.75 -42.3 61.28 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.426 1.49 . . . . 0.0 111.821 170.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -73.61 -58.89 2.99 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.841 1.656 . . . . 0.0 113.036 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.253 1.26 0 C-N-CA 126.127 1.771 . . . . 0.0 114.459 -167.707 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.173 0 O5'-C5'-C4' 114.822 3.302 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.974 0 O4'-C1'-N19 110.825 3.782 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.515 1 O4'-C1'-N19 112.19 5.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.917 1 O4'-C1'-N19 111.087 4.108 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.111 0 O4'-C4'-C3' 108.607 3.007 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.269 0 C5'-C4'-C3' 109.988 -3.141 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.082 1 O4'-C1'-N19 111.405 4.506 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.017 0 P-O3'-C3' 123.238 2.949 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.512 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.526 1 O4'-C1'-N19 111.072 4.09 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.515 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.225 1 C4'-C3'-C2' 99.017 -4.183 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.224 0 O4'-C1'-N19 110.868 3.836 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.297 0 O4'-C4'-C3' 108.876 3.276 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.409 0 P-O3'-C3' 123.772 3.393 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.365 0 C4'-C3'-C2' 100.044 -3.156 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.694 0 N19-C1'-C2' 108.63 -3.481 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.396 0 C3'-C2'-C1' 107.06 3.114 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.539 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.513 0 O4'-C4'-C3' 109.209 3.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.539 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.39 0 O4'-C4'-C3' 108.812 3.212 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.515 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.878 1 O4'-C1'-N19 111.903 5.129 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.512 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.89 2 O4'-C1'-N19 117.257 11.821 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.823 1 O4'-C1'-N19 111.438 4.548 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.29 0 O4'-C4'-C3' 108.735 3.135 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.177 0 O4'-C4'-C3' 108.707 3.107 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.207 0 P-O3'-C3' 122.855 2.629 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.394 1 O4'-C1'-N19 111.083 4.103 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.409 0 O4'-C1'-N19 110.735 3.668 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.462 0 O4'-C4'-C3' 108.394 2.794 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.153 0 P-O3'-C3' 122.516 2.347 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' HIS . . . . . 0.46 ' HA ' " H4'" ' C' ' 83' ' ' ' DG' . 63.3 m80 . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.057 0.456 . . . . 0.0 112.085 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 80.4 mmm 64.96 11.59 7.17 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.584 2.354 . . . . 0.0 116.762 163.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.76 HD12 HD23 ' A' ' 8' ' ' LEU . 15.5 mt -61.82 165.12 5.55 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 122.134 0.969 . . . . 0.0 113.599 172.03 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.7 p -73.47 -169.31 0.65 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.705 1.202 . . . . 0.0 112.513 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -48.91 -24.66 1.56 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.554 1.542 . . . . 0.0 114.699 172.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.28 44.21 0.16 Allowed Glycine 0 C--N 1.341 0.841 0 CA-C-O 117.953 -1.471 . . . . 0.0 115.864 172.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -61.41 -14.92 31.91 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.7 2.25 . . . . 0.0 113.47 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.76 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -109.97 -17.21 13.66 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.716 1.206 . . . . 0.0 112.814 169.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.465 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.2 ttt -74.05 -59.17 2.84 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.914 1.686 . . . . 0.0 111.517 -175.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.486 ' C ' HD22 ' A' ' 11' ' ' LEU . 19.4 pttt -76.86 19.26 0.3 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.91 1.284 . . . . 0.0 112.918 -174.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.486 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -128.45 -41.33 1.55 Allowed 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 129.716 3.207 . . . . 0.0 110.574 -170.175 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 pt -61.33 -37.75 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 118.69 0.677 . . . . 0.0 111.274 -177.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.42 -14.01 44.57 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.715 1.005 . . . . 0.0 113.715 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.7 tp10 -95.21 -19.96 19.62 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 125.972 1.709 . . . . 0.0 111.761 -170.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -98.61 -46.53 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 C-N-CA 124.813 1.245 . . . . 0.0 109.149 169.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.81 -35.44 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.593 1.088 . . . . 0.0 111.324 -173.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -79.01 -2.64 41.24 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 177.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -104.85 -17.64 14.5 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.204 1.801 . . . . 0.0 112.87 -176.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -97.32 -91.73 0.25 Allowed 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.577 0.751 . . . . 0.0 112.256 -169.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -137.18 89.26 2.42 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 125.064 1.346 . . . . 0.0 110.218 177.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.3 mtmm -59.12 -18.81 39.06 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.62 1.168 . . . . 0.0 112.754 167.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -21.47 61.57 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 127.436 2.295 . . . . 0.0 114.051 169.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.5 mtmt -148.73 74.66 10.29 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 127.819 2.448 . . . . 0.0 109.747 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -68.75 161.56 44.89 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.09 2.526 . . . . 0.0 113.011 -169.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -76.5 -172.73 2.27 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.714 1.206 . . . . 0.0 110.671 167.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.432 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 59.7 p -136.78 167.51 21.3 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 126.316 1.847 . . . . 0.0 109.457 176.131 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 51.3 p30 -54.66 -30.96 56.83 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 175.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -68.17 -54.45 17.88 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.0 -1.688 . . . . 0.0 110.702 168.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.432 ' HB2' ' H ' ' A' ' 26' ' ' SER . 40.0 mt-10 -62.71 -47.78 82.13 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 120.659 -1.275 . . . . 0.0 112.757 -173.52 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.1 pt -59.27 -38.24 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-N 119.518 1.053 . . . . 0.0 112.142 173.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.8 -35.46 79.93 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.647 1.112 . . . . 0.0 112.138 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -67.31 -53.11 32.66 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.651 1.18 . . . . 0.0 112.952 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.478 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -64.74 -32.42 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 O-C-N 121.567 -0.708 . . . . 0.0 111.657 -176.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.29 -22.36 66.82 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 125.174 1.39 . . . . 0.0 112.149 175.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -81.28 -14.6 57.23 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 175.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -87.57 -11.51 48.47 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.562 0.745 . . . . 0.0 111.992 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.478 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.1 ptpt -127.49 -22.73 3.6 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -173.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.45 0.5 0.07 OUTLIER Glycine 0 N--CA 1.47 0.931 0 N-CA-C 115.93 1.132 . . . . 0.0 115.93 152.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -89.48 -29.4 19.0 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.426 1.113 . . . . 0.0 112.694 -167.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt 29.03 43.37 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 130.243 3.417 . . . . 0.0 114.181 -173.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.569 HG21 HD22 ' A' ' 8' ' ' LEU . 3.3 p -83.4 144.24 10.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.092 0.957 . . . . 0.0 109.132 175.411 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.45 165.5 14.29 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.307 2.643 . . . . 0.0 112.806 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.01 -29.5 69.74 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.494 1.518 . . . . 0.0 114.254 -175.212 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -68.42 -32.11 71.92 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.188 0.904 . . . . 0.0 111.747 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.402 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 2.1 m -84.15 -48.16 10.12 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 127.913 2.485 . . . . 0.0 110.174 -177.452 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.9 -28.98 44.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.641 -173.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.56 -33.4 72.7 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.804 1.642 . . . . 0.0 111.921 176.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -72.74 -22.5 60.85 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.734 0.814 . . . . 0.0 112.693 174.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -83.49 -44.17 14.99 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.514 0.726 . . . . 0.0 112.909 -174.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.17 -30.65 7.1 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 118.785 0.72 . . . . 0.0 112.926 172.19 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -72.64 -33.07 66.36 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.195 0.998 . . . . 0.0 112.853 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 23.6 ptt? -94.37 -22.74 18.13 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.861 1.059 . . . . 0.0 113.861 -176.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.465 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.2 mt -72.92 -63.64 1.13 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.148 0.979 . . . . 0.0 111.374 170.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 165.93 -2.78 0.05 OUTLIER Glycine 0 CA--C 1.536 1.349 0 N-CA-C 117.675 1.83 . . . . 0.0 117.675 169.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.8 mt -72.63 128.06 88.98 Favored Pre-proline 0 CA--C 1.547 0.861 0 CA-C-N 119.127 1.463 . . . . 0.0 111.074 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.73 -64.42 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 123.459 2.773 . . . . 0.0 109.887 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 77.2 p -149.04 -10.41 0.33 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.1 1.36 . . . . 0.0 114.58 164.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.9 m 59.24 -14.58 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 128.436 2.694 . . . . 0.0 116.259 -165.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -67.39 -45.21 76.87 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.421 1.489 . . . . 0.0 108.76 165.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -22.34 59.25 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -177.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -73.99 -41.93 61.19 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.543 1.537 . . . . 0.0 111.76 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -73.58 -58.38 3.35 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.441 1.496 . . . . 0.0 113.192 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.253 1.264 0 C-N-CA 126.622 1.969 . . . . 0.0 114.479 -168.031 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.823 0 C4'-C3'-C2' 100.316 -2.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.315 0 O4'-C1'-N19 110.552 3.44 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.508 1 O4'-C1'-N19 112.079 5.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.998 1 O4'-C1'-N19 111.125 4.156 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.679 0 O4'-C1'-N19 109.821 2.526 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.54 0 P-O3'-C3' 123.164 2.887 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.907 0 O4'-C1'-N19 110.487 3.358 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.015 0 P-O3'-C3' 123.165 2.888 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.517 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.574 1 O4'-C1'-N19 111.369 4.462 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.488 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.529 1 C4'-C3'-C2' 98.9 -4.3 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.39 1 O4'-C1'-N19 111.409 4.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.448 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.489 0 O4'-C4'-C3' 108.731 3.131 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.448 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.239 0 P-O3'-C3' 123.844 3.453 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.356 0 C4'-C3'-C2' 100.061 -3.139 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.679 0 N19-C1'-C2' 109.035 -3.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.408 0 C3'-C2'-C1' 107.184 3.203 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.554 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.455 0 O4'-C4'-C3' 109.145 3.545 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.554 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.064 0 O4'-C4'-C3' 108.673 3.073 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.488 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.465 1 O4'-C1'-N19 112.013 5.266 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.517 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.535 3.002 3 O4'-C1'-N19 117.526 12.157 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.092 0 O4'-C1'-N19 110.392 3.241 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.548 0 O4'-C4'-C3' 109.349 3.749 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.477 0 O4'-C4'-C3' 108.085 2.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.29 0 O4'-C1'-N19 110.097 2.872 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.553 0 O4'-C1'-N19 110.113 2.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.369 0 P-O3'-C3' 123.904 3.503 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.996 0 O4'-C4'-C3' 108.071 2.471 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.966 0 P-O3'-C3' 122.713 2.511 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 29.4 p80 . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.856 0.36 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 17.3 tpt -83.75 -55.35 4.31 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.495 1.118 . . . . 0.0 112.073 176.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.831 HD12 HD23 ' A' ' 8' ' ' LEU . 33.1 mt -104.87 176.35 5.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.236 1.814 . . . . 0.0 113.385 -169.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.3 p -73.97 -169.24 0.72 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.625 1.57 . . . . 0.0 112.645 177.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -49.19 -24.88 1.91 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.78 1.632 . . . . 0.0 114.626 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.63 45.76 0.12 Allowed Glycine 0 C--N 1.34 0.8 0 CA-C-O 118.174 -1.348 . . . . 0.0 114.833 171.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.36 -19.85 38.82 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 120.038 1.919 . . . . 0.0 113.552 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.831 HD23 HD12 ' A' ' 3' ' ' LEU . 1.8 pp -108.67 -17.63 13.91 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.146 1.378 . . . . 0.0 112.761 171.551 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.501 ' HG3' HD21 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -73.18 -57.33 4.1 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 126.09 1.756 . . . . 0.0 111.48 -175.512 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.484 ' C ' HD22 ' A' ' 11' ' ' LEU . 8.3 pttp -76.0 15.68 0.51 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.733 1.213 . . . . 0.0 113.161 -174.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.484 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.1 mm? -126.32 -42.03 1.86 Allowed 'General case' 0 C--O 1.233 0.203 0 C-N-CA 129.753 3.221 . . . . 0.0 110.436 -170.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.4 pt -62.99 -35.88 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-N 118.658 0.663 . . . . 0.0 111.679 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.07 -19.04 41.05 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 178.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -94.95 -17.47 21.94 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 127.091 2.156 . . . . 0.0 111.919 -168.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -100.8 -51.16 9.87 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 C-N-CA 123.955 0.902 . . . . 0.0 108.746 167.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 93.7 t -63.87 -39.11 84.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 119.81 1.186 . . . . 0.0 111.181 -170.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -82.39 3.74 26.82 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 120.076 -0.65 . . . . 0.0 112.273 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.67 -11.39 9.42 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.312 1.845 . . . . 0.0 114.17 -177.225 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -91.15 -86.95 0.21 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.243 1.017 . . . . 0.0 111.621 -176.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -131.99 96.66 3.96 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 122.53 1.157 . . . . 0.0 112.243 178.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -57.81 -15.72 9.18 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.273 1.429 . . . . 0.0 113.939 171.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -102.06 -10.2 19.92 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.921 2.088 . . . . 0.0 113.747 173.563 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -140.6 76.09 25.14 Favored Pre-proline 0 N--CA 1.483 1.195 0 C-N-CA 125.773 1.629 . . . . 0.0 111.076 172.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.51 161.9 44.38 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.254 2.636 . . . . 0.0 112.445 -176.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -81.89 -178.01 6.82 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.642 1.177 . . . . 0.0 111.255 169.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.471 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 93.2 p -131.18 169.01 16.5 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.889 1.676 . . . . 0.0 109.866 173.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -54.33 -31.96 55.55 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 174.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -68.83 -53.82 19.29 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.001 -1.687 . . . . 0.0 110.988 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.471 ' HB2' ' H ' ' A' ' 26' ' ' SER . 43.6 mt-10 -61.81 -47.64 84.19 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 120.578 -1.326 . . . . 0.0 112.597 -174.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.5 pt -59.98 -38.38 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 119.657 1.117 . . . . 0.0 112.06 173.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.89 -34.52 76.18 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.433 1.015 . . . . 0.0 112.197 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -68.16 -54.39 18.33 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.65 1.18 . . . . 0.0 112.771 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.462 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.0 mt -63.37 -33.46 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 121.496 -0.753 . . . . 0.0 111.509 -176.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.88 -23.03 67.19 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.499 1.52 . . . . 0.0 112.332 176.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -80.95 -15.46 56.2 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -84.39 -13.59 51.77 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.505 0.722 . . . . 0.0 112.179 -178.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.462 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.2 ptpt -127.0 -23.51 3.61 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.342 1.608 . . . . 0.0 115.342 -171.003 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.63 1.7 0.07 OUTLIER Glycine 0 N--CA 1.471 0.975 0 N-CA-C 115.752 1.061 . . . . 0.0 115.752 152.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -87.42 -30.7 20.52 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.412 1.106 . . . . 0.0 112.676 -169.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ptmt 29.01 44.81 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 129.947 3.299 . . . . 0.0 113.921 -171.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.558 HG21 HD22 ' A' ' 8' ' ' LEU . 2.7 p -82.08 140.46 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.078 1.351 . . . . 0.0 109.002 176.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.418 ' H ' ' P ' ' C' ' 84' ' ' ' DT' . . . -81.98 165.23 20.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.355 2.262 . . . . 0.0 112.328 176.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -25.75 68.4 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.267 1.427 . . . . 0.0 113.904 -177.077 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -67.3 -36.35 81.33 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.165 0.986 . . . . 0.0 111.516 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.1 m -84.89 -48.91 8.85 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 127.481 2.312 . . . . 0.0 109.4 -175.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.91 -30.05 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.27 -174.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.11 -48.88 72.09 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.105 1.362 . . . . 0.0 110.727 176.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -69.22 -16.26 63.56 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.522 0.729 . . . . 0.0 112.938 -178.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -81.54 -47.53 12.97 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.985 0.914 . . . . 0.0 112.158 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.9 ptp180 -56.27 -23.08 34.11 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 119.066 0.848 . . . . 0.0 113.081 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -66.85 -47.46 71.87 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.723 1.209 . . . . 0.0 112.654 174.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -84.65 -25.33 28.57 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -171.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.501 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.4 mt -71.0 -59.57 2.71 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.325 1.05 . . . . 0.0 111.868 175.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 167.42 8.6 0.03 OUTLIER Glycine 0 CA--C 1.534 1.262 0 N-CA-C 118.192 2.037 . . . . 0.0 118.192 171.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.8 mt -96.38 130.34 31.07 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 119.938 1.869 . . . . 0.0 110.928 -175.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -69.98 -58.7 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.669 2.912 . . . . 0.0 111.233 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.2 p -155.5 -4.13 0.13 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.722 1.609 . . . . 0.0 114.715 168.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 83.4 p 59.23 -10.6 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.785 2.834 . . . . 0.0 116.217 -168.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -82.17 -30.92 30.73 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 120.521 1.51 . . . . 0.0 111.057 172.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -23.73 59.07 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 174.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -72.95 -37.33 67.16 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.941 1.296 . . . . 0.0 112.417 170.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -72.85 -59.67 2.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.137 1.775 . . . . 0.0 112.88 179.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.7 tp . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.668 1.587 . . . . 0.0 114.415 -167.315 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.121 0 O4'-C1'-N19 110.483 3.353 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.564 0 O4'-C4'-C3' 108.565 2.965 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.619 1 O4'-C1'-N19 112.381 5.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.931 0 O4'-C4'-C3' 107.856 2.256 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.344 0 O4'-C1'-N19 109.87 2.588 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.49 0 P-O3'-C3' 123.591 3.242 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.357 0 O4'-C1'-N19 110.046 2.808 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.429 0 P-O3'-C3' 123.078 2.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.521 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.574 1 O4'-C1'-N19 111.174 4.217 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.505 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.57 1 C4'-C3'-C2' 98.965 -4.235 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.249 0 O4'-C4'-C3' 109.449 3.849 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.453 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.295 0 O4'-C4'-C3' 108.419 2.819 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.453 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.24 0 P-O3'-C3' 123.815 3.429 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.261 0 C4'-C3'-C2' 100.096 -3.104 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.782 0 N19-C1'-C2' 109.012 -3.242 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.295 0 C3'-C2'-C1' 107.244 3.246 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.502 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.699 0 P-O3'-C3' 124.087 3.656 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.502 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.544 0 O4'-C4'-C3' 108.287 2.687 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.505 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.543 3.962 1 O4'-C1'-N19 111.471 4.589 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.521 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.144 1 O4'-C1'-N19 116.125 10.407 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . 0.418 ' P ' ' H ' ' A' ' 42' ' ' ALA . . . . . . . . 0 C5'--C4' 1.533 2.72 0 N19-C1'-C2' 118.366 2.604 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.7 0 O4'-C4'-C3' 108.066 2.466 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.776 0 O4'-C4'-C3' 109.098 3.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.257 0 C4'-C3'-C2' 100.207 -2.993 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.408 0 O4'-C4'-C3' 108.436 2.836 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.917 0 P-O3'-C3' 124.44 3.95 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.752 0 P-O3'-C3' 122.945 2.704 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.768 0 P-O3'-C3' 123.389 3.074 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 53.1 m80 . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 121.019 0.438 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 56.5 tpp -139.8 -56.22 0.56 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.107 1.763 . . . . 0.0 110.887 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.763 HD12 HD23 ' A' ' 8' ' ' LEU . 30.6 mt -88.48 179.57 6.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.873 1.669 . . . . 0.0 112.468 175.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.5 p -71.53 -169.86 0.47 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.796 1.238 . . . . 0.0 112.502 175.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -48.7 -24.68 1.46 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.718 1.607 . . . . 0.0 114.655 173.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.2 45.83 0.11 Allowed Glycine 0 C--N 1.341 0.82 0 CA-C-O 117.954 -1.47 . . . . 0.0 115.205 170.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.59 -17.4 32.69 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.623 2.212 . . . . 0.0 113.425 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.763 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -107.85 -20.06 13.32 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.526 1.13 . . . . 0.0 112.635 171.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.402 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.5 ttt -68.79 -62.66 1.29 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 126.134 1.774 . . . . 0.0 110.718 -178.269 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.516 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.2 pttp -76.67 16.36 0.52 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.098 1.359 . . . . 0.0 113.675 -171.098 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.516 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -127.46 -39.67 1.84 Allowed 'General case' 0 C--O 1.233 0.214 0 C-N-CA 129.375 3.07 . . . . 0.0 110.745 -171.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pt -63.07 -36.8 77.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.947 0.794 . . . . 0.0 111.447 -176.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 -16.03 44.89 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -179.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -97.57 -17.06 19.77 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 127.828 2.451 . . . . 0.0 111.773 -167.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.0 pp -101.42 -46.51 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 C-N-CA 124.981 1.312 . . . . 0.0 109.762 167.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.6 t -62.81 -42.78 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-N 119.463 1.028 . . . . 0.0 110.471 -174.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -81.41 0.19 38.64 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.659 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -96.22 -21.49 17.84 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.22 1.408 . . . . 0.0 112.622 175.447 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -91.8 -84.64 0.26 Allowed 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.504 1.122 . . . . 0.0 112.005 -172.606 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -140.1 92.42 2.54 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.573 1.149 . . . . 0.0 110.465 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -53.13 -27.76 22.44 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 160.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -22.59 63.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.611 2.765 . . . . 0.0 114.208 173.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -148.11 73.36 11.11 Favored Pre-proline 0 N--CA 1.478 0.937 0 C-N-CA 127.398 2.279 . . . . 0.0 109.878 -174.232 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -69.26 155.96 66.06 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.848 2.365 . . . . 0.0 112.402 -168.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -78.96 172.25 14.06 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.639 0.733 . . . . 0.0 110.423 165.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.461 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 57.5 p -129.09 169.01 15.26 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.491 1.516 . . . . 0.0 110.008 179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.0 p30 -53.29 -34.15 56.14 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 178.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -67.64 -53.84 24.61 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 119.716 -1.865 . . . . 0.0 110.8 168.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.461 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.6 mm-40 -61.33 -49.66 76.08 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 120.807 -1.183 . . . . 0.0 112.558 -173.35 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.3 pt -59.22 -38.61 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-N 119.593 1.088 . . . . 0.0 112.28 173.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.92 -34.42 76.04 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.527 1.058 . . . . 0.0 112.01 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -68.36 -55.28 12.55 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.415 1.086 . . . . 0.0 112.826 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.471 HG22 ' HE2' ' A' ' 37' ' ' LYS . 1.5 mp -63.8 -33.03 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-N 118.826 0.739 . . . . 0.0 111.201 -176.425 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mp -61.01 -26.37 67.56 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.048 1.339 . . . . 0.0 112.629 176.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -78.89 -13.66 59.67 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.648 0.779 . . . . 0.0 112.76 176.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -90.01 -9.6 48.04 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.553 0.741 . . . . 0.0 112.341 -177.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.471 ' HE2' HG22 ' A' ' 33' ' ' ILE . 23.5 pttt -127.86 -22.62 3.5 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -175.584 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 153.56 5.14 0.11 Allowed Glycine 0 N--CA 1.47 0.902 0 CA-C-N 119.65 1.114 . . . . 0.0 115.499 151.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -85.09 -20.73 29.91 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.023 0.912 . . . . 0.0 112.905 -171.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 36.52 28.38 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 130.603 3.561 . . . . 0.0 115.342 -177.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.539 HG21 HD22 ' A' ' 8' ' ' LEU . 4.1 p -84.79 139.84 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-O 121.441 0.638 . . . . 0.0 109.978 -171.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.73 164.31 19.68 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.641 2.376 . . . . 0.0 112.363 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -57.1 -36.62 70.84 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.6 1.16 . . . . 0.0 113.839 -176.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -37.99 86.09 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.56 0.695 . . . . 0.0 110.54 -172.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.423 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 3.2 m -79.04 -48.82 13.7 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 127.972 2.509 . . . . 0.0 109.957 -175.466 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.06 -29.69 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.823 -175.181 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.52 -38.53 80.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.828 1.651 . . . . 0.0 111.757 178.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -64.78 -32.35 74.0 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.601 0.76 . . . . 0.0 111.396 175.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -79.52 -48.79 13.27 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 118.555 -0.736 . . . . 0.0 112.195 -171.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -53.54 -32.31 50.05 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.253 0.933 . . . . 0.0 112.286 172.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -72.37 -36.46 68.74 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.564 0.746 . . . . 0.0 112.372 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.0 ptt? -85.79 -31.69 22.21 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -175.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.402 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.5 mp -67.1 -61.2 2.04 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.079 0.952 . . . . 0.0 111.312 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 174.29 -2.63 0.03 OUTLIER Glycine 0 CA--C 1.536 1.371 0 N-CA-C 117.763 1.865 . . . . 0.0 117.763 174.119 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.7 mt -77.23 131.98 71.15 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 119.476 1.638 . . . . 0.0 110.251 177.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.11 -65.28 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.181 2.587 . . . . 0.0 109.873 170.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.6 p -151.03 -2.48 0.34 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.01 1.724 . . . . 0.0 114.225 163.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.5 m 57.73 -8.59 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.79 2.836 . . . . 0.0 116.026 -167.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -73.28 -40.53 64.49 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.491 1.516 . . . . 0.0 108.854 174.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -78.94 -21.53 47.11 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -71.79 -41.93 67.71 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.867 0.867 . . . . 0.0 111.981 169.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -75.27 -59.97 2.51 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.063 1.345 . . . . 0.0 112.86 -176.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.254 1.33 0 C-N-CA 125.541 1.536 . . . . 0.0 114.553 -168.087 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.752 0 C4'-C3'-C2' 100.216 -2.984 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.348 0 O4'-C1'-N19 110.118 2.898 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.573 1 O4'-C1'-N19 112.367 5.709 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.71 1 O4'-C1'-N19 111.719 4.899 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.696 0 P-O3'-C3' 123.302 3.001 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.538 0 P-O3'-C3' 122.984 2.736 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.007 0 O4'-C1'-N19 110.52 3.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.979 0 P-O3'-C3' 123.032 2.777 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.492 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.54 1 O4'-C1'-N19 111.229 4.287 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.428 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.365 1 C4'-C3'-C2' 99.004 -4.196 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.679 1 O4'-C1'-N19 112.073 5.342 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.456 " H2'" ' H72' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.574 0 O4'-C1'-N19 110.249 3.062 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.456 ' H72' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.187 0 P-O3'-C3' 124.003 3.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.337 0 C4'-C3'-C2' 100.202 -2.998 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.811 0 N19-C1'-C2' 109.035 -3.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.367 0 C3'-C2'-C1' 107.019 3.085 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.485 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.541 1 C4'-C3'-C2' 98.96 -4.24 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.485 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.313 0 N19-C1'-C2' 109.079 -3.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.428 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.543 4.032 1 O4'-C1'-N19 112.388 5.735 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.492 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.573 3 O4'-C1'-N19 117.33 11.913 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.059 0 O4'-C1'-N19 110.987 3.984 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.356 0 C3'-C2'-C1' 105.565 2.046 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.25 0 O4'-C4'-C3' 108.335 2.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.324 0 O4'-C1'-N19 110.165 2.956 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.597 0 O4'-C4'-C3' 108.666 3.066 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.573 0 P-O3'-C3' 123.176 2.897 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 0 O4'-C4'-C3' 108.598 2.998 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.745 0 P-O3'-C3' 122.558 2.382 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.621 0.248 . . . . 0.0 110.73 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 15.7 tpt -69.02 -42.17 76.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.118 0.967 . . . . 0.0 113.467 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.831 HD12 HD23 ' A' ' 8' ' ' LEU . 26.3 mt -83.37 176.73 8.89 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.176 1.39 . . . . 0.0 113.257 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 48.2 p -70.28 -173.6 0.72 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.089 0.956 . . . . 0.0 112.148 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -43.06 -25.73 0.12 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.123 2.169 . . . . 0.0 115.897 170.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -172.58 40.44 0.16 Allowed Glycine 0 C--N 1.341 0.818 0 CA-C-O 117.747 -1.585 . . . . 0.0 115.657 170.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -64.5 -10.28 24.49 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 121.06 2.43 . . . . 0.0 114.127 -177.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.831 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -112.64 -15.33 13.03 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.751 1.22 . . . . 0.0 113.687 166.177 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.706 ' HG3' HD21 ' A' ' 53' ' ' LEU . 3.0 ttp -71.73 -61.72 1.68 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.96 1.304 . . . . 0.0 110.489 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.46 ' C ' HD22 ' A' ' 11' ' ' LEU . 8.7 pttp -73.62 16.37 0.21 Allowed 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -173.427 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.46 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -124.23 -46.11 1.94 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 129.632 3.173 . . . . 0.0 110.931 -171.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pp -63.98 -34.51 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.635 0.652 . . . . 0.0 112.166 -176.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.553 ' HG2' HD22 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -80.78 -17.12 51.93 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 175.715 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -94.68 -16.23 23.28 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.609 1.964 . . . . 0.0 111.81 -168.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.0 -46.25 9.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 C-N-CA 124.601 1.16 . . . . 0.0 109.381 169.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.1 -32.33 55.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 119.848 1.204 . . . . 0.0 111.367 -174.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -80.28 -0.95 38.76 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.495 -0.753 . . . . 0.0 112.583 175.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -110.05 -14.49 14.22 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.124 1.769 . . . . 0.0 113.07 -176.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -101.43 -96.58 0.27 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.052 0.842 . . . . 0.0 112.386 -169.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -136.74 88.33 2.36 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.886 1.274 . . . . 0.0 109.971 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -58.93 -20.46 52.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.543 0.737 . . . . 0.0 112.691 165.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -23.08 61.91 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 128.889 2.875 . . . . 0.0 114.208 169.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -148.45 69.7 10.49 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 127.649 2.379 . . . . 0.0 109.722 -174.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -72.35 165.54 32.36 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.934 2.423 . . . . 0.0 113.645 -163.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -76.02 -170.97 1.52 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.735 1.214 . . . . 0.0 111.045 165.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.459 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 60.3 p -141.47 169.02 18.4 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.726 2.01 . . . . 0.0 109.39 174.533 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -55.2 -32.32 62.13 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -66.5 -53.85 30.43 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 119.846 -1.784 . . . . 0.0 110.919 168.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.459 ' HB2' ' H ' ' A' ' 26' ' ' SER . 41.1 mt-10 -62.62 -49.02 76.85 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 120.661 -1.274 . . . . 0.0 112.758 -173.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.4 pt -59.34 -37.49 69.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-N 119.888 1.222 . . . . 0.0 112.212 173.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.35 -35.16 79.48 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.585 1.084 . . . . 0.0 112.456 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -68.41 -51.09 47.84 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.806 1.242 . . . . 0.0 113.015 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.403 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -63.6 -35.48 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 121.829 -0.544 . . . . 0.0 110.938 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.3 mp -62.58 -23.22 66.9 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.534 1.534 . . . . 0.0 112.643 176.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 pttm -78.02 -15.11 59.22 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -83.39 -19.96 35.06 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.458 0.703 . . . . 0.0 111.801 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.403 ' HE3' HG22 ' A' ' 33' ' ' ILE . 26.6 mmtt -89.3 -57.48 2.87 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.339 1.856 . . . . 0.0 108.735 -177.294 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 155.93 7.92 0.07 OUTLIER Glycine 0 CA--C 1.529 0.937 0 CA-C-N 114.185 -1.37 . . . . 0.0 114.152 173.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.406 ' HB3' HD11 ' A' ' 3' ' ' LEU . 48.6 m-85 -79.37 -24.42 42.67 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.492 1.146 . . . . 0.0 112.3 -175.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt 32.69 35.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 130.692 3.597 . . . . 0.0 114.586 -176.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.601 HG21 HD22 ' A' ' 8' ' ' LEU . 2.5 p -82.48 139.83 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -175.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.36 160.71 26.61 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.345 2.258 . . . . 0.0 112.22 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -34.9 64.48 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.726 1.211 . . . . 0.0 113.915 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.08 -31.49 72.39 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 118.735 0.698 . . . . 0.0 111.661 -173.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.8 m -83.86 -49.64 8.84 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 128.584 2.753 . . . . 0.0 109.745 -176.056 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.79 -26.9 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.193 -176.104 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.46 -36.16 76.32 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 126.718 2.007 . . . . 0.0 111.829 177.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -64.74 -39.04 92.96 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.982 -0.449 . . . . 0.0 111.626 172.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -73.47 -35.94 65.76 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -164.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.98 -30.84 6.51 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 170.454 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -71.11 -36.42 72.14 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.1 ptp -86.51 -20.62 27.78 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -175.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.706 HD21 ' HG3' ' A' ' 9' ' ' MET . 4.2 mt -86.45 -63.4 1.32 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.295 1.438 . . . . 0.0 111.623 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.92 -5.55 0.04 OUTLIER Glycine 0 CA--C 1.535 1.294 0 N-CA-C 117.851 1.901 . . . . 0.0 117.851 167.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.0 mt -76.73 122.7 86.99 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 119.329 1.564 . . . . 0.0 110.871 -176.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.23 -59.41 0.08 OUTLIER 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.556 2.838 . . . . 0.0 110.729 -178.074 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 83.2 p -146.24 -6.8 0.55 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.798 1.639 . . . . 0.0 113.884 159.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 85.1 p 60.45 -20.43 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 129.561 3.144 . . . . 0.0 116.17 -163.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -71.1 -43.6 67.36 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.801 1.64 . . . . 0.0 109.649 172.117 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -23.56 60.81 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.652 0.781 . . . . 0.0 112.768 -172.326 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -70.23 -46.29 64.76 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.989 1.716 . . . . 0.0 111.993 167.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -72.0 -58.98 2.99 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.188 1.795 . . . . 0.0 113.194 -174.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.833 2.053 . . . . 0.0 114.437 -167.602 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.8 0 O5'-C5'-C4' 114.422 3.016 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.522 0 O4'-C1'-N19 110.518 3.398 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.747 1 O4'-C1'-N19 112.44 5.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.138 1 O4'-C1'-N19 111.292 4.365 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.724 0 O4'-C1'-N19 110.392 3.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.891 0 O5'-C5'-C4' 114.253 2.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.073 0 O4'-C1'-N19 110.572 3.465 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.091 0 P-O3'-C3' 122.682 2.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.491 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.679 1 O4'-C1'-N19 111.626 4.783 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.447 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.784 0 C4'-C3'-C2' 99.681 -3.519 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.662 0 O4'-C1'-N19 110.95 3.937 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.433 0 O4'-C4'-C3' 109.106 3.506 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.378 0 P-O3'-C3' 123.95 3.542 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.655 0 C4'-C3'-C2' 100.061 -3.139 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.661 0 O4'-C4'-C3' 108.617 3.017 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.398 0 O4'-C4'-C3' 108.481 2.881 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.512 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.285 2 C4'-C3'-C2' 99.031 -4.169 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.512 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.269 0 O4'-C4'-C3' 109.161 3.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.447 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.483 2 O4'-C1'-N19 114.313 8.142 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.491 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.544 4.148 3 O4'-C1'-N19 117.24 11.8 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.111 1 O4'-C1'-N19 111.507 4.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.309 0 C3'-C2'-C1' 105.338 1.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.38 0 O4'-C4'-C3' 108.0 2.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.262 0 C4'-C3'-C2' 100.209 -2.991 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.31 0 O4'-C1'-N19 110.02 2.775 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.119 0 P-O3'-C3' 123.663 3.303 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.215 0 O4'-C4'-C3' 108.642 3.042 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.018 0 P-O3'-C3' 122.657 2.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 120.47 0.176 . . . . 0.0 110.821 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 51.6 mtt -137.87 -49.96 0.58 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.735 1.214 . . . . 0.0 112.518 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.732 HD12 HD23 ' A' ' 8' ' ' LEU . 36.1 mt -106.12 176.64 5.1 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.669 1.588 . . . . 0.0 113.72 -172.027 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 54.2 p -74.25 -168.03 0.6 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.821 1.648 . . . . 0.0 112.485 179.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -49.05 -25.7 2.19 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.204 1.402 . . . . 0.0 114.378 173.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.47 45.8 0.12 Allowed Glycine 0 C--N 1.34 0.776 0 CA-C-O 118.09 -1.394 . . . . 0.0 115.021 172.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -62.84 -15.77 55.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 120.504 2.152 . . . . 0.0 113.373 -178.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.732 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -108.16 -18.07 13.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.111 0.964 . . . . 0.0 112.832 169.103 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.516 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.2 ttp -70.07 -61.78 1.64 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.411 1.484 . . . . 0.0 110.749 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.458 ' C ' HD22 ' A' ' 11' ' ' LEU . 16.6 pttt -76.71 15.89 0.58 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.996 0.918 . . . . 0.0 113.385 -171.102 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.458 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -124.96 -43.4 1.98 Allowed 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 129.305 3.042 . . . . 0.0 110.631 -171.128 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.8 pt -58.48 -37.79 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-N 118.67 0.668 . . . . 0.0 111.553 -177.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.37 -18.53 41.7 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -105.92 -12.22 15.91 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.344 1.857 . . . . 0.0 112.738 -167.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -94.54 -48.2 13.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 124.472 1.109 . . . . 0.0 108.777 162.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 82.7 t -64.33 -37.51 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 O-C-N 120.7 -1.25 . . . . 0.0 111.167 -173.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -83.85 5.35 25.5 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 178.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -109.29 -22.9 11.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.501 1.52 . . . . 0.0 112.756 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -89.23 -85.59 0.2 Allowed 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.798 1.239 . . . . 0.0 111.665 -173.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -142.97 82.67 1.77 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.764 1.226 . . . . 0.0 110.81 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -60.22 -19.29 53.73 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 166.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -72.06 -28.3 63.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.981 2.512 . . . . 0.0 114.755 169.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.88 79.02 12.33 Favored Pre-proline 0 N--CA 1.482 1.174 0 C-N-CA 127.509 2.324 . . . . 0.0 109.6 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.37 168.29 25.15 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.881 3.054 . . . . 0.0 113.769 -167.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -81.1 -171.0 3.0 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.077 1.751 . . . . 0.0 111.704 168.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.478 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 70.0 p -139.4 173.38 11.6 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 127.61 2.364 . . . . 0.0 108.959 172.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -66.86 -27.18 67.32 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 120.182 1.355 . . . . 0.0 112.085 -175.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -65.67 -52.73 49.29 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 119.888 -1.757 . . . . 0.0 110.968 166.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.478 ' HB2' ' H ' ' A' ' 26' ' ' SER . 42.5 mt-10 -62.26 -48.46 79.83 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 120.623 -1.298 . . . . 0.0 112.372 -173.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.3 pt -59.92 -38.11 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.575 1.079 . . . . 0.0 112.104 173.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.02 -35.61 79.08 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.283 0.947 . . . . 0.0 111.881 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -68.3 -52.36 34.47 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.322 1.049 . . . . 0.0 112.816 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.464 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -64.84 -32.27 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 O-C-N 121.211 -0.93 . . . . 0.0 111.627 -178.042 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.45 -22.87 66.55 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.149 1.38 . . . . 0.0 112.369 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.1 pttt -79.86 -16.11 56.06 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 175.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -87.73 -12.26 45.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.887 0.875 . . . . 0.0 112.138 -176.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.464 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.7 ptpt -125.92 -21.73 4.3 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -174.067 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.6 1.07 0.08 OUTLIER Glycine 0 N--CA 1.471 0.976 0 N-CA-C 115.672 1.029 . . . . 0.0 115.672 151.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -86.75 -25.92 24.45 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.41 1.105 . . . . 0.0 113.036 -168.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.6 ptmt 30.56 40.45 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 130.371 3.468 . . . . 0.0 114.474 -173.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.566 HG21 HD22 ' A' ' 8' ' ' LEU . 4.0 p -84.3 156.71 3.62 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 124.489 1.116 . . . . 0.0 109.099 175.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -109.04 169.81 8.45 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.662 2.785 . . . . 0.0 112.646 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -59.17 -32.87 70.3 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.028 1.331 . . . . 0.0 114.079 -172.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -37.53 87.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.022 0.529 . . . . 0.0 110.2 -174.251 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.0 m -84.31 -44.09 14.15 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 126.584 1.954 . . . . 0.0 109.941 -174.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.91 -31.18 52.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.328 -178.546 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.13 -36.24 72.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.815 1.646 . . . . 0.0 112.789 174.174 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -65.77 -27.77 68.54 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.422 0.689 . . . . 0.0 112.097 172.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -84.2 -53.69 5.33 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 124.058 0.943 . . . . 0.0 111.778 -175.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.21 -26.82 19.0 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 118.837 0.744 . . . . 0.0 112.851 174.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.3 -39.78 89.56 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.943 0.897 . . . . 0.0 113.082 175.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -92.41 -22.15 19.81 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -174.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.516 HD21 ' HG3' ' A' ' 9' ' ' MET . 0.8 OUTLIER -71.86 -65.16 0.8 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.49 1.116 . . . . 0.0 111.761 172.223 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 173.53 15.98 0.02 OUTLIER Glycine 0 CA--C 1.535 1.327 0 N-CA-C 118.024 1.97 . . . . 0.0 118.024 175.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.4 mp -120.72 135.3 24.58 Favored Pre-proline 0 CA--C 1.552 1.028 0 CA-C-N 119.408 1.604 . . . . 0.0 113.077 -166.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.29 -47.99 0.14 Allowed 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 124.333 3.355 . . . . 0.0 113.701 177.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 88.2 p -163.46 -7.75 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.903 2.081 . . . . 0.0 114.126 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.9 m 63.99 -6.59 0.25 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.515 2.726 . . . . 0.0 115.569 -162.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -81.74 -39.21 24.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.82 1.248 . . . . 0.0 110.088 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -91.19 -6.09 53.98 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.374 1.469 . . . . 0.0 114.624 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.5 mtp85 -69.29 -33.09 72.65 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 121.298 -0.876 . . . . 0.0 112.15 161.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -83.45 -63.37 1.37 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.865 2.066 . . . . 0.0 112.384 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.9 mm . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.2 1.8 . . . . 0.0 112.261 -178.061 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.76 0 C4'-C3'-C2' 100.187 -3.013 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.3 0 O4'-C1'-N19 110.221 3.026 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.548 1 O4'-C1'-N19 111.244 4.305 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.33 0 O4'-C1'-N19 110.453 3.316 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . 0.411 ' H1 ' ' N4 ' ' C' ' 87' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.544 4.136 0 O5'-C5'-C4' 114.878 3.342 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.189 0 P-O3'-C3' 123.262 2.968 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.293 0 P-O3'-C3' 123.063 2.803 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.038 0 P-O3'-C3' 123.265 2.971 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.503 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.71 1 O4'-C1'-N19 111.413 4.516 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.468 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.675 1 C4'-C3'-C2' 99.07 -4.13 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.715 1 O4'-C1'-N19 111.358 4.447 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.414 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.684 0 O4'-C4'-C3' 108.647 3.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.414 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.3 0 P-O3'-C3' 123.748 3.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.357 0 C4'-C3'-C2' 99.972 -3.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.733 0 N19-C1'-C2' 109.422 -2.986 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.254 0 C3'-C2'-C1' 106.855 2.968 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.502 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.411 0 C4'-C3'-C2' 99.343 -3.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.502 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.354 0 O4'-C4'-C3' 108.553 2.953 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.468 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.925 1 O4'-C1'-N19 112.678 6.098 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.503 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.545 4.244 2 O4'-C1'-N19 117.902 12.628 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 0 O4'-C1'-N19 110.383 3.229 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.452 0 C3'-C2'-C1' 105.905 2.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.656 0 O4'-C4'-C3' 108.877 3.277 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . 0.411 ' N4 ' ' H1 ' ' B' ' 68' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.325 0 C4'-C3'-C2' 100.306 -2.894 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.744 0 P-O3'-C3' 122.635 2.446 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.351 0 P-O3'-C3' 123.228 2.94 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.021 0 O4'-C4'-C3' 108.038 2.438 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.764 0 P-O3'-C3' 122.696 2.497 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 . . . . . 0 N--CA 1.484 1.272 0 N-CA-C 111.428 0.158 . . . . 0.0 111.428 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.0 mmt 43.67 41.42 3.55 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 127.968 2.507 . . . . 0.0 114.823 168.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.784 HD12 HD23 ' A' ' 8' ' ' LEU . 41.1 mt -63.38 176.54 0.79 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 127.177 2.191 . . . . 0.0 115.116 -179.227 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.3 p -69.91 -169.5 0.26 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.015 1.326 . . . . 0.0 112.581 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -48.44 -24.45 1.27 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.592 1.557 . . . . 0.0 114.627 172.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.67 42.09 0.13 Allowed Glycine 0 CA--C 1.527 0.823 0 CA-C-O 117.518 -1.712 . . . . 0.0 116.081 172.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.37 -12.82 23.57 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 121.431 2.615 . . . . 0.0 113.697 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.784 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -112.02 -16.46 13.07 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.915 1.286 . . . . 0.0 113.242 168.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.44 ' HG3' HD11 ' A' ' 53' ' ' LEU . 5.8 ttt -69.15 -65.92 0.64 Allowed 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.211 1.405 . . . . 0.0 110.17 178.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.518 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.1 pttp -74.05 17.33 0.18 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.599 1.56 . . . . 0.0 113.7 -173.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.518 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -128.41 -37.54 1.81 Allowed 'General case' 0 C--O 1.233 0.219 0 C-N-CA 129.205 3.002 . . . . 0.0 111.733 -172.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.1 pt -62.95 -33.19 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.648 1.113 . . . . 0.0 111.514 -178.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.03 -11.24 39.4 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -96.94 -13.35 22.46 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.385 1.874 . . . . 0.0 111.879 -174.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.27 -46.97 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 124.91 1.284 . . . . 0.0 109.473 167.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.23 -36.58 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 119.828 1.194 . . . . 0.0 111.028 -174.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -78.43 -1.63 34.51 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -106.71 -16.67 14.43 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.63 1.572 . . . . 0.0 113.03 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -96.41 -88.93 0.27 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.874 0.87 . . . . 0.0 112.331 -172.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -138.76 90.68 2.47 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.719 1.208 . . . . 0.0 110.367 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -57.36 -20.5 29.57 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.71 0.804 . . . . 0.0 113.04 164.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -75.37 -21.66 58.14 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.832 2.453 . . . . 0.0 113.822 171.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -147.81 75.79 10.86 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 127.286 2.235 . . . . 0.0 110.2 -174.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -70.05 162.19 43.16 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.143 2.562 . . . . 0.0 113.1 -170.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -78.34 -166.43 0.84 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.33 1.452 . . . . 0.0 110.943 169.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.489 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 67.9 m -149.85 172.43 15.17 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.205 1.802 . . . . 0.0 109.61 173.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.4 ' CG ' ' HE ' ' A' ' 43' ' ' ARG . 23.7 p30 -62.55 -31.47 72.27 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -171.196 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -65.03 -50.89 64.46 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.078 -1.639 . . . . 0.0 110.67 165.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.489 ' HB2' ' H ' ' A' ' 26' ' ' SER . 46.1 mt-10 -61.95 -50.97 70.0 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 120.677 -1.264 . . . . 0.0 112.531 -173.064 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.7 pt -59.23 -37.27 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 119.363 0.983 . . . . 0.0 112.366 174.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.72 -35.6 80.29 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.403 1.001 . . . . 0.0 111.973 176.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -67.49 -53.25 30.37 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.202 1.001 . . . . 0.0 112.745 -178.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.478 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.6 mt -63.81 -32.36 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 O-C-N 121.42 -0.8 . . . . 0.0 111.449 -177.129 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.86 -21.65 66.55 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.031 1.332 . . . . 0.0 112.522 175.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.5 ptmt -80.84 -15.37 56.56 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 175.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -88.33 -12.31 43.81 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.821 0.849 . . . . 0.0 112.267 -177.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.478 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.9 ptpt -126.75 -22.51 3.87 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -173.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.33 1.83 0.07 OUTLIER Glycine 0 N--CA 1.469 0.899 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 152.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.444 ' HB3' HD11 ' A' ' 3' ' ' LEU . 47.7 m-85 -88.91 -34.65 16.86 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.395 1.097 . . . . 0.0 112.017 -168.768 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.8 ptmt 27.12 53.61 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 129.15 2.98 . . . . 0.0 112.486 -170.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.671 HG21 HD22 ' A' ' 8' ' ' LEU . 4.2 p -88.16 142.76 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 126.372 1.869 . . . . 0.0 108.858 168.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.43 ' H ' ' P ' ' C' ' 84' ' ' ' DT' . . . -87.32 169.87 11.91 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 129.384 3.073 . . . . 0.0 113.291 175.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.4 ' HE ' ' CG ' ' A' ' 27' ' ' ASP . 0.7 OUTLIER -64.14 -28.85 70.04 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 125.681 1.592 . . . . 0.0 114.39 -171.96 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -35.14 69.7 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.795 1.18 . . . . 0.0 111.132 -175.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.2 m -77.43 -48.65 16.65 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 125.816 1.646 . . . . 0.0 108.589 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.29 -30.9 51.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.82 -175.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.67 -43.65 72.09 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 126.311 1.844 . . . . 0.0 111.594 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -66.99 -25.64 66.41 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 173.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -79.4 -46.47 17.51 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.666 0.787 . . . . 0.0 112.673 -178.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 30.8 ptt85 -51.94 -31.68 29.91 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.765 1.166 . . . . 0.0 111.821 170.309 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -77.89 -23.51 48.72 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 178.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.9 ptm -93.05 -26.99 17.25 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.573 1.079 . . . . 0.0 112.823 177.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.44 HD11 ' HG3' ' A' ' 9' ' ' MET . 2.2 mp -73.73 -74.63 0.17 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.994 1.318 . . . . 0.0 111.322 172.054 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 176.12 14.53 0.02 OUTLIER Glycine 0 CA--C 1.537 1.44 0 N-CA-C 118.253 2.061 . . . . 0.0 118.253 178.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.9 mt -112.27 126.39 28.48 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 119.556 1.678 . . . . 0.0 111.773 -173.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.29 -70.36 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 124.143 3.229 . . . . 0.0 110.348 173.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 95.2 p -141.38 -7.05 1.02 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.41 2.284 . . . . 0.0 113.351 174.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.2 m 56.86 -1.58 0.05 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 128.488 2.715 . . . . 0.0 116.088 -161.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -82.45 -39.63 22.28 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 120.309 1.413 . . . . 0.0 110.369 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -73.44 -20.62 60.67 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.2 mtp180 -75.3 -42.54 54.47 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.678 1.191 . . . . 0.0 112.43 167.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -66.15 -58.67 4.92 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.231 1.812 . . . . 0.0 112.835 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 C--O 1.254 1.308 0 C-N-CA 125.498 1.519 . . . . 0.0 114.441 -169.432 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.719 0 C4'-C3'-C2' 100.162 -3.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.41 1 O4'-C1'-N19 111.439 4.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.801 1 O4'-C1'-N19 111.654 4.818 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C1'-N19 110.275 3.094 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.385 0 O4'-C4'-C3' 108.125 2.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.452 0 P-O3'-C3' 123.345 3.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.144 0 O4'-C1'-N19 110.787 3.734 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.082 0 P-O3'-C3' 123.498 3.165 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 72' ' ' ' DC' . . . . . 0.484 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.716 1 O4'-C1'-N19 111.141 4.176 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 73' ' ' ' DG' . . . . . 0.463 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.282 1 C4'-C3'-C2' 99.002 -4.198 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.329 1 O4'-C1'-N19 111.261 4.326 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 75' ' ' ' DT' . . . . . 0.404 " H2'" ' H72' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.483 0 O4'-C4'-C3' 108.96 3.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 76' ' ' ' DT' . . . . . 0.404 ' H72' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.158 0 P-O3'-C3' 123.64 3.283 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 0 C4'-C3'-C2' 100.292 -2.908 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.718 0 N19-C1'-C2' 109.171 -3.143 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.188 0 C3'-C2'-C1' 106.753 2.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 80' ' ' ' DA' . . . . . 0.529 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.294 0 O4'-C4'-C3' 109.299 3.699 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 81' ' ' ' DA' . . . . . 0.529 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.154 0 O4'-C4'-C3' 108.64 3.04 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 82' ' ' ' DC' . . . . . 0.463 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.59 1 O4'-C1'-N19 111.653 4.816 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 83' ' ' ' DG' . . . . . 0.484 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.535 3.05 2 O4'-C1'-N19 118.094 12.868 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 84' ' ' ' DT' . . . . . 0.43 ' P ' ' H ' ' A' ' 42' ' ' ALA . . . . . . . . 0 C5'--C4' 1.537 3.256 1 O4'-C1'-N19 111.849 5.061 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.396 0 C3'-C2'-C1' 105.942 2.316 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.523 0 O4'-C4'-C3' 108.374 2.774 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.432 0 P-O3'-C3' 123.145 2.871 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.756 0 O4'-C1'-N19 110.105 2.881 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.578 0 P-O3'-C3' 123.355 3.046 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.11 0 O4'-C4'-C3' 108.679 3.079 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.943 0 C4'-C3'-C2' 100.502 -2.698 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.777 HD12 HD23 ' A' ' 8' ' ' LEU . 32.4 mt . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.7 p -71.19 -168.95 0.34 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.381 1.472 . . . . 0.0 112.683 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -48.48 -25.22 1.56 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.581 1.552 . . . . 0.0 114.556 172.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.7 40.11 0.14 Allowed Glycine 0 CA--C 1.529 0.929 0 CA-C-O 117.688 -1.618 . . . . 0.0 116.063 174.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.98 -14.06 31.56 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 121.435 2.618 . . . . 0.0 113.364 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.777 HD23 HD12 ' A' ' 3' ' ' LEU . 1.8 pp -111.34 -16.87 13.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.87 1.268 . . . . 0.0 113.278 168.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 9.5 ttm -67.65 -67.05 0.49 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.351 1.46 . . . . 0.0 110.031 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.512 ' C ' HD22 ' A' ' 11' ' ' LEU . 7.0 pttp -74.45 18.76 0.15 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.59 1.556 . . . . 0.0 113.712 -172.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.512 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -128.8 -38.4 1.68 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 129.53 3.132 . . . . 0.0 111.158 -172.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -61.99 -35.57 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 CA-C-N 119.447 1.021 . . . . 0.0 111.441 -177.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.57 -13.11 28.11 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -177.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -91.59 -17.44 25.59 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 126.855 2.062 . . . . 0.0 111.579 -174.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.29 -46.32 9.73 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 C-N-CA 124.95 1.3 . . . . 0.0 109.727 169.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 87.9 t -64.66 -35.81 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 119.923 1.238 . . . . 0.0 111.091 -175.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -83.74 5.07 26.11 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -112.28 -16.28 13.0 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.471 1.909 . . . . 0.0 113.445 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -94.71 -86.83 0.28 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.152 0.981 . . . . 0.0 111.708 -173.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -139.69 85.11 2.02 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.26 1.424 . . . . 0.0 109.669 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -59.4 -17.99 35.15 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.491 1.116 . . . . 0.0 113.574 172.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -87.74 -7.95 56.67 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 126.607 1.963 . . . . 0.0 113.852 174.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -146.72 71.12 12.6 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 127.438 2.295 . . . . 0.0 110.456 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -69.37 160.49 49.6 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.874 2.383 . . . . 0.0 113.332 -168.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -76.6 -174.25 2.88 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.143 1.377 . . . . 0.0 111.004 167.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.481 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 87.9 p -134.0 169.62 16.85 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.078 1.751 . . . . 0.0 110.131 173.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -55.64 -31.34 62.25 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 176.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -68.24 -54.38 18.05 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 119.836 -1.79 . . . . 0.0 110.932 167.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.481 ' HB2' ' H ' ' A' ' 26' ' ' SER . 22.2 mm-40 -62.17 -47.48 84.32 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.793 -1.192 . . . . 0.0 112.702 -173.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 pt -59.63 -38.75 77.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.752 1.16 . . . . 0.0 112.061 172.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.2 -34.99 77.52 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.656 1.116 . . . . 0.0 112.055 176.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -68.2 -54.26 19.09 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.213 1.005 . . . . 0.0 112.819 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.453 HG22 ' HE2' ' A' ' 37' ' ' LYS . 1.8 mt -63.2 -32.89 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-N 119.063 0.847 . . . . 0.0 111.452 -177.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mp -63.3 -20.09 65.17 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.155 1.382 . . . . 0.0 112.855 176.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 ptmt -81.53 -14.89 56.35 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.706 0.803 . . . . 0.0 112.646 173.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -88.21 -11.73 45.87 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.247 0.619 . . . . 0.0 112.361 -176.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.453 ' HE2' HG22 ' A' ' 33' ' ' ILE . 27.2 pttt -129.06 -27.3 2.51 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -171.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.81 6.24 0.04 OUTLIER Glycine 0 N--CA 1.471 0.997 0 CA-C-N 120.592 1.542 . . . . 0.0 116.941 160.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -99.3 -39.86 8.21 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.527 1.163 . . . . 0.0 111.361 -168.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER 37.85 51.06 1.33 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 128.138 2.575 . . . . 0.0 111.776 179.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.664 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -91.66 139.88 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 111.592 -2.549 . . . . 0.0 109.194 171.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.09 165.61 18.37 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 128.857 2.863 . . . . 0.0 112.414 176.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.57 -26.6 68.67 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 125.589 1.555 . . . . 0.0 113.981 -177.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -34.38 76.62 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.835 0.854 . . . . 0.0 111.31 -177.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.0 m -84.91 -47.5 10.24 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 127.222 2.209 . . . . 0.0 109.948 -176.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.78 -28.33 42.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.949 -173.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.03 -47.39 80.43 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 125.672 1.589 . . . . 0.0 111.06 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -67.92 -18.27 64.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.106 1.362 . . . . 0.0 112.443 179.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -89.58 -50.35 6.13 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.48 1.512 . . . . 0.0 112.84 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -22.26 47.45 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.687 1.13 . . . . 0.0 112.144 172.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -69.49 -44.18 71.67 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.951 0.9 . . . . 0.0 112.871 170.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.9 ptp -83.31 -31.57 26.78 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -172.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 mp -65.64 -63.48 1.08 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.426 1.09 . . . . 0.0 111.205 175.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.96 8.07 0.03 OUTLIER Glycine 0 CA--C 1.536 1.372 0 N-CA-C 118.227 2.051 . . . . 0.0 118.227 171.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.5 mt -90.96 125.19 59.68 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 119.629 1.714 . . . . 0.0 111.217 -173.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.74 -53.25 0.28 Allowed 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.016 2.477 . . . . 0.0 110.78 175.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.2 p -158.89 -10.99 0.07 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 163.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 56.3 m 61.72 -18.4 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 128.293 2.637 . . . . 0.0 116.071 -164.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -67.11 -42.0 85.27 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 120.476 1.489 . . . . 0.0 109.012 168.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -25.09 54.02 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.993 0.917 . . . . 0.0 113.263 -178.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.9 mtm180 -72.2 -42.82 65.37 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.412 1.485 . . . . 0.0 112.302 169.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -69.49 -58.77 3.56 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.051 1.74 . . . . 0.0 113.229 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.8 tp . . . . . 0 C--O 1.254 1.309 0 C-N-CA 125.985 1.714 . . . . 0.0 114.43 -168.099 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.726 HD12 HD23 ' A' ' 8' ' ' LEU . 35.9 mt . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.2 p -71.29 -173.49 0.88 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.701 1.2 . . . . 0.0 112.158 170.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -51.23 -24.46 4.4 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.23 1.412 . . . . 0.0 114.791 175.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.77 39.12 0.21 Allowed Glycine 0 C--N 1.341 0.841 0 CA-C-O 117.61 -1.661 . . . . 0.0 115.954 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.8 -15.82 23.51 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 120.831 2.316 . . . . 0.0 113.137 177.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.726 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -108.92 -18.4 13.69 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.959 1.303 . . . . 0.0 112.795 170.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.436 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.4 ttt -73.38 -59.45 2.71 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.541 1.536 . . . . 0.0 111.255 -176.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.517 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.8 pttp -76.32 19.2 0.26 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.777 1.231 . . . . 0.0 113.005 -174.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.517 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -130.57 -38.93 1.3 Allowed 'General case' 0 C--O 1.233 0.223 0 C-N-CA 129.703 3.201 . . . . 0.0 110.992 -170.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.6 pt -64.04 -34.32 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 CA-C-N 119.07 0.85 . . . . 0.0 111.359 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.93 -13.83 43.61 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -93.22 -18.33 22.64 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.48 1.912 . . . . 0.0 111.847 -171.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.95 -48.8 10.99 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.165 0 C-N-CA 124.568 1.147 . . . . 0.0 108.933 168.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.0 t -65.55 -34.6 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 119.961 1.255 . . . . 0.0 111.407 -172.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -81.56 3.22 25.81 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.42 -7.71 9.69 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.153 1.781 . . . . 0.0 114.186 -176.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -100.53 -85.76 0.41 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.838 0.855 . . . . 0.0 112.296 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -136.88 87.77 2.31 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.913 1.285 . . . . 0.0 110.98 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -58.12 -23.82 56.45 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.959 0.904 . . . . 0.0 112.777 166.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -27.49 62.88 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 128.365 2.666 . . . . 0.0 113.914 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -148.29 75.63 10.45 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 127.122 2.169 . . . . 0.0 110.116 -170.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.2 161.48 45.83 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.14 2.56 . . . . 0.0 112.533 -170.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -78.7 -176.22 4.79 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.539 1.136 . . . . 0.0 110.964 167.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.471 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 55.1 p -137.43 169.59 17.52 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.098 1.759 . . . . 0.0 110.527 175.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -56.01 -32.1 63.68 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -67.16 -55.29 14.79 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 120.226 -1.546 . . . . 0.0 110.813 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.471 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.4 mm-40 -61.83 -49.29 76.88 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 120.786 -1.196 . . . . 0.0 112.866 -173.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.9 pt -59.07 -38.53 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 119.484 1.038 . . . . 0.0 112.183 173.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.56 -35.22 78.8 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.803 1.183 . . . . 0.0 111.827 176.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -68.89 -53.19 22.51 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.422 1.089 . . . . 0.0 112.947 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.455 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.8 mt -64.16 -32.86 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 O-C-N 121.321 -0.862 . . . . 0.0 111.433 -177.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.13 -24.69 67.3 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.242 1.417 . . . . 0.0 112.385 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -78.83 -15.75 57.98 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -88.35 -11.65 45.67 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.677 0.791 . . . . 0.0 112.105 -176.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.455 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.8 ptpt -126.58 -21.63 4.09 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -174.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.16 2.32 0.08 OUTLIER Glycine 0 N--CA 1.472 1.055 0 N-CA-C 115.992 1.157 . . . . 0.0 115.992 151.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.401 ' HB3' HD11 ' A' ' 3' ' ' LEU . 52.3 m-85 -89.0 -22.24 23.1 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.3 1.05 . . . . 0.0 113.671 -167.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.01 28.96 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 130.398 3.479 . . . . 0.0 115.673 -175.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.576 HG21 HD22 ' A' ' 8' ' ' LEU . 3.3 p -82.77 141.73 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 121.391 0.615 . . . . 0.0 109.348 -173.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.17 164.95 16.08 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.07 2.548 . . . . 0.0 112.719 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.2 -31.18 68.78 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 125.45 1.5 . . . . 0.0 114.354 -175.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -36.6 78.97 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.205 0.911 . . . . 0.0 110.693 -176.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.418 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 2.6 m -77.41 -47.5 19.64 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 126.492 1.917 . . . . 0.0 109.455 -176.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.25 -29.34 45.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.064 -175.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.06 -35.35 69.28 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.561 1.545 . . . . 0.0 112.287 178.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -67.5 -30.93 70.74 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.398 0.679 . . . . 0.0 111.841 172.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -77.08 -46.07 24.87 Favored 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 123.154 0.582 . . . . 0.0 112.423 -172.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.19 -29.5 14.2 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 175.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -74.0 -37.42 64.42 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.52 0.728 . . . . 0.0 112.515 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -87.28 -23.87 24.53 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -175.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.436 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.4 mt -71.41 -62.82 1.27 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.265 1.026 . . . . 0.0 111.387 169.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 165.84 3.98 0.04 OUTLIER Glycine 0 CA--C 1.537 1.464 0 N-CA-C 118.029 1.972 . . . . 0.0 118.029 170.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 28.4 mt -84.2 131.33 51.16 Favored Pre-proline 0 CA--C 1.547 0.835 0 CA-C-N 119.371 1.585 . . . . 0.0 111.169 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.6 -63.96 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.737 2.958 . . . . 0.0 110.797 172.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 85.1 p -150.69 -11.9 0.24 Allowed 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.254 1.575 . . . . 0.0 115.254 168.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 73.6 m 61.06 -13.36 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 128.456 2.702 . . . . 0.0 116.184 -166.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -69.11 -40.29 78.42 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.823 1.649 . . . . 0.0 109.263 167.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.65 -20.42 46.73 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -76.25 -38.86 55.72 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.175 1.39 . . . . 0.0 112.174 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -68.83 -58.64 3.9 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.851 1.661 . . . . 0.0 112.133 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.256 1.397 0 C-N-CA 125.596 1.558 . . . . 0.0 114.349 -169.105 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.714 HD12 HD23 ' A' ' 8' ' ' LEU . 41.8 mt . . . . . 0 CA--C 1.546 0.81 0 CA-C-O 122.645 1.212 . . . . 0.0 114.018 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.8 p -72.8 -165.5 0.22 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.444 1.498 . . . . 0.0 112.797 -176.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -50.56 -23.66 2.69 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.76 51.78 0.09 OUTLIER Glycine 0 C--N 1.341 0.816 0 CA-C-O 118.438 -1.201 . . . . 0.0 114.783 168.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -64.3 -13.34 49.31 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.096 1.948 . . . . 0.0 114.282 -177.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.714 HD23 HD12 ' A' ' 3' ' ' LEU . 1.7 pp -105.48 -19.71 13.7 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.979 0.912 . . . . 0.0 113.263 166.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.436 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.5 ttt -72.39 -59.22 2.84 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.041 1.737 . . . . 0.0 111.006 -176.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.472 ' C ' HD22 ' A' ' 11' ' ' LEU . 22.7 pttt -76.53 15.45 0.62 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.659 1.184 . . . . 0.0 113.255 -174.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.472 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.6 mm? -126.34 -39.89 2.01 Favored 'General case' 0 C--N 1.34 0.182 0 C-N-CA 129.326 3.05 . . . . 0.0 111.064 -171.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.4 pt -63.09 -34.04 64.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 119.084 0.856 . . . . 0.0 111.708 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.05 -17.48 40.2 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 176.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -97.48 -13.96 21.41 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 127.02 2.128 . . . . 0.0 111.913 -169.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.11 -49.22 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.782 1.233 . . . . 0.0 109.158 166.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.64 -39.41 85.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.736 1.153 . . . . 0.0 111.14 -172.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -83.07 5.26 22.97 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -113.98 -15.61 12.29 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.66 1.584 . . . . 0.0 113.508 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -89.33 -83.86 0.23 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.851 1.26 . . . . 0.0 111.552 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -136.01 95.68 3.26 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 122.702 1.239 . . . . 0.0 112.153 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -56.5 -14.21 2.92 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.783 1.633 . . . . 0.0 114.53 171.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -118.25 8.32 12.26 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.036 1.735 . . . . 0.0 114.962 171.795 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -140.58 79.13 20.46 Favored Pre-proline 0 N--CA 1.484 1.236 0 C-N-CA 125.667 1.587 . . . . 0.0 110.87 161.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -71.83 163.84 37.6 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 123.678 2.919 . . . . 0.0 113.209 -172.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -90.22 175.75 7.01 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.859 1.264 . . . . 0.0 111.157 168.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.457 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 77.7 p -129.45 169.78 14.52 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 126.256 1.822 . . . . 0.0 109.834 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.2 p30 -56.62 -34.42 67.23 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -67.64 -52.4 38.61 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 120.23 -1.544 . . . . 0.0 110.709 168.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.457 ' HB2' ' H ' ' A' ' 26' ' ' SER . 46.7 mt-10 -61.52 -50.83 71.12 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.783 -1.198 . . . . 0.0 112.462 -173.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.5 pt -59.46 -38.02 72.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 119.265 0.939 . . . . 0.0 112.036 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.56 -35.2 77.11 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.409 1.004 . . . . 0.0 111.79 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -69.56 -52.99 21.1 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.578 1.151 . . . . 0.0 112.796 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -64.41 -32.95 59.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 O-C-N 121.269 -0.894 . . . . 0.0 111.53 -177.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mp -63.58 -23.26 67.31 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.521 1.529 . . . . 0.0 112.207 176.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -80.03 -15.02 58.08 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -87.85 -11.76 46.87 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.68 0.792 . . . . 0.0 112.055 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.9 ptpt -127.34 -23.03 3.59 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -173.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.7 1.24 0.07 OUTLIER Glycine 0 N--CA 1.47 0.914 0 N-CA-C 115.948 1.139 . . . . 0.0 115.948 152.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -89.89 -27.36 19.94 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 118.43 1.115 . . . . 0.0 112.869 -167.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 29.19 40.87 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 130.426 3.491 . . . . 0.0 114.205 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.605 HG21 HD22 ' A' ' 8' ' ' LEU . 2.6 p -82.66 139.57 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.618 0.767 . . . . 0.0 108.995 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.6 158.21 31.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 127.471 2.308 . . . . 0.0 111.971 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.63 -29.69 64.75 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.398 1.479 . . . . 0.0 113.596 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -65.24 -37.42 87.19 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.003 1.321 . . . . 0.0 111.25 -175.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.3 m -82.25 -52.3 7.08 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 128.261 2.624 . . . . 0.0 109.701 -177.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.84 -29.27 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.027 -171.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.87 -52.55 62.66 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.377 1.471 . . . . 0.0 110.241 175.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -72.5 -9.59 58.74 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.917 -174.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.85 -45.83 11.19 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.537 1.135 . . . . 0.0 112.732 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -55.37 -24.16 28.14 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.348 0.976 . . . . 0.0 112.847 176.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.2 tt0 -62.56 -50.2 72.28 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.785 1.234 . . . . 0.0 112.937 175.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.4 ptt? -84.51 -26.29 28.2 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -169.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.436 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.2 mt -70.58 -57.65 4.52 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.622 1.169 . . . . 0.0 112.129 178.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.38 5.8 0.02 OUTLIER Glycine 0 CA--C 1.535 1.338 0 N-CA-C 118.194 2.038 . . . . 0.0 118.194 173.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.9 mt -107.22 134.18 20.03 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 119.411 1.606 . . . . 0.0 111.857 -169.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.43 -66.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.485 2.79 . . . . 0.0 109.842 169.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.2 p -150.08 -3.51 0.37 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.749 2.02 . . . . 0.0 113.247 167.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 52.4 m 55.4 -4.08 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 128.987 2.915 . . . . 0.0 116.235 -165.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.9 ttt85 -79.2 -42.57 25.73 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.17 1.388 . . . . 0.0 109.309 176.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -73.99 -21.04 60.15 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.736 1.215 . . . . 0.0 113.62 174.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -73.87 -41.29 62.42 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.604 1.162 . . . . 0.0 111.981 168.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -72.4 -59.72 2.59 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.85 1.66 . . . . 0.0 113.176 -178.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.254 1.335 0 C-N-CA 126.023 1.729 . . . . 0.0 114.386 -167.899 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.773 HD12 HD23 ' A' ' 8' ' ' LEU . 42.1 mt . . . . . 0 C--O 1.237 0.444 0 CA-C-O 121.695 0.76 . . . . 0.0 112.496 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.1 p -71.96 -168.55 0.39 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.882 1.273 . . . . 0.0 112.2 175.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -49.65 -25.4 2.83 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.238 1.415 . . . . 0.0 114.387 172.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.68 43.3 0.15 Allowed Glycine 0 C--N 1.341 0.835 0 CA-C-O 117.857 -1.524 . . . . 0.0 115.563 174.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -63.86 -11.13 24.82 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.625 2.213 . . . . 0.0 113.973 -179.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.773 HD23 HD12 ' A' ' 3' ' ' LEU . 1.7 pp -110.61 -17.81 13.32 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.732 1.213 . . . . 0.0 113.136 167.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.573 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.2 ttp -71.4 -63.15 1.17 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.573 1.549 . . . . 0.0 110.595 -178.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.485 ' C ' HD22 ' A' ' 11' ' ' LEU . 20.0 pttt -73.07 18.07 0.11 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.054 1.342 . . . . 0.0 113.791 -174.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.485 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -127.52 -43.72 1.57 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 129.621 3.168 . . . . 0.0 110.909 -171.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.5 pt -60.74 -36.42 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 119.082 0.855 . . . . 0.0 111.564 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.436 ' HG2' HD22 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -82.29 -18.77 41.16 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 178.428 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -96.48 -20.86 18.09 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.812 2.045 . . . . 0.0 111.908 -167.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -96.7 -50.15 11.64 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.166 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 169.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.3 t -65.02 -35.88 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 O-C-N 120.597 -1.315 . . . . 0.0 111.19 -171.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -80.22 -2.66 45.88 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.0 t30 -109.38 -19.57 13.22 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.721 1.609 . . . . 0.0 113.072 -175.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -91.4 -89.62 0.17 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.766 0.826 . . . . 0.0 111.734 -169.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -141.02 82.71 1.85 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.698 1.199 . . . . 0.0 110.051 -177.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.9 mtmm -60.62 -21.66 62.94 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.18 0.992 . . . . 0.0 113.261 173.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -69.79 -25.55 63.84 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 128.033 2.533 . . . . 0.0 115.04 167.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -143.1 70.81 18.42 Favored Pre-proline 0 N--CA 1.479 1.015 0 C-N-CA 127.645 2.378 . . . . 0.0 109.742 -176.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.48 166.49 29.67 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.585 2.857 . . . . 0.0 113.502 -165.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -78.68 -170.94 2.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.073 1.349 . . . . 0.0 111.011 164.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.1 m -149.88 175.94 11.19 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.389 1.476 . . . . 0.0 110.048 169.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 27.1 p30 -57.41 -31.05 65.46 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -66.86 -53.02 36.66 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.331 -1.481 . . . . 0.0 110.666 167.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.4 ' O ' HD12 ' A' ' 33' ' ' ILE . 6.4 mm-40 -66.77 -43.07 84.99 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 120.621 -1.299 . . . . 0.0 113.275 -172.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.7 pt -60.04 -40.0 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-N 120.164 1.347 . . . . 0.0 111.912 171.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.18 -34.89 77.3 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 120.06 1.3 . . . . 0.0 112.28 173.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -67.63 -53.61 26.53 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.796 1.639 . . . . 0.0 112.459 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.442 HG22 ' HE3' ' A' ' 37' ' ' LYS . 1.8 mt -66.66 -32.8 59.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 121.373 -0.83 . . . . 0.0 111.406 -179.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.92 -24.06 66.73 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.161 0.985 . . . . 0.0 112.131 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 pttm -80.01 -15.18 57.76 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -87.65 -12.96 43.97 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.899 0.88 . . . . 0.0 112.294 -178.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.442 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.1 ptpt -126.33 -20.51 4.42 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -173.478 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.13 -0.13 0.08 OUTLIER Glycine 0 N--CA 1.47 0.923 0 N-CA-C 115.812 1.085 . . . . 0.0 115.812 151.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -89.24 -31.47 17.87 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 118.634 1.217 . . . . 0.0 112.728 -167.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 28.55 43.69 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 130.338 3.455 . . . . 0.0 114.018 -171.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.567 HG21 HD22 ' A' ' 8' ' ' LEU . 2.7 p -81.25 142.31 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 174.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -82.92 163.55 21.02 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 128.365 2.666 . . . . 0.0 111.98 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -56.68 -36.17 69.29 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.909 1.283 . . . . 0.0 113.807 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -66.58 -32.41 73.73 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.356 1.062 . . . . 0.0 111.175 -169.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.5 m -80.93 -52.02 7.91 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.643 2.777 . . . . 0.0 109.842 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.35 -30.81 50.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.268 1.027 . . . . 0.0 110.949 -173.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.49 -37.18 74.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.107 2.163 . . . . 0.0 112.255 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.6 mtmm -79.56 -14.95 58.49 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -82.77 -40.27 20.69 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.3 ptt-85 -52.86 -26.28 14.19 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 175.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.9 -39.99 75.88 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.413 1.085 . . . . 0.0 112.957 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 23.9 ptp -80.25 -23.48 40.79 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.573 HD21 ' HG3' ' A' ' 9' ' ' MET . 4.2 mt -81.54 -61.42 1.94 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.113 1.365 . . . . 0.0 111.981 176.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.31 5.25 0.05 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 118.035 1.974 . . . . 0.0 118.035 168.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.0 mt -95.05 128.7 38.0 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 119.492 1.646 . . . . 0.0 111.452 -172.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -73.12 -49.36 0.23 Allowed 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.526 3.484 . . . . 0.0 113.445 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.3 p -139.84 -68.41 0.42 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.739 1.616 . . . . 0.0 109.88 169.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 62.8 m 121.2 -20.3 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.005 1 C-N-CA 134.351 5.06 . . . . 0.0 110.747 -164.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -74.78 -41.12 60.63 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.083 2.153 . . . . 0.0 109.697 174.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.17 -21.31 43.2 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.708 0.803 . . . . 0.0 112.948 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -69.76 -32.78 71.48 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.909 1.284 . . . . 0.0 112.055 173.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -82.46 -59.92 2.37 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.085 1.754 . . . . 0.0 113.16 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 C--O 1.253 1.25 0 C-N-CA 125.932 1.693 . . . . 0.0 114.64 -163.596 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.729 HD12 HD23 ' A' ' 8' ' ' LEU . 35.4 mt . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.1 p -71.83 -168.78 0.39 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 125.374 1.47 . . . . 0.0 112.671 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -49.04 -24.79 1.69 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.284 1.434 . . . . 0.0 114.469 173.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.92 46.25 0.12 Allowed Glycine 0 C--N 1.341 0.835 0 CA-C-O 118.228 -1.318 . . . . 0.0 115.552 170.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.21 -17.13 39.28 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.822 2.311 . . . . 0.0 113.175 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.729 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -109.33 -18.7 13.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.632 1.173 . . . . 0.0 112.582 170.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.7 ttm -71.18 -63.11 1.17 Allowed 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.586 1.555 . . . . 0.0 110.274 -175.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.497 ' C ' HD22 ' A' ' 11' ' ' LEU . 5.3 pttm -76.61 18.99 0.29 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.564 1.145 . . . . 0.0 113.547 -172.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.497 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.1 mm? -128.3 -39.02 1.73 Allowed 'General case' 0 C--O 1.233 0.229 0 C-N-CA 129.706 3.202 . . . . 0.0 110.726 -171.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -65.03 -35.45 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.027 0.831 . . . . 0.0 111.696 -176.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.82 -11.93 54.66 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -92.92 -17.95 23.37 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 127.297 2.239 . . . . 0.0 111.825 -170.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.15 -46.28 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 125.056 1.342 . . . . 0.0 109.671 168.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.4 t -65.99 -36.19 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-N 119.58 1.082 . . . . 0.0 111.309 -173.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -78.97 -1.19 34.19 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -107.11 -15.82 14.58 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.701 1.6 . . . . 0.0 112.998 -177.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -98.45 -93.06 0.25 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.781 0.832 . . . . 0.0 112.386 -170.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -136.38 92.09 2.74 Favored 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 124.63 1.172 . . . . 0.0 110.372 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.0 mttt -58.56 -20.38 46.18 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.737 0.815 . . . . 0.0 112.938 166.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.58 -20.46 60.61 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 127.745 2.418 . . . . 0.0 113.919 170.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -146.85 72.7 12.45 Favored Pre-proline 0 N--CA 1.477 0.877 0 C-N-CA 127.457 2.303 . . . . 0.0 109.754 -176.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.62 155.44 68.91 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.835 2.357 . . . . 0.0 112.4 -168.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -75.54 169.1 18.76 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.676 0.75 . . . . 0.0 110.19 164.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.464 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 81.1 p -124.63 168.55 12.99 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.359 1.464 . . . . 0.0 109.746 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.8 p30 -53.92 -32.13 52.54 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 175.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -67.98 -55.04 14.15 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 119.616 -1.927 . . . . 0.0 110.726 167.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.464 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.0 mm-40 -61.08 -50.05 74.85 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 120.81 -1.181 . . . . 0.0 112.784 -173.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.1 pt -59.54 -37.76 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 119.856 1.207 . . . . 0.0 112.278 173.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.54 -35.14 78.5 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.508 1.049 . . . . 0.0 111.74 177.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -68.39 -52.53 31.98 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.413 1.085 . . . . 0.0 112.7 -178.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.513 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -64.3 -32.69 58.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 121.347 -0.846 . . . . 0.0 111.621 -177.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -65.01 -21.67 66.88 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.631 1.572 . . . . 0.0 112.67 176.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -80.09 -15.55 56.9 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -86.39 -13.96 44.82 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 123.132 0.573 . . . . 0.0 111.926 -176.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.513 ' HE3' HG22 ' A' ' 33' ' ' ILE . 15.3 ptpt -130.15 -26.36 2.37 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 116.93 2.196 . . . . 0.0 116.93 -167.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 165.26 10.35 0.03 OUTLIER Glycine 0 N--CA 1.471 1.007 0 N-CA-C 117.126 1.61 . . . . 0.0 117.126 163.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -112.12 -36.11 5.44 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 118.895 1.347 . . . . 0.0 112.385 -167.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.27 1.4 ttpt 40.3 43.84 1.51 Allowed 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 128.33 2.652 . . . . 0.0 113.095 175.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.617 HG21 HD22 ' A' ' 8' ' ' LEU . 3.5 p -91.44 144.44 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.842 2.057 . . . . 0.0 109.129 177.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.54 170.73 10.25 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.612 2.765 . . . . 0.0 112.853 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -59.73 -33.84 72.15 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 125.694 1.598 . . . . 0.0 114.052 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -38.34 85.87 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.73 1.212 . . . . 0.0 111.278 -172.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.6 m -86.68 -47.96 8.7 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 127.137 2.175 . . . . 0.0 109.036 -172.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.15 -31.65 54.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.667 -174.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.57 -46.94 74.36 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 125.597 1.559 . . . . 0.0 111.118 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -68.06 -20.01 64.93 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.414 1.086 . . . . 0.0 112.595 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -82.78 -48.3 10.96 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.072 0.949 . . . . 0.0 112.072 178.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -54.53 -29.8 51.78 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 119.906 1.23 . . . . 0.0 112.08 171.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -71.91 -38.04 69.97 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.384 1.074 . . . . 0.0 113.364 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 15.0 ptm -84.97 -28.37 25.84 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.8 mp -69.76 -64.05 0.96 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.106 0.962 . . . . 0.0 111.478 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.47 2.59 0.03 OUTLIER Glycine 0 CA--C 1.538 1.509 0 N-CA-C 118.516 2.166 . . . . 0.0 118.516 175.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.6 mt -90.23 132.16 36.6 Favored Pre-proline 0 CA--C 1.547 0.85 0 CA-C-N 119.59 1.695 . . . . 0.0 110.912 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.73 -62.05 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.503 2.802 . . . . 0.0 110.594 173.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.4 p -151.9 -7.71 0.22 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 164.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 72.0 m 58.45 -16.45 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 127.872 2.469 . . . . 0.0 116.272 -166.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 -66.37 -43.01 87.15 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.14 1.376 . . . . 0.0 108.402 167.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -22.69 52.91 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.192 0.997 . . . . 0.0 113.587 -178.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.9 mtp180 -74.31 -42.99 58.57 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.208 1.403 . . . . 0.0 111.796 170.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -72.33 -59.24 2.83 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.497 1.519 . . . . 0.0 112.694 -176.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.784 1.634 . . . . 0.0 114.469 -169.266 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.735 HD12 HD23 ' A' ' 8' ' ' LEU . 18.4 mt . . . . . 0 N--CA 1.467 0.403 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.0 p -74.56 -170.4 1.02 Allowed 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.191 175.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.03 -26.81 1.95 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.349 1.46 . . . . 0.0 114.663 172.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -170.55 38.09 0.18 Allowed Glycine 0 C--N 1.34 0.77 0 CA-C-O 117.608 -1.662 . . . . 0.0 115.688 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.1 -13.77 19.53 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.902 2.351 . . . . 0.0 113.26 176.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.735 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -107.75 -18.56 13.79 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.176 0.99 . . . . 0.0 112.976 168.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.3 ttt -70.09 -62.62 1.31 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.633 1.573 . . . . 0.0 110.301 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.526 ' C ' HD22 ' A' ' 11' ' ' LEU . 18.3 pttt -76.78 17.06 0.44 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.04 1.336 . . . . 0.0 113.215 -172.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.526 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -129.45 -35.55 1.74 Allowed 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 129.236 3.014 . . . . 0.0 111.482 -171.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pt -61.59 -34.92 63.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 119.291 0.95 . . . . 0.0 111.312 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.0 -12.39 36.02 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -93.2 -17.89 23.18 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 127.125 2.17 . . . . 0.0 111.819 -174.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.51 -48.51 11.19 Favored 'Isoleucine or valine' 0 C--N 1.341 0.229 0 C-N-CA 124.863 1.265 . . . . 0.0 109.427 169.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 72.8 t -63.03 -39.26 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 119.671 1.123 . . . . 0.0 111.013 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -82.1 5.09 20.65 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -111.58 -15.48 13.48 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.312 1.845 . . . . 0.0 113.583 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -94.95 -86.25 0.29 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.341 1.056 . . . . 0.0 111.874 -174.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -139.7 87.95 2.21 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.85 1.26 . . . . 0.0 110.107 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -54.35 -27.63 37.42 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.441 1.096 . . . . 0.0 112.8 169.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -81.18 -12.93 59.07 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.035 2.134 . . . . 0.0 114.175 177.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -146.51 73.65 12.76 Favored Pre-proline 0 N--CA 1.481 1.11 0 C-N-CA 127.43 2.292 . . . . 0.0 110.514 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -73.11 167.95 26.01 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.07 2.513 . . . . 0.0 113.408 -169.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -88.29 -175.29 4.97 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.464 1.505 . . . . 0.0 111.619 171.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.478 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 26.6 p -139.98 171.64 13.9 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.798 2.039 . . . . 0.0 110.166 176.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.0 p-10 -48.04 -48.4 33.06 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -62.48 -48.74 78.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.293 -1.504 . . . . 0.0 110.449 174.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.478 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.9 mm-40 -63.22 -49.8 72.75 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 120.849 -1.157 . . . . 0.0 112.545 -174.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.6 pt -59.36 -38.16 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.322 0.964 . . . . 0.0 112.437 173.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.83 -35.85 77.58 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.387 0.994 . . . . 0.0 111.658 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -68.77 -52.83 26.17 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.502 1.121 . . . . 0.0 112.853 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.493 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -64.36 -32.65 58.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.337 -0.852 . . . . 0.0 111.793 -177.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mp -62.64 -23.81 67.28 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.504 1.522 . . . . 0.0 112.451 174.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -79.19 -15.67 57.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 176.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -86.95 -12.94 46.09 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.465 0.706 . . . . 0.0 112.08 -176.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.493 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.2 ptpt -127.56 -21.28 3.82 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -172.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.2 1.91 0.07 OUTLIER Glycine 0 N--CA 1.471 0.991 0 N-CA-C 116.05 1.18 . . . . 0.0 116.05 151.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.413 ' HB3' HD11 ' A' ' 3' ' ' LEU . 49.4 m-85 -91.29 -21.36 21.1 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.355 1.077 . . . . 0.0 113.803 -165.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.05 28.12 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 130.531 3.532 . . . . 0.0 115.62 -175.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.583 HG21 HD22 ' A' ' 8' ' ' LEU . 3.6 p -84.06 141.29 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 121.49 0.662 . . . . 0.0 109.254 -170.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.0 166.23 15.23 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 128.412 2.685 . . . . 0.0 112.562 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 44.2 ttp85 -58.77 -32.19 69.06 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 125.767 1.627 . . . . 0.0 114.263 -173.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -65.05 -39.68 93.64 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.142 0.972 . . . . 0.0 111.5 -174.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.421 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 1.9 m -77.85 -49.6 13.93 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 127.345 2.258 . . . . 0.0 108.943 -175.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -31.1 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.825 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.412 -173.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.6 -37.88 67.99 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.874 1.67 . . . . 0.0 111.961 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -68.95 -22.71 64.11 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 175.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -84.62 -47.99 9.96 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.316 1.047 . . . . 0.0 112.423 -176.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.6 ptm85 -54.78 -28.37 48.35 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.337 0.971 . . . . 0.0 112.28 171.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -72.91 -34.24 66.5 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.925 0.89 . . . . 0.0 112.914 176.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.8 ptt? -92.17 -29.39 16.5 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 mp -67.17 -63.93 0.96 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.82 0.848 . . . . 0.0 111.264 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.88 3.22 0.03 OUTLIER Glycine 0 CA--C 1.538 1.471 0 N-CA-C 118.414 2.126 . . . . 0.0 118.414 173.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 47.6 mt -79.54 128.26 75.56 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-N 119.826 1.813 . . . . 0.0 111.038 -176.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -50.29 -68.87 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 125.213 3.942 . . . . 0.0 112.34 165.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.3 m 165.66 106.64 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.174 1 C-N-CA 134.638 5.175 . . . . 0.0 105.395 167.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.6 m -42.33 -5.53 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 131.128 3.771 . . . . 0.0 119.122 -169.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -70.38 -15.76 62.89 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.972 1.309 . . . . 0.0 112.116 167.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -118.53 -11.93 9.86 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -69.07 -50.41 48.63 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.713 0.688 . . . . 0.0 112.516 169.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -74.11 -56.16 5.25 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.011 1.724 . . . . 0.0 113.267 -171.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.256 1.404 0 C-N-CA 126.291 1.836 . . . . 0.0 114.339 -167.848 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.726 HD12 HD23 ' A' ' 8' ' ' LEU . 21.2 mt . . . . . 0 CA--C 1.538 0.502 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.6 p -74.03 -168.96 0.68 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.416 1.486 . . . . 0.0 112.55 177.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -48.64 -25.05 1.57 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.82 1.648 . . . . 0.0 114.667 172.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.73 45.65 0.12 Allowed Glycine 0 C--N 1.341 0.817 0 CA-C-O 118.073 -1.404 . . . . 0.0 115.305 172.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.41 -15.19 34.48 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 120.38 2.09 . . . . 0.0 113.421 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.726 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -108.51 -19.18 13.53 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.777 1.231 . . . . 0.0 113.007 169.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.531 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.2 ttt -73.9 -58.38 3.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.077 1.751 . . . . 0.0 111.442 -174.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.447 ' C ' HD22 ' A' ' 11' ' ' LEU . 21.6 pttt -76.99 17.1 0.46 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.405 1.082 . . . . 0.0 112.971 -173.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.447 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -125.65 -43.93 1.85 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 129.908 3.283 . . . . 0.0 110.359 -170.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.9 pt -61.51 -36.45 73.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 118.344 0.52 . . . . 0.0 111.91 -177.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.07 -17.79 41.95 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 177.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -96.96 -15.45 21.12 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 127.117 2.167 . . . . 0.0 112.003 -168.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -102.04 -47.97 11.1 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 C-N-CA 124.63 1.172 . . . . 0.0 109.013 166.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.1 t -65.64 -35.77 76.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 119.903 1.229 . . . . 0.0 111.635 -172.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -82.03 4.7 21.89 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -118.95 -9.96 9.96 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.309 1.844 . . . . 0.0 114.042 -177.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -101.52 -82.62 0.47 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.97 0.908 . . . . 0.0 112.139 -174.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -139.22 84.11 1.98 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.526 1.13 . . . . 0.0 111.089 -173.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -58.31 -25.07 61.45 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.161 0.984 . . . . 0.0 113.181 171.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -16.66 56.03 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 127.152 2.181 . . . . 0.0 114.956 172.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -147.53 76.07 11.02 Favored Pre-proline 0 N--CA 1.479 1.025 0 C-N-CA 126.769 2.028 . . . . 0.0 110.126 -178.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -69.18 162.28 42.42 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.041 2.494 . . . . 0.0 112.86 -171.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -79.68 -173.13 3.65 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.731 1.212 . . . . 0.0 110.756 167.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.49 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 52.3 p -138.03 168.19 20.22 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.995 1.318 . . . . 0.0 111.154 171.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.2 p30 -52.1 -30.99 28.64 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 175.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -68.11 0.32 Allowed 'General case' 0 C--N 1.333 -0.124 0 O-C-N 120.322 -1.486 . . . . 0.0 110.08 165.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.49 ' HB2' ' H ' ' A' ' 26' ' ' SER . 38.1 mt-10 -57.5 -49.33 76.65 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.222 1.009 . . . . 0.0 112.86 -170.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.4 pt -59.32 -37.29 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 119.193 0.906 . . . . 0.0 112.166 174.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.15 -34.62 78.47 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.862 1.21 . . . . 0.0 111.878 175.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -68.02 -53.47 25.61 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.235 1.014 . . . . 0.0 112.604 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.482 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -63.73 -32.68 57.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 121.572 -0.705 . . . . 0.0 111.617 -176.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.98 -23.1 67.21 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.394 1.477 . . . . 0.0 112.295 175.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -80.25 -15.77 56.23 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -86.24 -13.08 47.89 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.604 0.762 . . . . 0.0 112.163 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.482 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.0 ptpt -127.17 -21.99 3.83 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -172.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.54 2.6 0.07 OUTLIER Glycine 0 N--CA 1.47 0.916 0 N-CA-C 115.97 1.148 . . . . 0.0 115.97 151.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -89.38 -21.93 22.83 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 118.265 1.032 . . . . 0.0 113.443 -167.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.49 30.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 130.368 3.467 . . . . 0.0 115.298 -176.244 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.596 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -83.0 138.43 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 121.576 0.703 . . . . 0.0 109.238 -172.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.05 159.92 28.43 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 127.72 2.408 . . . . 0.0 112.21 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.83 -29.73 63.09 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.261 1.424 . . . . 0.0 113.543 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -32.27 72.71 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.61 1.164 . . . . 0.0 111.722 -175.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.1 m -87.14 -48.64 7.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.104 2.562 . . . . 0.0 110.059 -177.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.24 -30.11 49.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.096 -174.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.21 -37.96 86.81 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.223 1.409 . . . . 0.0 111.042 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -75.34 -17.94 60.12 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.456 1.102 . . . . 0.0 112.311 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.74 -50.13 7.41 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.46 1.104 . . . . 0.0 112.635 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.81 -23.58 18.85 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 175.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -68.78 -43.74 75.12 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.0 1.32 . . . . 0.0 112.585 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -87.63 -28.14 22.06 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -173.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.531 HD21 ' HG3' ' A' ' 9' ' ' MET . 0.9 OUTLIER -69.26 -59.21 3.16 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.319 1.048 . . . . 0.0 111.695 177.132 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.92 4.52 0.03 OUTLIER Glycine 0 CA--C 1.534 1.257 0 N-CA-C 118.312 2.085 . . . . 0.0 118.312 170.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 35.3 mt -91.81 121.47 67.01 Favored Pre-proline 0 CA--C 1.545 0.754 0 CA-C-N 120.014 1.907 . . . . 0.0 111.047 -173.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.94 -58.07 0.16 Allowed 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.382 2.721 . . . . 0.0 110.204 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.7 p -150.81 -8.87 0.25 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 160.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 77.4 p 60.61 -15.86 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 128.878 2.871 . . . . 0.0 116.151 -166.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 63.3 ttt180 -71.61 -43.74 65.68 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.345 1.458 . . . . 0.0 109.351 167.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -22.34 61.02 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -178.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -74.69 -39.5 61.94 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.776 1.63 . . . . 0.0 112.149 169.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -74.11 -59.09 2.88 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.568 1.547 . . . . 0.0 112.931 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.725 2.01 . . . . 0.0 114.483 -167.505 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.735 HD12 HD23 ' A' ' 8' ' ' LEU . 25.6 mt . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.8 p -73.88 -170.56 0.92 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.337 1.455 . . . . 0.0 112.245 176.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -49.23 -25.44 2.29 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.589 1.555 . . . . 0.0 114.599 172.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -171.68 40.66 0.17 Allowed Glycine 0 C--N 1.343 0.918 0 CA-C-O 117.682 -1.621 . . . . 0.0 115.682 175.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.61 -13.96 26.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 120.815 2.307 . . . . 0.0 113.467 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.735 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -108.72 -18.86 13.61 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.385 1.074 . . . . 0.0 113.151 168.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.617 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.4 ttp -71.64 -61.55 1.74 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.592 1.557 . . . . 0.0 111.104 -177.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.453 ' C ' HD22 ' A' ' 11' ' ' LEU . 19.6 pttt -75.17 17.01 0.27 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.305 1.042 . . . . 0.0 113.193 -171.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.453 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -125.4 -45.82 1.79 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 129.82 3.248 . . . . 0.0 110.392 -169.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.0 pt -59.64 -36.85 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt -82.76 -14.6 54.18 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 174.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -90.87 -17.76 25.96 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 125.55 1.54 . . . . 0.0 112.094 -174.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.39 -45.19 11.18 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 C-N-CA 124.167 0.987 . . . . 0.0 109.32 170.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.77 -31.18 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 O-C-N 120.891 -1.131 . . . . 0.0 111.225 -174.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -79.08 -2.39 40.32 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.253 -0.905 . . . . 0.0 112.816 174.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -108.73 -14.46 14.6 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.903 1.681 . . . . 0.0 112.851 -176.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -103.4 -102.59 0.29 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.201 0.909 . . . . 0.0 112.095 -168.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -139.96 80.82 1.79 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.495 1.118 . . . . 0.0 109.896 -172.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -62.62 -17.31 60.05 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 174.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -66.09 -22.29 66.4 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 127.212 2.205 . . . . 0.0 114.623 164.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -142.6 66.22 18.06 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 128.29 2.636 . . . . 0.0 109.637 177.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -70.23 162.0 43.93 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.318 2.679 . . . . 0.0 113.424 -163.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -77.53 170.01 17.3 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.845 0.831 . . . . 0.0 111.106 166.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.482 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 89.8 p -124.69 170.31 11.11 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 126.003 1.721 . . . . 0.0 109.846 178.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.4 p30 -53.98 -32.65 54.68 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -68.54 -54.67 15.25 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 119.776 -1.827 . . . . 0.0 110.789 168.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.482 ' HB2' ' H ' ' A' ' 26' ' ' SER . 91.9 mt-10 -62.55 -47.85 82.06 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 120.704 -1.247 . . . . 0.0 112.714 -173.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.3 pt -58.94 -38.92 76.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-N 119.871 1.214 . . . . 0.0 112.317 172.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.8 -35.41 78.11 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.543 1.065 . . . . 0.0 111.892 176.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -68.87 -52.62 27.69 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.518 1.127 . . . . 0.0 112.74 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.7 mt -64.03 -33.18 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 118.841 0.746 . . . . 0.0 111.269 -177.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.13 -24.93 68.12 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.369 1.468 . . . . 0.0 112.486 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -14.82 58.26 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 176.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -86.5 -13.19 46.73 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.436 0.694 . . . . 0.0 112.017 -178.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.1 ptpt -126.49 -22.55 3.95 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -172.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.04 2.54 0.08 OUTLIER Glycine 0 N--CA 1.47 0.933 0 CA-C-N 119.562 1.074 . . . . 0.0 115.668 151.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -87.16 -23.12 24.92 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 118.331 1.065 . . . . 0.0 113.303 -168.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.8 30.88 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 130.351 3.461 . . . . 0.0 115.109 -175.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.567 HG21 HD22 ' A' ' 8' ' ' LEU . 3.0 p -82.07 138.55 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.56 0.695 . . . . 0.0 109.226 -174.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.9 161.59 24.31 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 127.894 2.478 . . . . 0.0 112.033 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.63 -27.57 67.89 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 125.386 1.474 . . . . 0.0 113.853 -178.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.28 -32.51 72.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.118 0.967 . . . . 0.0 111.956 -177.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 m -84.09 -51.35 7.15 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 128.298 2.639 . . . . 0.0 109.914 -177.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.57 -29.06 45.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.848 -172.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.6 94.65 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.303 1.441 . . . . 0.0 110.91 176.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -71.43 -16.63 62.39 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.509 0.723 . . . . 0.0 112.487 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -85.97 -51.61 6.25 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.222 1.009 . . . . 0.0 112.267 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -54.36 -25.42 24.19 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.035 0.834 . . . . 0.0 112.679 175.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -68.77 -40.32 79.77 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.331 1.452 . . . . 0.0 113.025 178.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -92.88 -25.44 18.08 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -173.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.617 HD21 ' HG3' ' A' ' 9' ' ' MET . 0.8 OUTLIER -71.2 -60.56 2.17 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.625 1.17 . . . . 0.0 112.013 177.705 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 177.17 -0.6 0.03 OUTLIER Glycine 0 CA--C 1.534 1.254 0 N-CA-C 118.141 2.016 . . . . 0.0 118.141 172.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.8 mt -86.85 129.13 53.54 Favored Pre-proline 0 CA--C 1.546 0.794 0 CA-C-N 119.518 1.659 . . . . 0.0 110.628 -177.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.41 -60.02 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.827 2.351 . . . . 0.0 110.387 174.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.5 p -153.27 -7.47 0.17 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 163.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.403 ' HA ' ' HE ' ' A' ' 61' ' ' ARG . 28.9 m 59.26 -21.55 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.977 2.511 . . . . 0.0 116.199 -164.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.7 ttt85 -67.56 -43.15 81.34 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.923 1.238 . . . . 0.0 108.585 170.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -25.6 60.41 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.403 ' HE ' ' HA ' ' A' ' 58' ' ' SER . 57.3 mtm180 -71.3 -43.47 67.05 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.197 1.399 . . . . 0.0 112.244 169.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -74.19 -61.04 1.99 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.682 1.593 . . . . 0.0 113.31 -176.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.1 tp . . . . . 0 C--O 1.255 1.355 0 C-N-CA 126.515 1.926 . . . . 0.0 114.593 -166.108 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.728 HD12 HD23 ' A' ' 8' ' ' LEU . 63.8 mt . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 42.9 p -72.19 -163.09 0.1 Allowed 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 125.68 1.592 . . . . 0.0 112.635 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -48.16 -25.35 1.44 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.065 1.346 . . . . 0.0 114.335 169.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 176.14 53.96 0.06 OUTLIER Glycine 0 CA--C 1.527 0.808 0 CA-C-O 118.728 -1.04 . . . . 0.0 114.276 168.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -64.87 -13.54 56.66 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.688 1.744 . . . . 0.0 114.202 -175.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.728 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -106.0 -19.7 13.65 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.218 1.007 . . . . 0.0 113.113 168.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.583 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.0 ttp -72.25 -60.21 2.35 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.092 1.757 . . . . 0.0 110.68 -177.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.467 ' C ' HD22 ' A' ' 11' ' ' LEU . 9.3 pttp -75.28 15.78 0.41 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.601 1.16 . . . . 0.0 113.459 -173.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.467 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.6 mm? -127.03 -41.59 1.78 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 129.404 3.082 . . . . 0.0 111.391 -170.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.0 pt -60.95 -33.83 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 119.069 0.85 . . . . 0.0 112.125 178.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -17.58 44.65 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 175.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -96.71 -13.03 23.01 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 126.439 1.896 . . . . 0.0 111.929 -170.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.28 -48.7 9.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.183 0 C-N-CA 124.482 1.113 . . . . 0.0 108.776 167.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.2 -32.49 57.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 120.282 1.401 . . . . 0.0 111.434 -172.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -78.29 -2.76 39.52 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.381 -0.824 . . . . 0.0 112.893 175.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -117.22 -9.19 11.03 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.432 1.893 . . . . 0.0 113.816 -172.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -102.66 -97.78 0.29 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.003 0.82 . . . . 0.0 112.263 -170.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -137.33 83.21 1.98 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.588 1.155 . . . . 0.0 110.219 -177.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -62.46 -17.96 60.67 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 175.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.51 ' H ' ' HD3' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -79.96 -12.48 59.72 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.814 2.046 . . . . 0.0 114.799 168.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -145.06 67.06 13.17 Favored Pre-proline 0 N--CA 1.48 1.075 0 C-N-CA 127.368 2.267 . . . . 0.0 109.624 175.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.15 165.44 32.7 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.956 2.437 . . . . 0.0 112.99 -164.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -77.34 -175.49 3.74 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.684 1.194 . . . . 0.0 111.416 167.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.506 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 93.2 p -136.64 170.87 15.35 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.651 1.98 . . . . 0.0 109.634 171.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.5 p30 -54.03 -32.14 53.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 172.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -67.76 -54.11 21.88 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.011 -1.681 . . . . 0.0 110.691 169.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.506 ' HB2' ' H ' ' A' ' 26' ' ' SER . 22.1 mm-40 -62.45 -47.93 81.86 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 120.812 -1.18 . . . . 0.0 112.663 -174.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.4 pt -58.97 -39.13 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.625 1.102 . . . . 0.0 112.096 173.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.78 -35.37 79.62 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.578 1.081 . . . . 0.0 111.943 176.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -69.18 -52.34 28.89 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.439 1.096 . . . . 0.0 112.819 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.3 mt -64.22 -33.65 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 O-C-N 121.437 -0.789 . . . . 0.0 111.19 -178.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -62.11 -25.65 67.84 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.238 1.415 . . . . 0.0 112.644 176.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -79.01 -15.78 57.79 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -87.21 -12.73 45.96 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 123.446 0.698 . . . . 0.0 112.144 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.0 ptpt -126.79 -21.48 4.05 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -173.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.79 2.21 0.07 OUTLIER Glycine 0 N--CA 1.472 1.083 0 N-CA-C 115.932 1.133 . . . . 0.0 115.932 153.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -90.42 -19.75 23.57 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 118.334 1.067 . . . . 0.0 113.43 -167.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 35.82 25.17 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 130.699 3.6 . . . . 0.0 116.095 -175.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.548 HG21 HD22 ' A' ' 8' ' ' LEU . 2.6 p -81.75 137.93 20.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -169.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.39 158.73 31.13 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.148 2.179 . . . . 0.0 112.093 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -55.64 -30.81 61.63 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.841 1.257 . . . . 0.0 113.243 175.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -66.37 -34.36 77.8 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.117 1.367 . . . . 0.0 111.615 -174.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.8 m -83.66 -51.91 6.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 129.036 2.934 . . . . 0.0 109.882 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.93 -30.93 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.932 -173.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.84 -34.7 77.22 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.862 1.665 . . . . 0.0 111.788 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -84.18 -9.55 58.46 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.416 1.086 . . . . 0.0 112.989 176.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -90.03 -51.37 5.5 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.82 1.248 . . . . 0.0 112.297 176.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -20.31 5.96 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 174.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -65.26 -42.59 93.11 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.761 1.625 . . . . 0.0 113.143 173.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -94.61 -26.33 16.41 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.583 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.1 mt -73.73 -59.69 2.6 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.404 1.082 . . . . 0.0 112.166 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.89 -8.47 0.03 OUTLIER Glycine 0 CA--C 1.533 1.213 0 N-CA-C 118.142 2.017 . . . . 0.0 118.142 167.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.4 mt -69.6 121.63 83.04 Favored Pre-proline 0 CA--C 1.542 0.642 0 CA-C-N 119.439 1.62 . . . . 0.0 110.743 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.88 -64.36 0.05 OUTLIER 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.116 2.544 . . . . 0.0 109.308 178.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.1 p -150.94 -10.17 0.24 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.122 1.369 . . . . 0.0 114.422 158.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.3 m 56.85 -17.82 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 128.389 2.676 . . . . 0.0 116.455 -163.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -67.21 -42.34 84.29 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 120.308 1.413 . . . . 0.0 108.743 166.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.81 -22.11 60.87 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -71.27 -46.49 60.8 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.643 1.577 . . . . 0.0 111.667 166.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -75.37 -59.44 2.75 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.515 1.926 . . . . 0.0 113.405 -170.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 C--O 1.253 1.285 0 C-N-CA 127.384 2.274 . . . . 0.0 114.525 -167.596 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.777 HD12 HD23 ' A' ' 8' ' ' LEU . 20.6 mt . . . . . 0 C--O 1.236 0.361 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 60.2 p -73.44 -172.59 1.21 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.035 1.334 . . . . 0.0 111.582 171.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -51.86 -23.58 5.03 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.206 1.402 . . . . 0.0 114.73 172.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.64 29.44 0.24 Allowed Glycine 0 C--N 1.34 0.781 0 CA-C-O 117.339 -1.812 . . . . 0.0 116.939 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -62.01 -10.81 10.86 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 121.784 2.792 . . . . 0.0 113.82 178.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.777 HD23 HD12 ' A' ' 3' ' ' LEU . 1.9 pp -111.18 -16.89 13.33 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.624 1.17 . . . . 0.0 113.508 166.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.411 ' HG3' HD11 ' A' ' 53' ' ' LEU . 6.3 ttt -68.3 -67.06 0.49 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.224 1.41 . . . . 0.0 110.339 176.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.501 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.9 pttp -73.79 15.88 0.25 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.406 1.482 . . . . 0.0 113.673 -172.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.501 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -127.4 -35.15 2.2 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 128.798 2.839 . . . . 0.0 111.822 -172.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -61.3 -29.96 46.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.471 1.032 . . . . 0.0 112.023 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.52 -9.53 23.2 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -178.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -88.74 -16.61 31.78 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 125.64 1.576 . . . . 0.0 111.56 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 pp -101.45 -51.81 9.06 Favored 'Isoleucine or valine' 0 C--N 1.342 0.265 0 C-N-CA 123.974 0.91 . . . . 0.0 108.786 168.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.7 t -63.88 -35.48 73.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 120.378 1.444 . . . . 0.0 111.325 -172.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -80.77 -0.74 39.96 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -109.9 -19.78 12.99 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.752 1.621 . . . . 0.0 112.991 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -93.82 -95.47 0.16 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.741 0.816 . . . . 0.0 112.202 -167.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -139.98 85.53 2.03 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.194 0.998 . . . . 0.0 110.971 -175.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -58.05 -22.34 49.62 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.571 1.149 . . . . 0.0 113.354 168.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 -68.79 -23.83 64.33 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.079 2.152 . . . . 0.0 114.598 169.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -147.29 70.7 11.87 Favored Pre-proline 0 N--CA 1.481 1.115 0 C-N-CA 127.67 2.388 . . . . 0.0 109.771 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -76.82 173.58 14.24 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.167 2.578 . . . . 0.0 113.772 -165.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -89.8 -175.03 4.5 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.832 1.653 . . . . 0.0 112.158 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.7 p -140.08 175.99 9.13 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 126.749 2.02 . . . . 0.0 109.515 172.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 40.3 p-10 -49.28 -47.3 46.88 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 173.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -60.01 -51.17 70.78 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.025 -1.672 . . . . 0.0 110.706 173.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.418 ' O ' HD12 ' A' ' 33' ' ' ILE . 6.8 mm-40 -66.97 -43.39 83.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 120.934 -1.104 . . . . 0.0 113.366 -174.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 pt -60.07 -39.87 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 120.366 1.439 . . . . 0.0 111.881 171.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.84 -35.76 77.39 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.83 1.195 . . . . 0.0 112.257 174.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -67.66 -51.68 46.99 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.713 1.605 . . . . 0.0 112.323 -178.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.488 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -67.55 -32.68 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 O-C-N 121.372 -0.83 . . . . 0.0 111.598 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mp -63.53 -23.14 67.27 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.011 1.324 . . . . 0.0 112.022 175.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -82.37 -14.27 55.53 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 176.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -85.3 -13.33 50.03 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.463 0.705 . . . . 0.0 112.135 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.488 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.8 ptpt -127.38 -21.64 3.82 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -172.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.28 1.37 0.09 OUTLIER Glycine 0 N--CA 1.468 0.83 0 N-CA-C 115.521 0.968 . . . . 0.0 115.521 150.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.463 ' HB3' HD11 ' A' ' 3' ' ' LEU . 54.1 m-85 -85.1 -29.47 24.84 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.405 1.102 . . . . 0.0 112.59 -169.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.3 ptmt 28.84 41.81 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 130.388 3.475 . . . . 0.0 114.185 -173.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.665 HG21 HD22 ' A' ' 8' ' ' LEU . 2.4 p -79.78 139.73 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.305 1.042 . . . . 0.0 108.244 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.71 163.68 24.32 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.103 2.161 . . . . 0.0 112.515 177.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -61.78 -30.15 70.61 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 125.545 1.538 . . . . 0.0 114.205 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -71.96 -31.12 66.0 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.62 1.1 . . . . 0.0 111.791 -175.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 m -79.45 -48.89 13.17 Favored 'General case' 0 CA--C 1.505 -0.761 0 C-N-CA 125.853 1.661 . . . . 0.0 108.848 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -64.79 -32.06 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 CA-C-N 115.003 -0.998 . . . . 0.0 110.615 -176.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.95 -36.92 67.27 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 125.218 1.407 . . . . 0.0 112.354 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -75.64 -15.17 60.36 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.954 1.302 . . . . 0.0 112.655 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -90.28 -49.54 6.48 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.249 1.42 . . . . 0.0 111.991 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -22.8 26.63 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.426 1.012 . . . . 0.0 112.963 169.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -69.15 -45.3 70.41 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.706 1.202 . . . . 0.0 112.683 171.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 13.8 ptt? -87.08 -28.98 22.22 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.917 0.887 . . . . 0.0 113.283 -170.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.411 HD11 ' HG3' ' A' ' 9' ' ' MET . 1.3 mp -67.24 -65.52 0.67 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.505 1.122 . . . . 0.0 111.088 172.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.75 6.55 0.03 OUTLIER Glycine 0 CA--C 1.537 1.407 0 N-CA-C 119.594 2.598 . . . . 0.0 119.594 169.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 59.5 mt -82.91 124.13 77.16 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 120.399 2.099 . . . . 0.0 111.839 -173.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -51.57 -60.9 0.63 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 124.967 3.778 . . . . 0.0 112.852 170.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 90.7 p -162.41 -18.43 0.04 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 165.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 60.8 m 61.41 0.56 0.46 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.464 1.905 . . . . 0.0 115.181 -163.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -85.99 -16.28 38.82 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.797 1.639 . . . . 0.0 111.681 165.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.25 -14.01 9.28 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.311 1.444 . . . . 0.0 114.36 -176.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -70.8 -45.92 63.76 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.12 1.368 . . . . 0.0 112.032 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -76.07 -56.22 4.86 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.706 1.603 . . . . 0.0 112.728 -173.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.254 1.297 0 C-N-CA 126.923 2.089 . . . . 0.0 114.529 -168.543 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.744 HD12 HD23 ' A' ' 8' ' ' LEU . 32.1 mt . . . . . 0 CA--C 1.537 0.446 0 CA-C-O 122.012 0.911 . . . . 0.0 113.334 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 38.9 p -73.44 -164.31 0.19 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.009 1.724 . . . . 0.0 112.571 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -49.06 -24.98 1.79 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.433 1.493 . . . . 0.0 114.468 169.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 178.83 51.23 0.08 OUTLIER Glycine 0 C--N 1.341 0.807 0 CA-C-O 118.598 -1.112 . . . . 0.0 114.53 169.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.64 -13.88 55.7 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.913 1.857 . . . . 0.0 113.947 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.744 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -106.37 -19.18 13.77 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.464 1.105 . . . . 0.0 113.106 167.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.472 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.5 ttt -72.65 -57.97 3.72 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.322 1.849 . . . . 0.0 111.196 -175.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.479 ' C ' HD22 ' A' ' 11' ' ' LEU . 9.0 pttp -77.08 15.71 0.66 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.691 1.196 . . . . 0.0 113.046 -174.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.479 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -126.27 -40.91 1.94 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 129.473 3.109 . . . . 0.0 110.899 -170.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 pt -61.68 -37.85 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 118.776 0.717 . . . . 0.0 111.356 -178.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.94 -16.47 50.4 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -98.25 -16.15 19.54 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 126.452 1.901 . . . . 0.0 112.016 -168.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -99.09 -43.5 11.55 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 C-N-CA 124.737 1.215 . . . . 0.0 109.379 167.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.65 -32.09 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 119.818 1.19 . . . . 0.0 111.139 -175.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -77.99 -3.92 44.43 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 121.453 -0.779 . . . . 0.0 112.92 174.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -105.33 -16.24 14.81 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.721 1.608 . . . . 0.0 112.551 -176.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -101.31 -97.48 0.27 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.713 0.688 . . . . 0.0 112.393 -169.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -137.01 87.8 2.31 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.391 1.077 . . . . 0.0 110.13 -177.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -59.79 -17.51 36.18 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.651 1.18 . . . . 0.0 114.163 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -93.87 -2.55 53.23 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.431 1.892 . . . . 0.0 114.595 171.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -142.57 63.94 15.06 Favored Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 127.755 2.422 . . . . 0.0 110.45 174.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -71.21 160.38 49.15 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.274 2.65 . . . . 0.0 112.743 -165.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -74.53 -178.59 3.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.998 0.919 . . . . 0.0 111.066 164.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.484 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 46.5 p -142.84 172.93 12.02 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.387 1.475 . . . . 0.0 109.96 172.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -55.11 -33.53 62.92 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.83 1.418 . . . . 0.0 114.83 -174.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.8 tp60 -67.2 -51.03 58.42 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 120.159 -1.588 . . . . 0.0 110.661 169.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.484 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.3 mm-40 -62.39 -50.56 71.04 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 120.959 -1.088 . . . . 0.0 111.949 -173.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 pt -58.97 -37.82 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.455 1.025 . . . . 0.0 112.424 174.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.86 -34.94 78.42 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.307 0.958 . . . . 0.0 112.047 177.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -69.1 -52.0 32.81 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.413 1.085 . . . . 0.0 112.659 -178.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -63.95 -32.88 58.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 O-C-N 121.413 -0.804 . . . . 0.0 111.4 -177.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.74 -22.89 67.14 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.28 1.432 . . . . 0.0 112.736 175.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.7 ptmt -81.31 -14.62 57.14 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.663 -0.648 . . . . 0.0 112.736 175.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -85.93 -14.02 46.0 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.305 0.642 . . . . 0.0 111.969 -178.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.1 ptpt -126.66 -22.23 3.95 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -171.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.95 1.99 0.07 OUTLIER Glycine 0 N--CA 1.47 0.961 0 N-CA-C 115.82 1.088 . . . . 0.0 115.82 151.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -87.82 -27.19 22.42 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.314 1.057 . . . . 0.0 112.839 -168.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.0 ptmt 30.49 40.51 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 130.101 3.36 . . . . 0.0 114.253 -173.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.629 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -82.51 141.43 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -82.35 166.35 19.54 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 127.433 2.293 . . . . 0.0 112.449 176.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -64.56 -24.87 67.74 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.309 1.444 . . . . 0.0 114.587 -174.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -70.28 -39.03 75.16 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.16 -0.963 . . . . 0.0 111.948 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.1 m -78.74 -45.82 20.3 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 126.588 1.955 . . . . 0.0 109.003 -175.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.47 -32.5 58.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.093 -176.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.2 -35.92 74.25 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.595 1.558 . . . . 0.0 111.949 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.0 mttm -78.54 -18.95 53.94 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.592 1.157 . . . . 0.0 112.41 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -82.01 -48.44 11.43 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.46 1.104 . . . . 0.0 112.616 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.05 -20.76 10.26 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 175.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -68.54 -46.6 69.1 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.76 1.224 . . . . 0.0 112.822 173.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -82.87 -27.14 30.97 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -173.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.472 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.3 mt -70.61 -59.77 2.64 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.476 1.11 . . . . 0.0 111.724 176.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.59 6.04 0.03 OUTLIER Glycine 0 CA--C 1.535 1.305 0 N-CA-C 118.714 2.246 . . . . 0.0 118.714 169.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.8 mt -90.15 126.58 56.53 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 119.898 1.849 . . . . 0.0 111.157 -173.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.48 -52.04 0.29 Allowed 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.447 2.765 . . . . 0.0 111.034 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.1 p -160.68 -10.68 0.05 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.386 1.624 . . . . 0.0 115.386 161.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.6 m 64.63 -19.5 0.08 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 128.059 2.544 . . . . 0.0 115.731 -166.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.8 ttp180 -69.13 -36.94 78.03 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.626 1.171 . . . . 0.0 109.373 171.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -24.71 33.25 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.555 1.142 . . . . 0.0 113.576 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -74.01 -40.07 63.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.212 1.405 . . . . 0.0 112.704 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -63.69 -63.48 1.16 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 126.053 1.741 . . . . 0.0 112.277 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.6 tp . . . . . 0 C--O 1.253 1.267 0 C-N-CA 126.729 2.012 . . . . 0.0 114.357 -167.715 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.796 HD12 HD23 ' A' ' 8' ' ' LEU . 34.2 mt . . . . . 0 CA--C 1.54 0.558 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.7 p -75.15 -167.33 0.6 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.196 1.799 . . . . 0.0 113.004 -177.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -48.75 -24.68 1.49 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.638 1.575 . . . . 0.0 114.697 173.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.69 44.72 0.11 Allowed Glycine 0 C--N 1.341 0.857 0 CA-C-O 117.874 -1.514 . . . . 0.0 115.745 170.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -61.87 -13.98 29.49 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.612 2.206 . . . . 0.0 113.487 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.796 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -112.33 -17.55 12.7 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.969 1.308 . . . . 0.0 113.228 168.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.416 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.5 ttt -72.0 -60.54 2.18 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.198 1.399 . . . . 0.0 111.166 -176.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.458 ' C ' HD22 ' A' ' 11' ' ' LEU . 16.3 pttt -75.17 18.86 0.17 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.378 1.071 . . . . 0.0 113.624 -174.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.458 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -126.22 -43.77 1.77 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 129.318 3.047 . . . . 0.0 110.168 -171.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.5 pt -63.19 -32.02 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 118.268 0.486 . . . . 0.0 112.078 -173.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.46 -14.85 23.39 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -89.86 -14.28 34.67 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.785 2.034 . . . . 0.0 111.673 -176.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -105.47 -52.38 7.54 Favored 'Isoleucine or valine' 0 C--N 1.341 0.214 0 C-N-CA 124.34 1.056 . . . . 0.0 108.72 167.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.77 -36.88 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 120.608 1.549 . . . . 0.0 111.382 -170.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -87.24 9.28 20.72 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -116.96 -24.35 7.64 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.028 1.731 . . . . 0.0 112.99 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -85.6 -79.32 0.24 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.415 1.086 . . . . 0.0 111.282 -171.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -139.2 86.7 2.15 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.561 1.144 . . . . 0.0 110.747 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -59.68 -19.37 49.15 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.278 1.031 . . . . 0.0 113.615 170.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -16.94 39.03 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 127.217 2.207 . . . . 0.0 114.654 171.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -148.21 72.76 11.07 Favored Pre-proline 0 N--CA 1.481 1.116 0 C-N-CA 127.175 2.19 . . . . 0.0 110.386 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -72.75 168.35 24.79 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.054 2.503 . . . . 0.0 113.236 -170.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -78.93 -173.81 3.71 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.212 1.405 . . . . 0.0 110.629 166.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.485 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 91.1 p -133.93 172.54 12.67 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.898 1.679 . . . . 0.0 109.284 171.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -65.76 -23.52 66.75 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.292 -0.88 . . . . 0.0 112.453 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -68.74 -54.15 17.74 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.418 -1.426 . . . . 0.0 110.665 165.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.485 ' HB2' ' H ' ' A' ' 26' ' ' SER . 19.5 mm-40 -61.96 -48.0 82.32 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 120.843 -1.161 . . . . 0.0 112.606 -174.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 pt -60.83 -38.61 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-N 119.544 1.066 . . . . 0.0 112.207 173.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.74 -34.48 75.9 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.631 1.105 . . . . 0.0 111.712 177.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -67.81 -55.44 12.98 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.676 1.191 . . . . 0.0 112.886 178.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.447 HG22 ' HE2' ' A' ' 37' ' ' LYS . 1.9 mt -64.83 -32.54 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 O-C-N 121.463 -0.773 . . . . 0.0 111.167 -176.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.3 -22.64 66.2 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.74 1.216 . . . . 0.0 112.214 176.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 pttm -81.86 -13.03 58.17 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 175.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -90.01 -9.28 49.21 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.503 0.721 . . . . 0.0 112.191 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.447 ' HE2' HG22 ' A' ' 33' ' ' ILE . 23.6 pttt -127.61 -23.3 3.47 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 114.862 1.431 . . . . 0.0 114.862 -176.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 154.35 4.53 0.11 Allowed Glycine 0 N--CA 1.471 1.033 0 CA-C-N 119.377 0.99 . . . . 0.0 115.418 151.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.48 ' HB3' HD11 ' A' ' 3' ' ' LEU . 45.2 m-85 -84.46 -31.35 24.61 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 118.148 0.974 . . . . 0.0 111.943 -171.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.1 ptmt 26.11 50.7 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 129.802 3.241 . . . . 0.0 113.01 -172.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.694 HG21 HD22 ' A' ' 8' ' ' LEU . 4.8 p -88.12 140.62 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.648 1.579 . . . . 0.0 108.77 171.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.6 165.33 17.13 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 129.025 2.93 . . . . 0.0 113.309 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -25.62 68.08 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.471 1.908 . . . . 0.0 114.65 -175.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -34.45 75.93 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.823 1.249 . . . . 0.0 110.785 -178.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 m -87.18 -47.05 9.19 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 127.407 2.283 . . . . 0.0 110.509 -176.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.23 -28.7 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.875 -173.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.95 -37.23 72.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.176 1.79 . . . . 0.0 113.129 174.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -70.54 -23.65 62.66 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.262 1.025 . . . . 0.0 112.281 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -80.5 -40.72 25.56 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -175.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -55.4 -25.15 34.07 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 118.943 0.792 . . . . 0.0 112.629 174.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -70.15 -38.13 75.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 176.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.5 ptp -81.09 -26.66 36.07 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.416 HD21 ' HG3' ' A' ' 9' ' ' MET . 2.1 mt -73.61 -59.76 2.56 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.345 1.058 . . . . 0.0 111.758 172.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 156.12 15.03 0.05 OUTLIER Glycine 0 CA--C 1.536 1.344 0 N-CA-C 117.648 1.819 . . . . 0.0 117.648 167.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.1 mt -117.49 133.23 23.27 Favored Pre-proline 0 CA--C 1.548 0.874 0 CA-C-N 119.2 1.5 . . . . 0.0 111.328 -167.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -71.74 -52.83 0.19 Allowed 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.926 3.084 . . . . 0.0 113.793 -177.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.9 p -156.35 -9.2 0.1 Allowed 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.6 m 61.78 -13.97 0.05 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.144 2.178 . . . . 0.0 115.568 -166.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -85.23 -36.69 20.79 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.753 1.621 . . . . 0.0 110.476 176.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -20.23 57.7 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 177.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 64.4 mtp85 -70.43 -42.2 71.89 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.047 1.739 . . . . 0.0 111.977 167.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -70.65 -59.17 2.98 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.392 1.877 . . . . 0.0 113.224 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.9 tp . . . . . 0 C--O 1.255 1.355 0 C-N-CA 126.593 1.957 . . . . 0.0 114.595 -166.816 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.78 HD12 HD23 ' A' ' 8' ' ' LEU . 39.1 mt . . . . . 0 CA--C 1.54 0.594 0 N-CA-C 116.605 2.076 . . . . 0.0 116.605 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.9 p -72.34 -168.11 0.39 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.102 1.761 . . . . 0.0 112.7 -178.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -48.7 -24.4 1.37 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.446 1.498 . . . . 0.0 114.72 172.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.54 41.18 0.11 Allowed Glycine 0 CA--C 1.527 0.817 0 CA-C-O 117.75 -1.583 . . . . 0.0 115.769 173.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -62.63 -13.01 26.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 121.25 2.525 . . . . 0.0 113.871 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.797 HD22 HG21 ' A' ' 41' ' ' VAL . 1.8 pp -109.35 -17.39 13.81 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.692 1.197 . . . . 0.0 113.627 167.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.6 ttt -67.7 -66.01 0.62 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.948 1.299 . . . . 0.0 109.982 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.542 ' C ' HD22 ' A' ' 11' ' ' LEU . 4.3 pttp -74.43 17.17 0.21 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.207 1.403 . . . . 0.0 113.829 -172.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.542 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -130.03 -34.34 1.69 Allowed 'General case' 0 C--O 1.234 0.289 0 C-N-CA 129.082 2.953 . . . . 0.0 111.946 -172.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -62.8 -34.15 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 119.689 1.131 . . . . 0.0 111.656 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -9.93 41.88 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -178.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -91.13 -15.99 28.52 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.559 1.943 . . . . 0.0 111.943 -175.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -105.03 -47.93 9.4 Favored 'Isoleucine or valine' 0 C--N 1.342 0.252 0 C-N-CA 124.621 1.168 . . . . 0.0 109.337 168.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 63.6 t -66.56 -35.6 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 119.982 1.265 . . . . 0.0 111.249 -172.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -78.84 -0.59 31.23 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.561 -0.712 . . . . 0.0 112.612 176.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -109.65 -13.15 14.56 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.593 1.957 . . . . 0.0 113.544 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -101.92 -89.55 0.36 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.537 0.735 . . . . 0.0 112.531 -170.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -135.67 91.24 2.69 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 122.433 1.111 . . . . 0.0 112.371 -173.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -53.53 -30.98 44.35 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.61 1.564 . . . . 0.0 113.389 170.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.42 -8.69 49.92 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.613 1.965 . . . . 0.0 114.986 177.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -145.49 76.84 12.91 Favored Pre-proline 0 N--CA 1.481 1.114 0 C-N-CA 126.681 1.992 . . . . 0.0 110.345 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -72.02 164.43 35.69 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.796 2.331 . . . . 0.0 112.643 -172.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -78.69 -174.79 4.07 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.488 1.115 . . . . 0.0 110.91 166.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.485 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 81.2 p -136.88 169.87 17.03 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.127 1.771 . . . . 0.0 109.949 172.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.4 p30 -53.06 -33.77 53.48 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 176.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -68.16 -53.56 24.24 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 119.982 -1.698 . . . . 0.0 110.678 169.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.485 ' HB2' ' H ' ' A' ' 26' ' ' SER . 20.3 mm-40 -61.34 -49.12 78.26 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 120.929 -1.107 . . . . 0.0 112.504 -174.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.0 pt -59.64 -38.26 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-N 119.574 1.079 . . . . 0.0 112.222 174.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.94 -35.54 78.74 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.625 1.102 . . . . 0.0 111.829 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -69.26 -53.14 21.31 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.566 1.146 . . . . 0.0 112.656 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.437 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.4 mt -64.36 -32.74 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.112 0.869 . . . . 0.0 111.53 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 mp -63.11 -22.03 66.59 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.78 1.232 . . . . 0.0 112.181 176.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.3 pttt -79.43 -16.03 56.83 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 174.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -89.57 -11.22 43.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.945 0.898 . . . . 0.0 112.146 -176.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.437 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.0 ptpt -126.8 -22.32 3.89 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -173.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.46 0.92 0.06 OUTLIER Glycine 0 N--CA 1.472 1.043 0 N-CA-C 116.215 1.246 . . . . 0.0 116.215 153.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.432 ' HB3' HD11 ' A' ' 3' ' ' LEU . 48.2 m-85 -91.45 -30.97 16.18 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.76 1.28 . . . . 0.0 113.159 -166.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt 26.66 50.05 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 129.391 3.076 . . . . 0.0 113.081 -170.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.797 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -86.7 138.45 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.729 1.612 . . . . 0.0 108.849 174.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.54 161.91 26.69 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 128.344 2.658 . . . . 0.0 112.16 177.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -59.44 -27.58 66.2 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.409 1.483 . . . . 0.0 113.513 179.226 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -66.53 -34.29 77.59 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.405 1.482 . . . . 0.0 111.167 -174.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.0 m -87.1 -48.85 7.73 Favored 'General case' 0 CA--C 1.509 -0.601 0 C-N-CA 128.346 2.658 . . . . 0.0 110.397 -178.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.44 -29.45 46.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.994 -172.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.04 -42.8 80.01 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 125.608 1.563 . . . . 0.0 111.175 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -70.24 -19.61 63.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.775 1.23 . . . . 0.0 112.406 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -87.94 -46.7 9.16 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.634 1.174 . . . . 0.0 113.264 -177.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -22.81 40.94 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.389 0.995 . . . . 0.0 112.557 172.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -72.22 -42.31 65.88 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.661 1.185 . . . . 0.0 112.739 172.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.2 ptm -83.35 -30.14 27.69 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.829 0.852 . . . . 0.0 113.107 -173.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.9 mp -67.65 -67.82 0.43 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.665 1.186 . . . . 0.0 111.061 173.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.18 6.46 0.03 OUTLIER Glycine 0 CA--C 1.536 1.356 0 N-CA-C 118.427 2.131 . . . . 0.0 118.427 172.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.1 mt -84.74 125.42 71.15 Favored Pre-proline 0 CA--C 1.545 0.784 0 CA-C-N 119.87 1.835 . . . . 0.0 110.838 -177.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.6 -53.35 0.36 Allowed 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.923 2.416 . . . . 0.0 110.642 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 82.7 p -161.11 -10.82 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.484 1.514 . . . . 0.0 114.988 162.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.9 m 62.36 -19.71 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.38 2.672 . . . . 0.0 115.752 -165.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -67.75 -44.43 77.53 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.584 1.554 . . . . 0.0 108.688 169.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -22.85 59.24 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -178.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -73.75 -42.3 61.28 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.426 1.49 . . . . 0.0 111.821 170.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -73.61 -58.89 2.99 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.841 1.656 . . . . 0.0 113.036 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.253 1.26 0 C-N-CA 126.127 1.771 . . . . 0.0 114.459 -167.707 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.76 HD12 HD23 ' A' ' 8' ' ' LEU . 15.5 mt . . . . . 0 CA--C 1.54 0.586 0 CA-C-O 122.134 0.969 . . . . 0.0 113.599 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.7 p -73.47 -169.31 0.65 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.705 1.202 . . . . 0.0 112.513 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -48.91 -24.66 1.56 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.554 1.542 . . . . 0.0 114.699 172.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.28 44.21 0.16 Allowed Glycine 0 C--N 1.341 0.841 0 CA-C-O 117.953 -1.471 . . . . 0.0 115.864 172.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -61.41 -14.92 31.91 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.7 2.25 . . . . 0.0 113.47 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.76 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -109.97 -17.21 13.66 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.716 1.206 . . . . 0.0 112.814 169.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.465 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.2 ttt -74.05 -59.17 2.84 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.914 1.686 . . . . 0.0 111.517 -175.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.486 ' C ' HD22 ' A' ' 11' ' ' LEU . 19.4 pttt -76.86 19.26 0.3 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.91 1.284 . . . . 0.0 112.918 -174.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.486 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -128.45 -41.33 1.55 Allowed 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 129.716 3.207 . . . . 0.0 110.574 -170.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 pt -61.33 -37.75 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 118.69 0.677 . . . . 0.0 111.274 -177.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.42 -14.01 44.57 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.715 1.005 . . . . 0.0 113.715 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.7 tp10 -95.21 -19.96 19.62 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 125.972 1.709 . . . . 0.0 111.761 -170.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -98.61 -46.53 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 C-N-CA 124.813 1.245 . . . . 0.0 109.149 169.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.81 -35.44 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.593 1.088 . . . . 0.0 111.324 -173.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -79.01 -2.64 41.24 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 177.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -104.85 -17.64 14.5 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.204 1.801 . . . . 0.0 112.87 -176.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -97.32 -91.73 0.25 Allowed 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.577 0.751 . . . . 0.0 112.256 -169.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -137.18 89.26 2.42 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 125.064 1.346 . . . . 0.0 110.218 177.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.3 mtmm -59.12 -18.81 39.06 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.62 1.168 . . . . 0.0 112.754 167.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -21.47 61.57 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 127.436 2.295 . . . . 0.0 114.051 169.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.5 mtmt -148.73 74.66 10.29 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 127.819 2.448 . . . . 0.0 109.747 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -68.75 161.56 44.89 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.09 2.526 . . . . 0.0 113.011 -169.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -76.5 -172.73 2.27 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.714 1.206 . . . . 0.0 110.671 167.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.432 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 59.7 p -136.78 167.51 21.3 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 126.316 1.847 . . . . 0.0 109.457 176.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 51.3 p30 -54.66 -30.96 56.83 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 175.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -68.17 -54.45 17.88 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.0 -1.688 . . . . 0.0 110.702 168.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.432 ' HB2' ' H ' ' A' ' 26' ' ' SER . 40.0 mt-10 -62.71 -47.78 82.13 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 120.659 -1.275 . . . . 0.0 112.757 -173.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.1 pt -59.27 -38.24 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-N 119.518 1.053 . . . . 0.0 112.142 173.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.8 -35.46 79.93 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.647 1.112 . . . . 0.0 112.138 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -67.31 -53.11 32.66 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.651 1.18 . . . . 0.0 112.952 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.478 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -64.74 -32.42 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 O-C-N 121.567 -0.708 . . . . 0.0 111.657 -176.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.29 -22.36 66.82 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 125.174 1.39 . . . . 0.0 112.149 175.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -81.28 -14.6 57.23 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 175.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -87.57 -11.51 48.47 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.562 0.745 . . . . 0.0 111.992 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.478 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.1 ptpt -127.49 -22.73 3.6 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -173.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.45 0.5 0.07 OUTLIER Glycine 0 N--CA 1.47 0.931 0 N-CA-C 115.93 1.132 . . . . 0.0 115.93 152.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -89.48 -29.4 19.0 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.426 1.113 . . . . 0.0 112.694 -167.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt 29.03 43.37 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 130.243 3.417 . . . . 0.0 114.181 -173.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.569 HG21 HD22 ' A' ' 8' ' ' LEU . 3.3 p -83.4 144.24 10.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.092 0.957 . . . . 0.0 109.132 175.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.45 165.5 14.29 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.307 2.643 . . . . 0.0 112.806 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.01 -29.5 69.74 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.494 1.518 . . . . 0.0 114.254 -175.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -68.42 -32.11 71.92 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.188 0.904 . . . . 0.0 111.747 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.402 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 2.1 m -84.15 -48.16 10.12 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 127.913 2.485 . . . . 0.0 110.174 -177.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.9 -28.98 44.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.641 -173.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.56 -33.4 72.7 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.804 1.642 . . . . 0.0 111.921 176.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -72.74 -22.5 60.85 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.734 0.814 . . . . 0.0 112.693 174.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -83.49 -44.17 14.99 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.514 0.726 . . . . 0.0 112.909 -174.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.17 -30.65 7.1 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 118.785 0.72 . . . . 0.0 112.926 172.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -72.64 -33.07 66.36 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.195 0.998 . . . . 0.0 112.853 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 23.6 ptt? -94.37 -22.74 18.13 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.861 1.059 . . . . 0.0 113.861 -176.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.465 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.2 mt -72.92 -63.64 1.13 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.148 0.979 . . . . 0.0 111.374 170.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 165.93 -2.78 0.05 OUTLIER Glycine 0 CA--C 1.536 1.349 0 N-CA-C 117.675 1.83 . . . . 0.0 117.675 169.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.8 mt -72.63 128.06 88.98 Favored Pre-proline 0 CA--C 1.547 0.861 0 CA-C-N 119.127 1.463 . . . . 0.0 111.074 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.73 -64.42 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 123.459 2.773 . . . . 0.0 109.887 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 77.2 p -149.04 -10.41 0.33 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.1 1.36 . . . . 0.0 114.58 164.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.9 m 59.24 -14.58 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 128.436 2.694 . . . . 0.0 116.259 -165.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -67.39 -45.21 76.87 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.421 1.489 . . . . 0.0 108.76 165.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -22.34 59.25 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -177.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -73.99 -41.93 61.19 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.543 1.537 . . . . 0.0 111.76 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -73.58 -58.38 3.35 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.441 1.496 . . . . 0.0 113.192 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.253 1.264 0 C-N-CA 126.622 1.969 . . . . 0.0 114.479 -168.031 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.831 HD12 HD23 ' A' ' 8' ' ' LEU . 33.1 mt . . . . . 0 CA--C 1.541 0.602 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.3 p -73.97 -169.24 0.72 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.625 1.57 . . . . 0.0 112.645 177.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -49.19 -24.88 1.91 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.78 1.632 . . . . 0.0 114.626 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.63 45.76 0.12 Allowed Glycine 0 C--N 1.34 0.8 0 CA-C-O 118.174 -1.348 . . . . 0.0 114.833 171.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.36 -19.85 38.82 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 120.038 1.919 . . . . 0.0 113.552 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.831 HD23 HD12 ' A' ' 3' ' ' LEU . 1.8 pp -108.67 -17.63 13.91 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.146 1.378 . . . . 0.0 112.761 171.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.501 ' HG3' HD21 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -73.18 -57.33 4.1 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 126.09 1.756 . . . . 0.0 111.48 -175.512 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.484 ' C ' HD22 ' A' ' 11' ' ' LEU . 8.3 pttp -76.0 15.68 0.51 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.733 1.213 . . . . 0.0 113.161 -174.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.484 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.1 mm? -126.32 -42.03 1.86 Allowed 'General case' 0 C--O 1.233 0.203 0 C-N-CA 129.753 3.221 . . . . 0.0 110.436 -170.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.4 pt -62.99 -35.88 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-N 118.658 0.663 . . . . 0.0 111.679 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.07 -19.04 41.05 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 178.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -94.95 -17.47 21.94 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 127.091 2.156 . . . . 0.0 111.919 -168.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -100.8 -51.16 9.87 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 C-N-CA 123.955 0.902 . . . . 0.0 108.746 167.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 93.7 t -63.87 -39.11 84.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 119.81 1.186 . . . . 0.0 111.181 -170.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -82.39 3.74 26.82 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 120.076 -0.65 . . . . 0.0 112.273 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.67 -11.39 9.42 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.312 1.845 . . . . 0.0 114.17 -177.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -91.15 -86.95 0.21 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.243 1.017 . . . . 0.0 111.621 -176.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -131.99 96.66 3.96 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 122.53 1.157 . . . . 0.0 112.243 178.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -57.81 -15.72 9.18 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.273 1.429 . . . . 0.0 113.939 171.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -102.06 -10.2 19.92 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.921 2.088 . . . . 0.0 113.747 173.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -140.6 76.09 25.14 Favored Pre-proline 0 N--CA 1.483 1.195 0 C-N-CA 125.773 1.629 . . . . 0.0 111.076 172.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.51 161.9 44.38 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.254 2.636 . . . . 0.0 112.445 -176.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -81.89 -178.01 6.82 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.642 1.177 . . . . 0.0 111.255 169.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.471 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 93.2 p -131.18 169.01 16.5 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.889 1.676 . . . . 0.0 109.866 173.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -54.33 -31.96 55.55 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 174.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -68.83 -53.82 19.29 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.001 -1.687 . . . . 0.0 110.988 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.471 ' HB2' ' H ' ' A' ' 26' ' ' SER . 43.6 mt-10 -61.81 -47.64 84.19 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 120.578 -1.326 . . . . 0.0 112.597 -174.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.5 pt -59.98 -38.38 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 119.657 1.117 . . . . 0.0 112.06 173.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.89 -34.52 76.18 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.433 1.015 . . . . 0.0 112.197 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -68.16 -54.39 18.33 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.65 1.18 . . . . 0.0 112.771 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.462 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.0 mt -63.37 -33.46 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 121.496 -0.753 . . . . 0.0 111.509 -176.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.88 -23.03 67.19 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.499 1.52 . . . . 0.0 112.332 176.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -80.95 -15.46 56.2 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -84.39 -13.59 51.77 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.505 0.722 . . . . 0.0 112.179 -178.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.462 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.2 ptpt -127.0 -23.51 3.61 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.342 1.608 . . . . 0.0 115.342 -171.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.63 1.7 0.07 OUTLIER Glycine 0 N--CA 1.471 0.975 0 N-CA-C 115.752 1.061 . . . . 0.0 115.752 152.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -87.42 -30.7 20.52 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.412 1.106 . . . . 0.0 112.676 -169.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ptmt 29.01 44.81 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 129.947 3.299 . . . . 0.0 113.921 -171.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.558 HG21 HD22 ' A' ' 8' ' ' LEU . 2.7 p -82.08 140.46 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.078 1.351 . . . . 0.0 109.002 176.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.98 165.23 20.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.355 2.262 . . . . 0.0 112.328 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -25.75 68.4 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.267 1.427 . . . . 0.0 113.904 -177.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -67.3 -36.35 81.33 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.165 0.986 . . . . 0.0 111.516 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.1 m -84.89 -48.91 8.85 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 127.481 2.312 . . . . 0.0 109.4 -175.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.91 -30.05 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.27 -174.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.11 -48.88 72.09 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.105 1.362 . . . . 0.0 110.727 176.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -69.22 -16.26 63.56 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.522 0.729 . . . . 0.0 112.938 -178.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -81.54 -47.53 12.97 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.985 0.914 . . . . 0.0 112.158 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.9 ptp180 -56.27 -23.08 34.11 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 119.066 0.848 . . . . 0.0 113.081 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -66.85 -47.46 71.87 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.723 1.209 . . . . 0.0 112.654 174.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -84.65 -25.33 28.57 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -171.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.501 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.4 mt -71.0 -59.57 2.71 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.325 1.05 . . . . 0.0 111.868 175.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 167.42 8.6 0.03 OUTLIER Glycine 0 CA--C 1.534 1.262 0 N-CA-C 118.192 2.037 . . . . 0.0 118.192 171.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.8 mt -96.38 130.34 31.07 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 119.938 1.869 . . . . 0.0 110.928 -175.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -69.98 -58.7 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.669 2.912 . . . . 0.0 111.233 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.2 p -155.5 -4.13 0.13 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.722 1.609 . . . . 0.0 114.715 168.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 83.4 p 59.23 -10.6 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.785 2.834 . . . . 0.0 116.217 -168.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -82.17 -30.92 30.73 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 120.521 1.51 . . . . 0.0 111.057 172.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -23.73 59.07 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 174.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -72.95 -37.33 67.16 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.941 1.296 . . . . 0.0 112.417 170.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -72.85 -59.67 2.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.137 1.775 . . . . 0.0 112.88 179.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.7 tp . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.668 1.587 . . . . 0.0 114.415 -167.315 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.763 HD12 HD23 ' A' ' 8' ' ' LEU . 30.6 mt . . . . . 0 CA--C 1.541 0.625 0 CA-C-O 121.579 0.704 . . . . 0.0 112.468 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.5 p -71.53 -169.86 0.47 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.796 1.238 . . . . 0.0 112.502 175.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -48.7 -24.68 1.46 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.718 1.607 . . . . 0.0 114.655 173.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.2 45.83 0.11 Allowed Glycine 0 C--N 1.341 0.82 0 CA-C-O 117.954 -1.47 . . . . 0.0 115.205 170.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.59 -17.4 32.69 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.623 2.212 . . . . 0.0 113.425 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.763 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -107.85 -20.06 13.32 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.526 1.13 . . . . 0.0 112.635 171.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.402 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.5 ttt -68.79 -62.66 1.29 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 126.134 1.774 . . . . 0.0 110.718 -178.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.516 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.2 pttp -76.67 16.36 0.52 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.098 1.359 . . . . 0.0 113.675 -171.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.516 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -127.46 -39.67 1.84 Allowed 'General case' 0 C--O 1.233 0.214 0 C-N-CA 129.375 3.07 . . . . 0.0 110.745 -171.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pt -63.07 -36.8 77.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.947 0.794 . . . . 0.0 111.447 -176.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 -16.03 44.89 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -179.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -97.57 -17.06 19.77 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 127.828 2.451 . . . . 0.0 111.773 -167.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.0 pp -101.42 -46.51 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 C-N-CA 124.981 1.312 . . . . 0.0 109.762 167.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.6 t -62.81 -42.78 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-N 119.463 1.028 . . . . 0.0 110.471 -174.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -81.41 0.19 38.64 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.659 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -96.22 -21.49 17.84 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.22 1.408 . . . . 0.0 112.622 175.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -91.8 -84.64 0.26 Allowed 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.504 1.122 . . . . 0.0 112.005 -172.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -140.1 92.42 2.54 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.573 1.149 . . . . 0.0 110.465 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -53.13 -27.76 22.44 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 160.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -22.59 63.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.611 2.765 . . . . 0.0 114.208 173.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -148.11 73.36 11.11 Favored Pre-proline 0 N--CA 1.478 0.937 0 C-N-CA 127.398 2.279 . . . . 0.0 109.878 -174.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -69.26 155.96 66.06 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.848 2.365 . . . . 0.0 112.402 -168.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -78.96 172.25 14.06 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.639 0.733 . . . . 0.0 110.423 165.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.461 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 57.5 p -129.09 169.01 15.26 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.491 1.516 . . . . 0.0 110.008 179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.0 p30 -53.29 -34.15 56.14 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 178.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -67.64 -53.84 24.61 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 119.716 -1.865 . . . . 0.0 110.8 168.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.461 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.6 mm-40 -61.33 -49.66 76.08 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 120.807 -1.183 . . . . 0.0 112.558 -173.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.3 pt -59.22 -38.61 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-N 119.593 1.088 . . . . 0.0 112.28 173.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.92 -34.42 76.04 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.527 1.058 . . . . 0.0 112.01 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -68.36 -55.28 12.55 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.415 1.086 . . . . 0.0 112.826 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.471 HG22 ' HE2' ' A' ' 37' ' ' LYS . 1.5 mp -63.8 -33.03 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-N 118.826 0.739 . . . . 0.0 111.201 -176.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mp -61.01 -26.37 67.56 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.048 1.339 . . . . 0.0 112.629 176.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -78.89 -13.66 59.67 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.648 0.779 . . . . 0.0 112.76 176.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -90.01 -9.6 48.04 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.553 0.741 . . . . 0.0 112.341 -177.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.471 ' HE2' HG22 ' A' ' 33' ' ' ILE . 23.5 pttt -127.86 -22.62 3.5 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -175.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 153.56 5.14 0.11 Allowed Glycine 0 N--CA 1.47 0.902 0 CA-C-N 119.65 1.114 . . . . 0.0 115.499 151.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -85.09 -20.73 29.91 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.023 0.912 . . . . 0.0 112.905 -171.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 36.52 28.38 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 130.603 3.561 . . . . 0.0 115.342 -177.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.539 HG21 HD22 ' A' ' 8' ' ' LEU . 4.1 p -84.79 139.84 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-O 121.441 0.638 . . . . 0.0 109.978 -171.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.73 164.31 19.68 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.641 2.376 . . . . 0.0 112.363 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -57.1 -36.62 70.84 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.6 1.16 . . . . 0.0 113.839 -176.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -37.99 86.09 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.56 0.695 . . . . 0.0 110.54 -172.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.423 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 3.2 m -79.04 -48.82 13.7 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 127.972 2.509 . . . . 0.0 109.957 -175.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.06 -29.69 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.823 -175.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.52 -38.53 80.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.828 1.651 . . . . 0.0 111.757 178.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -64.78 -32.35 74.0 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.601 0.76 . . . . 0.0 111.396 175.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -79.52 -48.79 13.27 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 118.555 -0.736 . . . . 0.0 112.195 -171.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -53.54 -32.31 50.05 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.253 0.933 . . . . 0.0 112.286 172.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -72.37 -36.46 68.74 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.564 0.746 . . . . 0.0 112.372 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.0 ptt? -85.79 -31.69 22.21 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -175.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.402 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.5 mp -67.1 -61.2 2.04 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.079 0.952 . . . . 0.0 111.312 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 174.29 -2.63 0.03 OUTLIER Glycine 0 CA--C 1.536 1.371 0 N-CA-C 117.763 1.865 . . . . 0.0 117.763 174.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.7 mt -77.23 131.98 71.15 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 119.476 1.638 . . . . 0.0 110.251 177.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.11 -65.28 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.181 2.587 . . . . 0.0 109.873 170.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.6 p -151.03 -2.48 0.34 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.01 1.724 . . . . 0.0 114.225 163.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.5 m 57.73 -8.59 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.79 2.836 . . . . 0.0 116.026 -167.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -73.28 -40.53 64.49 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.491 1.516 . . . . 0.0 108.854 174.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -78.94 -21.53 47.11 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -71.79 -41.93 67.71 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.867 0.867 . . . . 0.0 111.981 169.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -75.27 -59.97 2.51 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.063 1.345 . . . . 0.0 112.86 -176.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.254 1.33 0 C-N-CA 125.541 1.536 . . . . 0.0 114.553 -168.087 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.831 HD12 HD23 ' A' ' 8' ' ' LEU . 26.3 mt . . . . . 0 CA--C 1.534 0.354 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 48.2 p -70.28 -173.6 0.72 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.089 0.956 . . . . 0.0 112.148 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -43.06 -25.73 0.12 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.123 2.169 . . . . 0.0 115.897 170.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -172.58 40.44 0.16 Allowed Glycine 0 C--N 1.341 0.818 0 CA-C-O 117.747 -1.585 . . . . 0.0 115.657 170.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -64.5 -10.28 24.49 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 121.06 2.43 . . . . 0.0 114.127 -177.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.831 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -112.64 -15.33 13.03 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.751 1.22 . . . . 0.0 113.687 166.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.706 ' HG3' HD21 ' A' ' 53' ' ' LEU . 3.0 ttp -71.73 -61.72 1.68 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.96 1.304 . . . . 0.0 110.489 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.46 ' C ' HD22 ' A' ' 11' ' ' LEU . 8.7 pttp -73.62 16.37 0.21 Allowed 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -173.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.46 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -124.23 -46.11 1.94 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 129.632 3.173 . . . . 0.0 110.931 -171.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pp -63.98 -34.51 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.635 0.652 . . . . 0.0 112.166 -176.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.553 ' HG2' HD22 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -80.78 -17.12 51.93 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 175.715 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -94.68 -16.23 23.28 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.609 1.964 . . . . 0.0 111.81 -168.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.0 -46.25 9.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 C-N-CA 124.601 1.16 . . . . 0.0 109.381 169.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.1 -32.33 55.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 119.848 1.204 . . . . 0.0 111.367 -174.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -80.28 -0.95 38.76 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.495 -0.753 . . . . 0.0 112.583 175.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -110.05 -14.49 14.22 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.124 1.769 . . . . 0.0 113.07 -176.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -101.43 -96.58 0.27 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.052 0.842 . . . . 0.0 112.386 -169.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -136.74 88.33 2.36 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.886 1.274 . . . . 0.0 109.971 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -58.93 -20.46 52.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.543 0.737 . . . . 0.0 112.691 165.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -23.08 61.91 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 128.889 2.875 . . . . 0.0 114.208 169.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -148.45 69.7 10.49 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 127.649 2.379 . . . . 0.0 109.722 -174.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -72.35 165.54 32.36 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.934 2.423 . . . . 0.0 113.645 -163.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -76.02 -170.97 1.52 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.735 1.214 . . . . 0.0 111.045 165.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.459 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 60.3 p -141.47 169.02 18.4 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.726 2.01 . . . . 0.0 109.39 174.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -55.2 -32.32 62.13 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -66.5 -53.85 30.43 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 119.846 -1.784 . . . . 0.0 110.919 168.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.459 ' HB2' ' H ' ' A' ' 26' ' ' SER . 41.1 mt-10 -62.62 -49.02 76.85 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 120.661 -1.274 . . . . 0.0 112.758 -173.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.4 pt -59.34 -37.49 69.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-N 119.888 1.222 . . . . 0.0 112.212 173.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.35 -35.16 79.48 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.585 1.084 . . . . 0.0 112.456 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -68.41 -51.09 47.84 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.806 1.242 . . . . 0.0 113.015 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.403 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -63.6 -35.48 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 121.829 -0.544 . . . . 0.0 110.938 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.3 mp -62.58 -23.22 66.9 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.534 1.534 . . . . 0.0 112.643 176.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 pttm -78.02 -15.11 59.22 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -83.39 -19.96 35.06 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.458 0.703 . . . . 0.0 111.801 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.403 ' HE3' HG22 ' A' ' 33' ' ' ILE . 26.6 mmtt -89.3 -57.48 2.87 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.339 1.856 . . . . 0.0 108.735 -177.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 155.93 7.92 0.07 OUTLIER Glycine 0 CA--C 1.529 0.937 0 CA-C-N 114.185 -1.37 . . . . 0.0 114.152 173.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.406 ' HB3' HD11 ' A' ' 3' ' ' LEU . 48.6 m-85 -79.37 -24.42 42.67 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.492 1.146 . . . . 0.0 112.3 -175.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt 32.69 35.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 130.692 3.597 . . . . 0.0 114.586 -176.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.601 HG21 HD22 ' A' ' 8' ' ' LEU . 2.5 p -82.48 139.83 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -175.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.36 160.71 26.61 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.345 2.258 . . . . 0.0 112.22 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -34.9 64.48 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.726 1.211 . . . . 0.0 113.915 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.08 -31.49 72.39 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 118.735 0.698 . . . . 0.0 111.661 -173.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.8 m -83.86 -49.64 8.84 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 128.584 2.753 . . . . 0.0 109.745 -176.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.79 -26.9 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.193 -176.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.46 -36.16 76.32 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 126.718 2.007 . . . . 0.0 111.829 177.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -64.74 -39.04 92.96 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.982 -0.449 . . . . 0.0 111.626 172.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -73.47 -35.94 65.76 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -164.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.98 -30.84 6.51 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 170.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -71.11 -36.42 72.14 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.1 ptp -86.51 -20.62 27.78 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -175.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.706 HD21 ' HG3' ' A' ' 9' ' ' MET . 4.2 mt -86.45 -63.4 1.32 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.295 1.438 . . . . 0.0 111.623 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.92 -5.55 0.04 OUTLIER Glycine 0 CA--C 1.535 1.294 0 N-CA-C 117.851 1.901 . . . . 0.0 117.851 167.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.0 mt -76.73 122.7 86.99 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 119.329 1.564 . . . . 0.0 110.871 -176.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.23 -59.41 0.08 OUTLIER 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.556 2.838 . . . . 0.0 110.729 -178.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 83.2 p -146.24 -6.8 0.55 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.798 1.639 . . . . 0.0 113.884 159.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 85.1 p 60.45 -20.43 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 129.561 3.144 . . . . 0.0 116.17 -163.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -71.1 -43.6 67.36 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.801 1.64 . . . . 0.0 109.649 172.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -23.56 60.81 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.652 0.781 . . . . 0.0 112.768 -172.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -70.23 -46.29 64.76 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.989 1.716 . . . . 0.0 111.993 167.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -72.0 -58.98 2.99 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.188 1.795 . . . . 0.0 113.194 -174.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.833 2.053 . . . . 0.0 114.437 -167.602 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.732 HD12 HD23 ' A' ' 8' ' ' LEU . 36.1 mt . . . . . 0 CA--C 1.536 0.407 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 54.2 p -74.25 -168.03 0.6 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.821 1.648 . . . . 0.0 112.485 179.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -49.05 -25.7 2.19 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.204 1.402 . . . . 0.0 114.378 173.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.47 45.8 0.12 Allowed Glycine 0 C--N 1.34 0.776 0 CA-C-O 118.09 -1.394 . . . . 0.0 115.021 172.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -62.84 -15.77 55.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 120.504 2.152 . . . . 0.0 113.373 -178.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.732 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -108.16 -18.07 13.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.111 0.964 . . . . 0.0 112.832 169.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.516 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.2 ttp -70.07 -61.78 1.64 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.411 1.484 . . . . 0.0 110.749 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.458 ' C ' HD22 ' A' ' 11' ' ' LEU . 16.6 pttt -76.71 15.89 0.58 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.996 0.918 . . . . 0.0 113.385 -171.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.458 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -124.96 -43.4 1.98 Allowed 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 129.305 3.042 . . . . 0.0 110.631 -171.128 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.8 pt -58.48 -37.79 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-N 118.67 0.668 . . . . 0.0 111.553 -177.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.37 -18.53 41.7 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -105.92 -12.22 15.91 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.344 1.857 . . . . 0.0 112.738 -167.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -94.54 -48.2 13.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 124.472 1.109 . . . . 0.0 108.777 162.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 82.7 t -64.33 -37.51 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 O-C-N 120.7 -1.25 . . . . 0.0 111.167 -173.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -83.85 5.35 25.5 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 178.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -109.29 -22.9 11.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.501 1.52 . . . . 0.0 112.756 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -89.23 -85.59 0.2 Allowed 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.798 1.239 . . . . 0.0 111.665 -173.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -142.97 82.67 1.77 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.764 1.226 . . . . 0.0 110.81 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -60.22 -19.29 53.73 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 166.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -72.06 -28.3 63.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.981 2.512 . . . . 0.0 114.755 169.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.88 79.02 12.33 Favored Pre-proline 0 N--CA 1.482 1.174 0 C-N-CA 127.509 2.324 . . . . 0.0 109.6 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.37 168.29 25.15 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.881 3.054 . . . . 0.0 113.769 -167.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -81.1 -171.0 3.0 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.077 1.751 . . . . 0.0 111.704 168.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.478 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 70.0 p -139.4 173.38 11.6 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 127.61 2.364 . . . . 0.0 108.959 172.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -66.86 -27.18 67.32 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 120.182 1.355 . . . . 0.0 112.085 -175.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -65.67 -52.73 49.29 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 119.888 -1.757 . . . . 0.0 110.968 166.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.478 ' HB2' ' H ' ' A' ' 26' ' ' SER . 42.5 mt-10 -62.26 -48.46 79.83 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 120.623 -1.298 . . . . 0.0 112.372 -173.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.3 pt -59.92 -38.11 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.575 1.079 . . . . 0.0 112.104 173.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.02 -35.61 79.08 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.283 0.947 . . . . 0.0 111.881 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -68.3 -52.36 34.47 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.322 1.049 . . . . 0.0 112.816 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.464 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -64.84 -32.27 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 O-C-N 121.211 -0.93 . . . . 0.0 111.627 -178.042 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.45 -22.87 66.55 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.149 1.38 . . . . 0.0 112.369 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.1 pttt -79.86 -16.11 56.06 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 175.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -87.73 -12.26 45.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.887 0.875 . . . . 0.0 112.138 -176.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.464 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.7 ptpt -125.92 -21.73 4.3 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -174.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.6 1.07 0.08 OUTLIER Glycine 0 N--CA 1.471 0.976 0 N-CA-C 115.672 1.029 . . . . 0.0 115.672 151.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -86.75 -25.92 24.45 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.41 1.105 . . . . 0.0 113.036 -168.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.6 ptmt 30.56 40.45 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 130.371 3.468 . . . . 0.0 114.474 -173.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.566 HG21 HD22 ' A' ' 8' ' ' LEU . 4.0 p -84.3 156.71 3.62 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 124.489 1.116 . . . . 0.0 109.099 175.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -109.04 169.81 8.45 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.662 2.785 . . . . 0.0 112.646 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -59.17 -32.87 70.3 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.028 1.331 . . . . 0.0 114.079 -172.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -37.53 87.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.022 0.529 . . . . 0.0 110.2 -174.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.0 m -84.31 -44.09 14.15 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 126.584 1.954 . . . . 0.0 109.941 -174.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.91 -31.18 52.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.328 -178.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.13 -36.24 72.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.815 1.646 . . . . 0.0 112.789 174.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -65.77 -27.77 68.54 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.422 0.689 . . . . 0.0 112.097 172.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -84.2 -53.69 5.33 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 124.058 0.943 . . . . 0.0 111.778 -175.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.21 -26.82 19.0 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 118.837 0.744 . . . . 0.0 112.851 174.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.3 -39.78 89.56 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.943 0.897 . . . . 0.0 113.082 175.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -92.41 -22.15 19.81 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -174.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.516 HD21 ' HG3' ' A' ' 9' ' ' MET . 0.8 OUTLIER -71.86 -65.16 0.8 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.49 1.116 . . . . 0.0 111.761 172.223 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 173.53 15.98 0.02 OUTLIER Glycine 0 CA--C 1.535 1.327 0 N-CA-C 118.024 1.97 . . . . 0.0 118.024 175.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.4 mp -120.72 135.3 24.58 Favored Pre-proline 0 CA--C 1.552 1.028 0 CA-C-N 119.408 1.604 . . . . 0.0 113.077 -166.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.29 -47.99 0.14 Allowed 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 124.333 3.355 . . . . 0.0 113.701 177.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 88.2 p -163.46 -7.75 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.903 2.081 . . . . 0.0 114.126 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.9 m 63.99 -6.59 0.25 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.515 2.726 . . . . 0.0 115.569 -162.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -81.74 -39.21 24.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.82 1.248 . . . . 0.0 110.088 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -91.19 -6.09 53.98 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.374 1.469 . . . . 0.0 114.624 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.5 mtp85 -69.29 -33.09 72.65 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 121.298 -0.876 . . . . 0.0 112.15 161.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -83.45 -63.37 1.37 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.865 2.066 . . . . 0.0 112.384 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.9 mm . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.2 1.8 . . . . 0.0 112.261 -178.061 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.784 HD12 HD23 ' A' ' 8' ' ' LEU . 41.1 mt . . . . . 0 CA--C 1.541 0.609 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.3 p -69.91 -169.5 0.26 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.015 1.326 . . . . 0.0 112.581 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -48.44 -24.45 1.27 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.592 1.557 . . . . 0.0 114.627 172.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.67 42.09 0.13 Allowed Glycine 0 CA--C 1.527 0.823 0 CA-C-O 117.518 -1.712 . . . . 0.0 116.081 172.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.37 -12.82 23.57 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 121.431 2.615 . . . . 0.0 113.697 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.784 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -112.02 -16.46 13.07 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.915 1.286 . . . . 0.0 113.242 168.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.44 ' HG3' HD11 ' A' ' 53' ' ' LEU . 5.8 ttt -69.15 -65.92 0.64 Allowed 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.211 1.405 . . . . 0.0 110.17 178.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.518 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.1 pttp -74.05 17.33 0.18 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.599 1.56 . . . . 0.0 113.7 -173.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.518 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -128.41 -37.54 1.81 Allowed 'General case' 0 C--O 1.233 0.219 0 C-N-CA 129.205 3.002 . . . . 0.0 111.733 -172.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.1 pt -62.95 -33.19 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.648 1.113 . . . . 0.0 111.514 -178.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.03 -11.24 39.4 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -96.94 -13.35 22.46 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.385 1.874 . . . . 0.0 111.879 -174.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.27 -46.97 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 124.91 1.284 . . . . 0.0 109.473 167.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.23 -36.58 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 119.828 1.194 . . . . 0.0 111.028 -174.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -78.43 -1.63 34.51 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -106.71 -16.67 14.43 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.63 1.572 . . . . 0.0 113.03 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -96.41 -88.93 0.27 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.874 0.87 . . . . 0.0 112.331 -172.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -138.76 90.68 2.47 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.719 1.208 . . . . 0.0 110.367 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -57.36 -20.5 29.57 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.71 0.804 . . . . 0.0 113.04 164.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -75.37 -21.66 58.14 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.832 2.453 . . . . 0.0 113.822 171.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -147.81 75.79 10.86 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 127.286 2.235 . . . . 0.0 110.2 -174.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -70.05 162.19 43.16 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.143 2.562 . . . . 0.0 113.1 -170.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -78.34 -166.43 0.84 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.33 1.452 . . . . 0.0 110.943 169.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.489 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 67.9 m -149.85 172.43 15.17 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.205 1.802 . . . . 0.0 109.61 173.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.4 ' CG ' ' HE ' ' A' ' 43' ' ' ARG . 23.7 p30 -62.55 -31.47 72.27 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -171.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -65.03 -50.89 64.46 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.078 -1.639 . . . . 0.0 110.67 165.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.489 ' HB2' ' H ' ' A' ' 26' ' ' SER . 46.1 mt-10 -61.95 -50.97 70.0 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 120.677 -1.264 . . . . 0.0 112.531 -173.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.7 pt -59.23 -37.27 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 119.363 0.983 . . . . 0.0 112.366 174.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.72 -35.6 80.29 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.403 1.001 . . . . 0.0 111.973 176.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -67.49 -53.25 30.37 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.202 1.001 . . . . 0.0 112.745 -178.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.478 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.6 mt -63.81 -32.36 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 O-C-N 121.42 -0.8 . . . . 0.0 111.449 -177.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.86 -21.65 66.55 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.031 1.332 . . . . 0.0 112.522 175.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.5 ptmt -80.84 -15.37 56.56 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 175.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -88.33 -12.31 43.81 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.821 0.849 . . . . 0.0 112.267 -177.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.478 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.9 ptpt -126.75 -22.51 3.87 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -173.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.33 1.83 0.07 OUTLIER Glycine 0 N--CA 1.469 0.899 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 152.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.444 ' HB3' HD11 ' A' ' 3' ' ' LEU . 47.7 m-85 -88.91 -34.65 16.86 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.395 1.097 . . . . 0.0 112.017 -168.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.8 ptmt 27.12 53.61 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 129.15 2.98 . . . . 0.0 112.486 -170.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.671 HG21 HD22 ' A' ' 8' ' ' LEU . 4.2 p -88.16 142.76 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 126.372 1.869 . . . . 0.0 108.858 168.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.32 169.87 11.91 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 129.384 3.073 . . . . 0.0 113.291 175.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.4 ' HE ' ' CG ' ' A' ' 27' ' ' ASP . 0.7 OUTLIER -64.14 -28.85 70.04 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 125.681 1.592 . . . . 0.0 114.39 -171.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -35.14 69.7 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.795 1.18 . . . . 0.0 111.132 -175.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.2 m -77.43 -48.65 16.65 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 125.816 1.646 . . . . 0.0 108.589 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.29 -30.9 51.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.82 -175.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.67 -43.65 72.09 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 126.311 1.844 . . . . 0.0 111.594 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -66.99 -25.64 66.41 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 173.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -79.4 -46.47 17.51 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.666 0.787 . . . . 0.0 112.673 -178.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 30.8 ptt85 -51.94 -31.68 29.91 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.765 1.166 . . . . 0.0 111.821 170.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -77.89 -23.51 48.72 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 178.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.9 ptm -93.05 -26.99 17.25 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.573 1.079 . . . . 0.0 112.823 177.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.44 HD11 ' HG3' ' A' ' 9' ' ' MET . 2.2 mp -73.73 -74.63 0.17 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.994 1.318 . . . . 0.0 111.322 172.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 176.12 14.53 0.02 OUTLIER Glycine 0 CA--C 1.537 1.44 0 N-CA-C 118.253 2.061 . . . . 0.0 118.253 178.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.9 mt -112.27 126.39 28.48 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 119.556 1.678 . . . . 0.0 111.773 -173.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.29 -70.36 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 124.143 3.229 . . . . 0.0 110.348 173.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 95.2 p -141.38 -7.05 1.02 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.41 2.284 . . . . 0.0 113.351 174.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.2 m 56.86 -1.58 0.05 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 128.488 2.715 . . . . 0.0 116.088 -161.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -82.45 -39.63 22.28 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 120.309 1.413 . . . . 0.0 110.369 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -73.44 -20.62 60.67 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.2 mtp180 -75.3 -42.54 54.47 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.678 1.191 . . . . 0.0 112.43 167.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -66.15 -58.67 4.92 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.231 1.812 . . . . 0.0 112.835 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 C--O 1.254 1.308 0 C-N-CA 125.498 1.519 . . . . 0.0 114.441 -169.432 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 63.9 mtt 52.5 37.33 22.64 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.951 2.1 . . . . 0.0 114.091 175.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.777 HD12 HD23 ' A' ' 8' ' ' LEU . 32.4 mt -65.71 174.16 2.47 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.729 2.012 . . . . 0.0 115.107 -178.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.7 p -71.19 -168.95 0.34 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.381 1.472 . . . . 0.0 112.683 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -48.48 -25.22 1.56 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.581 1.552 . . . . 0.0 114.556 172.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.7 40.11 0.14 Allowed Glycine 0 CA--C 1.529 0.929 0 CA-C-O 117.688 -1.618 . . . . 0.0 116.063 174.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.98 -14.06 31.56 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 121.435 2.618 . . . . 0.0 113.364 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.777 HD23 HD12 ' A' ' 3' ' ' LEU . 1.8 pp -111.34 -16.87 13.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.87 1.268 . . . . 0.0 113.278 168.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 9.5 ttm -67.65 -67.05 0.49 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.351 1.46 . . . . 0.0 110.031 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.512 ' C ' HD22 ' A' ' 11' ' ' LEU . 7.0 pttp -74.45 18.76 0.15 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.59 1.556 . . . . 0.0 113.712 -172.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.512 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -128.8 -38.4 1.68 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 129.53 3.132 . . . . 0.0 111.158 -172.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -61.99 -35.57 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 CA-C-N 119.447 1.021 . . . . 0.0 111.441 -177.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.57 -13.11 28.11 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -177.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -91.59 -17.44 25.59 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 126.855 2.062 . . . . 0.0 111.579 -174.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.29 -46.32 9.73 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 C-N-CA 124.95 1.3 . . . . 0.0 109.727 169.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 87.9 t -64.66 -35.81 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 119.923 1.238 . . . . 0.0 111.091 -175.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -83.74 5.07 26.11 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -112.28 -16.28 13.0 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.471 1.909 . . . . 0.0 113.445 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -94.71 -86.83 0.28 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.152 0.981 . . . . 0.0 111.708 -173.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -139.69 85.11 2.02 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.26 1.424 . . . . 0.0 109.669 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -59.4 -17.99 35.15 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.491 1.116 . . . . 0.0 113.574 172.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -87.74 -7.95 56.67 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 126.607 1.963 . . . . 0.0 113.852 174.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -146.72 71.12 12.6 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 127.438 2.295 . . . . 0.0 110.456 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -69.37 160.49 49.6 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.874 2.383 . . . . 0.0 113.332 -168.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -76.6 -174.25 2.88 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.143 1.377 . . . . 0.0 111.004 167.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.481 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 87.9 p -134.0 169.62 16.85 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.078 1.751 . . . . 0.0 110.131 173.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -55.64 -31.34 62.25 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 176.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -68.24 -54.38 18.05 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 119.836 -1.79 . . . . 0.0 110.932 167.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.481 ' HB2' ' H ' ' A' ' 26' ' ' SER . 22.2 mm-40 -62.17 -47.48 84.32 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.793 -1.192 . . . . 0.0 112.702 -173.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 pt -59.63 -38.75 77.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.752 1.16 . . . . 0.0 112.061 172.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.2 -34.99 77.52 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.656 1.116 . . . . 0.0 112.055 176.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -68.2 -54.26 19.09 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.213 1.005 . . . . 0.0 112.819 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.453 HG22 ' HE2' ' A' ' 37' ' ' LYS . 1.8 mt -63.2 -32.89 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-N 119.063 0.847 . . . . 0.0 111.452 -177.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mp -63.3 -20.09 65.17 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.155 1.382 . . . . 0.0 112.855 176.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 ptmt -81.53 -14.89 56.35 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.706 0.803 . . . . 0.0 112.646 173.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -88.21 -11.73 45.87 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.247 0.619 . . . . 0.0 112.361 -176.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.453 ' HE2' HG22 ' A' ' 33' ' ' ILE . 27.2 pttt -129.06 -27.3 2.51 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -171.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.81 6.24 0.04 OUTLIER Glycine 0 N--CA 1.471 0.997 0 CA-C-N 120.592 1.542 . . . . 0.0 116.941 160.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -99.3 -39.86 8.21 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.527 1.163 . . . . 0.0 111.361 -168.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER 37.85 51.06 1.33 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 128.138 2.575 . . . . 0.0 111.776 179.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.664 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -91.66 139.88 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 111.592 -2.549 . . . . 0.0 109.194 171.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.09 165.61 18.37 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 128.857 2.863 . . . . 0.0 112.414 176.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.57 -26.6 68.67 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 125.589 1.555 . . . . 0.0 113.981 -177.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -34.38 76.62 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.835 0.854 . . . . 0.0 111.31 -177.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.0 m -84.91 -47.5 10.24 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 127.222 2.209 . . . . 0.0 109.948 -176.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.78 -28.33 42.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.949 -173.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.03 -47.39 80.43 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 125.672 1.589 . . . . 0.0 111.06 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -67.92 -18.27 64.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.106 1.362 . . . . 0.0 112.443 179.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -89.58 -50.35 6.13 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.48 1.512 . . . . 0.0 112.84 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -22.26 47.45 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.687 1.13 . . . . 0.0 112.144 172.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -69.49 -44.18 71.67 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.951 0.9 . . . . 0.0 112.871 170.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.9 ptp -83.31 -31.57 26.78 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -172.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 mp -65.64 -63.48 1.08 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.426 1.09 . . . . 0.0 111.205 175.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.96 8.07 0.03 OUTLIER Glycine 0 CA--C 1.536 1.372 0 N-CA-C 118.227 2.051 . . . . 0.0 118.227 171.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.5 mt -90.96 125.19 59.68 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 119.629 1.714 . . . . 0.0 111.217 -173.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.74 -53.25 0.28 Allowed 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.016 2.477 . . . . 0.0 110.78 175.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.2 p -158.89 -10.99 0.07 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 163.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 56.3 m 61.72 -18.4 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 128.293 2.637 . . . . 0.0 116.071 -164.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -67.11 -42.0 85.27 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 120.476 1.489 . . . . 0.0 109.012 168.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -25.09 54.02 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.993 0.917 . . . . 0.0 113.263 -178.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.9 mtm180 -72.2 -42.82 65.37 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.412 1.485 . . . . 0.0 112.302 169.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -69.49 -58.77 3.56 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.051 1.74 . . . . 0.0 113.229 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.8 tp . . . . . 0 C--O 1.254 1.309 0 C-N-CA 125.985 1.714 . . . . 0.0 114.43 -168.099 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.666 0 C4'-C3'-C2' 100.046 -3.154 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.455 0 O4'-C1'-N19 110.714 3.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.62 1 O4'-C1'-N19 111.801 5.001 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.967 0 O4'-C1'-N19 110.786 3.733 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.751 0 O4'-C1'-N19 110.063 2.829 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.728 0 P-O3'-C3' 123.214 2.928 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.146 0 O4'-C1'-N19 110.747 3.683 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.176 0 P-O3'-C3' 122.937 2.697 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.528 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.778 1 O4'-C1'-N19 112.199 5.498 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.502 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.535 1 C4'-C3'-C2' 99.054 -4.146 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.409 -3.363 0 O4'-C1'-N19 110.765 3.707 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.464 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.298 0 O4'-C4'-C3' 109.084 3.484 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.464 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.143 0 P-O3'-C3' 123.453 3.127 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.097 0 C4'-C3'-C2' 100.129 -3.071 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.177 0 N19-C1'-C2' 109.051 -3.218 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.063 0 C3'-C2'-C1' 106.388 2.634 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.48 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.339 0 P-O3'-C3' 123.951 3.542 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.48 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.326 0 C3'-C2'-C1' 106.029 2.378 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.502 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.683 1 O4'-C1'-N19 111.89 5.112 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.528 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.171 2 O4'-C1'-N19 117.526 12.158 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.607 0 C5'-C4'-C3' 110.89 -2.54 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.591 0 N19-C1'-C2' 110.437 -2.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.871 0 O4'-C4'-C3' 108.975 3.375 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.134 0 P-O3'-C3' 123.288 2.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.756 0 O4'-C4'-C3' 108.101 2.501 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.286 0 P-O3'-C3' 123.701 3.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.105 0 O4'-C4'-C3' 108.226 2.626 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.953 0 P-O3'-C3' 122.425 2.271 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.5 p80 . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.765 0.316 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -137.12 -37.48 0.64 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.974 1.31 . . . . 0.0 112.402 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.726 HD12 HD23 ' A' ' 8' ' ' LEU . 35.9 mt -93.07 177.78 5.95 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.755 1.622 . . . . 0.0 113.639 178.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.2 p -71.29 -173.49 0.88 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.701 1.2 . . . . 0.0 112.158 170.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -51.23 -24.46 4.4 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.23 1.412 . . . . 0.0 114.791 175.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.77 39.12 0.21 Allowed Glycine 0 C--N 1.341 0.841 0 CA-C-O 117.61 -1.661 . . . . 0.0 115.954 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.8 -15.82 23.51 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 120.831 2.316 . . . . 0.0 113.137 177.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.726 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -108.92 -18.4 13.69 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.959 1.303 . . . . 0.0 112.795 170.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.436 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.4 ttt -73.38 -59.45 2.71 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.541 1.536 . . . . 0.0 111.255 -176.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.517 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.8 pttp -76.32 19.2 0.26 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.777 1.231 . . . . 0.0 113.005 -174.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.517 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -130.57 -38.93 1.3 Allowed 'General case' 0 C--O 1.233 0.223 0 C-N-CA 129.703 3.201 . . . . 0.0 110.992 -170.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.6 pt -64.04 -34.32 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 CA-C-N 119.07 0.85 . . . . 0.0 111.359 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.93 -13.83 43.61 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -93.22 -18.33 22.64 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.48 1.912 . . . . 0.0 111.847 -171.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.95 -48.8 10.99 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.165 0 C-N-CA 124.568 1.147 . . . . 0.0 108.933 168.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.0 t -65.55 -34.6 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 119.961 1.255 . . . . 0.0 111.407 -172.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -81.56 3.22 25.81 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.42 -7.71 9.69 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.153 1.781 . . . . 0.0 114.186 -176.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -100.53 -85.76 0.41 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.838 0.855 . . . . 0.0 112.296 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -136.88 87.77 2.31 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.913 1.285 . . . . 0.0 110.98 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -58.12 -23.82 56.45 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.959 0.904 . . . . 0.0 112.777 166.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -27.49 62.88 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 128.365 2.666 . . . . 0.0 113.914 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -148.29 75.63 10.45 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 127.122 2.169 . . . . 0.0 110.116 -170.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.2 161.48 45.83 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.14 2.56 . . . . 0.0 112.533 -170.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -78.7 -176.22 4.79 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.539 1.136 . . . . 0.0 110.964 167.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.471 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 55.1 p -137.43 169.59 17.52 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.098 1.759 . . . . 0.0 110.527 175.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -56.01 -32.1 63.68 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -67.16 -55.29 14.79 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 120.226 -1.546 . . . . 0.0 110.813 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.471 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.4 mm-40 -61.83 -49.29 76.88 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 120.786 -1.196 . . . . 0.0 112.866 -173.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.9 pt -59.07 -38.53 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 119.484 1.038 . . . . 0.0 112.183 173.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.56 -35.22 78.8 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.803 1.183 . . . . 0.0 111.827 176.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -68.89 -53.19 22.51 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.422 1.089 . . . . 0.0 112.947 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.455 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.8 mt -64.16 -32.86 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 O-C-N 121.321 -0.862 . . . . 0.0 111.433 -177.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.13 -24.69 67.3 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.242 1.417 . . . . 0.0 112.385 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -78.83 -15.75 57.98 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -88.35 -11.65 45.67 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.677 0.791 . . . . 0.0 112.105 -176.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.455 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.8 ptpt -126.58 -21.63 4.09 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -174.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.16 2.32 0.08 OUTLIER Glycine 0 N--CA 1.472 1.055 0 N-CA-C 115.992 1.157 . . . . 0.0 115.992 151.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.401 ' HB3' HD11 ' A' ' 3' ' ' LEU . 52.3 m-85 -89.0 -22.24 23.1 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.3 1.05 . . . . 0.0 113.671 -167.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.01 28.96 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 130.398 3.479 . . . . 0.0 115.673 -175.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.576 HG21 HD22 ' A' ' 8' ' ' LEU . 3.3 p -82.77 141.73 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 121.391 0.615 . . . . 0.0 109.348 -173.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.17 164.95 16.08 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.07 2.548 . . . . 0.0 112.719 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.2 -31.18 68.78 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 125.45 1.5 . . . . 0.0 114.354 -175.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -36.6 78.97 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.205 0.911 . . . . 0.0 110.693 -176.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.418 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 2.6 m -77.41 -47.5 19.64 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 126.492 1.917 . . . . 0.0 109.455 -176.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.25 -29.34 45.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.064 -175.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.06 -35.35 69.28 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.561 1.545 . . . . 0.0 112.287 178.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -67.5 -30.93 70.74 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.398 0.679 . . . . 0.0 111.841 172.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -77.08 -46.07 24.87 Favored 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 123.154 0.582 . . . . 0.0 112.423 -172.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.19 -29.5 14.2 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 175.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -74.0 -37.42 64.42 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.52 0.728 . . . . 0.0 112.515 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -87.28 -23.87 24.53 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -175.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.436 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.4 mt -71.41 -62.82 1.27 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.265 1.026 . . . . 0.0 111.387 169.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 165.84 3.98 0.04 OUTLIER Glycine 0 CA--C 1.537 1.464 0 N-CA-C 118.029 1.972 . . . . 0.0 118.029 170.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 28.4 mt -84.2 131.33 51.16 Favored Pre-proline 0 CA--C 1.547 0.835 0 CA-C-N 119.371 1.585 . . . . 0.0 111.169 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.6 -63.96 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.737 2.958 . . . . 0.0 110.797 172.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 85.1 p -150.69 -11.9 0.24 Allowed 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.254 1.575 . . . . 0.0 115.254 168.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 73.6 m 61.06 -13.36 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 128.456 2.702 . . . . 0.0 116.184 -166.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -69.11 -40.29 78.42 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.823 1.649 . . . . 0.0 109.263 167.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.65 -20.42 46.73 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -76.25 -38.86 55.72 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.175 1.39 . . . . 0.0 112.174 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -68.83 -58.64 3.9 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.851 1.661 . . . . 0.0 112.133 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.256 1.397 0 C-N-CA 125.596 1.558 . . . . 0.0 114.349 -169.105 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.665 0 C4'-C3'-C2' 100.134 -3.066 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.484 0 O4'-C1'-N19 110.735 3.669 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.91 1 O4'-C1'-N19 112.631 6.039 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.363 0 O4'-C1'-N19 110.758 3.697 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.661 0 P-O3'-C3' 122.691 2.493 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.476 0 P-O3'-C3' 122.86 2.633 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.137 0 O4'-C1'-N19 110.449 3.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.331 0 P-O3'-C3' 123.191 2.909 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.505 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.54 1 O4'-C1'-N19 111.232 4.29 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.484 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.472 1 C4'-C3'-C2' 99.054 -4.146 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.652 1 O4'-C1'-N19 111.397 4.496 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.415 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.674 0 O4'-C4'-C3' 108.638 3.038 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.415 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.402 0 P-O3'-C3' 124.002 3.585 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.383 0 C4'-C3'-C2' 100.038 -3.162 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.176 0 N19-C1'-C2' 109.415 -2.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.426 0 C3'-C2'-C1' 106.763 2.902 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.506 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.328 0 C4'-C3'-C2' 99.523 -3.677 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.506 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.382 0 C3'-C2'-C1' 106.685 2.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.484 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.658 1 O4'-C1'-N19 113.118 6.648 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.505 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.574 2 O4'-C1'-N19 117.357 11.946 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.361 1 O4'-C1'-N19 111.101 4.126 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.394 0 C3'-C2'-C1' 105.686 2.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.593 0 O4'-C4'-C3' 108.312 2.712 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.097 0 C4'-C3'-C2' 100.043 -3.157 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.334 0 O4'-C4'-C3' 108.504 2.904 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.348 0 P-O3'-C3' 123.811 3.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.393 0 O4'-C4'-C3' 108.64 3.04 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.984 0 C4'-C3'-C2' 100.781 -2.419 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 121.193 0.52 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -72.9 72.32 1.1 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.555 1.542 . . . . 0.0 111.461 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.714 HD12 HD23 ' A' ' 8' ' ' LEU . 41.8 mt -48.55 176.51 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 128.197 2.599 . . . . 0.0 114.018 158.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.8 p -72.8 -165.5 0.22 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.444 1.498 . . . . 0.0 112.797 -176.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -50.56 -23.66 2.69 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.76 51.78 0.09 OUTLIER Glycine 0 C--N 1.341 0.816 0 CA-C-O 118.438 -1.201 . . . . 0.0 114.783 168.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -64.3 -13.34 49.31 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.096 1.948 . . . . 0.0 114.282 -177.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.714 HD23 HD12 ' A' ' 3' ' ' LEU . 1.7 pp -105.48 -19.71 13.7 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.979 0.912 . . . . 0.0 113.263 166.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.436 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.5 ttt -72.39 -59.22 2.84 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.041 1.737 . . . . 0.0 111.006 -176.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.472 ' C ' HD22 ' A' ' 11' ' ' LEU . 22.7 pttt -76.53 15.45 0.62 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.659 1.184 . . . . 0.0 113.255 -174.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.472 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.6 mm? -126.34 -39.89 2.01 Favored 'General case' 0 C--N 1.34 0.182 0 C-N-CA 129.326 3.05 . . . . 0.0 111.064 -171.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.4 pt -63.09 -34.04 64.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 119.084 0.856 . . . . 0.0 111.708 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.05 -17.48 40.2 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 176.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -97.48 -13.96 21.41 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 127.02 2.128 . . . . 0.0 111.913 -169.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.11 -49.22 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.782 1.233 . . . . 0.0 109.158 166.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.64 -39.41 85.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.736 1.153 . . . . 0.0 111.14 -172.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -83.07 5.26 22.97 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -113.98 -15.61 12.29 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.66 1.584 . . . . 0.0 113.508 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -89.33 -83.86 0.23 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.851 1.26 . . . . 0.0 111.552 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -136.01 95.68 3.26 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 122.702 1.239 . . . . 0.0 112.153 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -56.5 -14.21 2.92 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.783 1.633 . . . . 0.0 114.53 171.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -118.25 8.32 12.26 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.036 1.735 . . . . 0.0 114.962 171.795 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -140.58 79.13 20.46 Favored Pre-proline 0 N--CA 1.484 1.236 0 C-N-CA 125.667 1.587 . . . . 0.0 110.87 161.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -71.83 163.84 37.6 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 123.678 2.919 . . . . 0.0 113.209 -172.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -90.22 175.75 7.01 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.859 1.264 . . . . 0.0 111.157 168.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.457 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 77.7 p -129.45 169.78 14.52 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 126.256 1.822 . . . . 0.0 109.834 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.2 p30 -56.62 -34.42 67.23 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -67.64 -52.4 38.61 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 120.23 -1.544 . . . . 0.0 110.709 168.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.457 ' HB2' ' H ' ' A' ' 26' ' ' SER . 46.7 mt-10 -61.52 -50.83 71.12 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.783 -1.198 . . . . 0.0 112.462 -173.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.5 pt -59.46 -38.02 72.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 119.265 0.939 . . . . 0.0 112.036 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.56 -35.2 77.11 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.409 1.004 . . . . 0.0 111.79 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -69.56 -52.99 21.1 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.578 1.151 . . . . 0.0 112.796 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -64.41 -32.95 59.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 O-C-N 121.269 -0.894 . . . . 0.0 111.53 -177.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mp -63.58 -23.26 67.31 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.521 1.529 . . . . 0.0 112.207 176.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -80.03 -15.02 58.08 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -87.85 -11.76 46.87 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.68 0.792 . . . . 0.0 112.055 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.9 ptpt -127.34 -23.03 3.59 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -173.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.7 1.24 0.07 OUTLIER Glycine 0 N--CA 1.47 0.914 0 N-CA-C 115.948 1.139 . . . . 0.0 115.948 152.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -89.89 -27.36 19.94 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 118.43 1.115 . . . . 0.0 112.869 -167.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 29.19 40.87 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 130.426 3.491 . . . . 0.0 114.205 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.605 HG21 HD22 ' A' ' 8' ' ' LEU . 2.6 p -82.66 139.57 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.618 0.767 . . . . 0.0 108.995 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.6 158.21 31.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 127.471 2.308 . . . . 0.0 111.971 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.63 -29.69 64.75 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.398 1.479 . . . . 0.0 113.596 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -65.24 -37.42 87.19 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.003 1.321 . . . . 0.0 111.25 -175.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.3 m -82.25 -52.3 7.08 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 128.261 2.624 . . . . 0.0 109.701 -177.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.84 -29.27 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.027 -171.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.87 -52.55 62.66 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.377 1.471 . . . . 0.0 110.241 175.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -72.5 -9.59 58.74 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.917 -174.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.85 -45.83 11.19 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.537 1.135 . . . . 0.0 112.732 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -55.37 -24.16 28.14 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.348 0.976 . . . . 0.0 112.847 176.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.2 tt0 -62.56 -50.2 72.28 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.785 1.234 . . . . 0.0 112.937 175.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.4 ptt? -84.51 -26.29 28.2 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -169.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.436 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.2 mt -70.58 -57.65 4.52 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.622 1.169 . . . . 0.0 112.129 178.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.38 5.8 0.02 OUTLIER Glycine 0 CA--C 1.535 1.338 0 N-CA-C 118.194 2.038 . . . . 0.0 118.194 173.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.9 mt -107.22 134.18 20.03 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 119.411 1.606 . . . . 0.0 111.857 -169.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.43 -66.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.485 2.79 . . . . 0.0 109.842 169.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.2 p -150.08 -3.51 0.37 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.749 2.02 . . . . 0.0 113.247 167.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 52.4 m 55.4 -4.08 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 128.987 2.915 . . . . 0.0 116.235 -165.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.9 ttt85 -79.2 -42.57 25.73 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.17 1.388 . . . . 0.0 109.309 176.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -73.99 -21.04 60.15 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.736 1.215 . . . . 0.0 113.62 174.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -73.87 -41.29 62.42 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.604 1.162 . . . . 0.0 111.981 168.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -72.4 -59.72 2.59 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.85 1.66 . . . . 0.0 113.176 -178.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.254 1.335 0 C-N-CA 126.023 1.729 . . . . 0.0 114.386 -167.899 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.155 0 O4'-C1'-N19 110.073 2.841 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.451 0 O4'-C1'-N19 110.566 3.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 1 O4'-C1'-N19 111.081 4.101 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.812 0 O4'-C1'-N19 110.878 3.847 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.325 0 O4'-C1'-N19 109.924 2.654 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.576 0 P-O3'-C3' 123.898 3.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.234 0 P-O3'-C3' 123.135 2.862 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.142 0 P-O3'-C3' 122.994 2.745 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.729 1 O4'-C1'-N19 111.139 4.174 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.407 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.449 1 C4'-C3'-C2' 98.817 -4.383 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.51 1 O4'-C1'-N19 111.079 4.099 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.427 " H2'" ' H72' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.432 0 O4'-C4'-C3' 108.829 3.229 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.427 ' H72' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.188 0 P-O3'-C3' 123.761 3.384 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.331 0 C4'-C3'-C2' 99.888 -3.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.69 0 N19-C1'-C2' 109.339 -3.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.3 0 C3'-C2'-C1' 107.002 3.073 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.544 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.349 0 O4'-C4'-C3' 109.374 3.774 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.544 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.411 -3.197 0 O4'-C4'-C3' 108.91 3.31 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.407 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.679 0 P-O3'-C3' 123.272 2.977 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.065 1 O4'-C1'-N19 115.393 9.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.776 0 O4'-C1'-N19 110.865 3.831 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.599 0 O4'-C4'-C3' 109.104 3.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.5 0 O4'-C4'-C3' 109.038 3.438 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.222 0 C4'-C3'-C2' 100.309 -2.891 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.666 0 O4'-C1'-N19 109.905 2.631 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.407 0 P-O3'-C3' 123.523 3.185 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.203 0 P-O3'-C3' 123.291 2.992 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.98 0 P-O3'-C3' 122.724 2.52 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 39.7 m80 . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 17.2 tpt 59.44 -59.72 0.05 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.428 2.291 . . . . 0.0 112.365 -157.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.773 HD12 HD23 ' A' ' 8' ' ' LEU . 42.1 mt -104.24 -179.83 4.06 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 127.843 2.457 . . . . 0.0 112.496 173.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.1 p -71.96 -168.55 0.39 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.882 1.273 . . . . 0.0 112.2 175.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -49.65 -25.4 2.83 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.238 1.415 . . . . 0.0 114.387 172.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.68 43.3 0.15 Allowed Glycine 0 C--N 1.341 0.835 0 CA-C-O 117.857 -1.524 . . . . 0.0 115.563 174.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -63.86 -11.13 24.82 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.625 2.213 . . . . 0.0 113.973 -179.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.773 HD23 HD12 ' A' ' 3' ' ' LEU . 1.7 pp -110.61 -17.81 13.32 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.732 1.213 . . . . 0.0 113.136 167.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.573 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.2 ttp -71.4 -63.15 1.17 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.573 1.549 . . . . 0.0 110.595 -178.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.485 ' C ' HD22 ' A' ' 11' ' ' LEU . 20.0 pttt -73.07 18.07 0.11 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.054 1.342 . . . . 0.0 113.791 -174.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.485 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -127.52 -43.72 1.57 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 129.621 3.168 . . . . 0.0 110.909 -171.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.5 pt -60.74 -36.42 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 119.082 0.855 . . . . 0.0 111.564 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.436 ' HG2' HD22 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -82.29 -18.77 41.16 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 178.428 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -96.48 -20.86 18.09 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.812 2.045 . . . . 0.0 111.908 -167.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -96.7 -50.15 11.64 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.166 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 169.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.3 t -65.02 -35.88 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 O-C-N 120.597 -1.315 . . . . 0.0 111.19 -171.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -80.22 -2.66 45.88 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.0 t30 -109.38 -19.57 13.22 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.721 1.609 . . . . 0.0 113.072 -175.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -91.4 -89.62 0.17 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.766 0.826 . . . . 0.0 111.734 -169.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -141.02 82.71 1.85 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.698 1.199 . . . . 0.0 110.051 -177.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.9 mtmm -60.62 -21.66 62.94 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.18 0.992 . . . . 0.0 113.261 173.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -69.79 -25.55 63.84 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 128.033 2.533 . . . . 0.0 115.04 167.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -143.1 70.81 18.42 Favored Pre-proline 0 N--CA 1.479 1.015 0 C-N-CA 127.645 2.378 . . . . 0.0 109.742 -176.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.48 166.49 29.67 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.585 2.857 . . . . 0.0 113.502 -165.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -78.68 -170.94 2.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.073 1.349 . . . . 0.0 111.011 164.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.1 m -149.88 175.94 11.19 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.389 1.476 . . . . 0.0 110.048 169.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 27.1 p30 -57.41 -31.05 65.46 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -66.86 -53.02 36.66 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.331 -1.481 . . . . 0.0 110.666 167.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.4 ' O ' HD12 ' A' ' 33' ' ' ILE . 6.4 mm-40 -66.77 -43.07 84.99 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 120.621 -1.299 . . . . 0.0 113.275 -172.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.7 pt -60.04 -40.0 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-N 120.164 1.347 . . . . 0.0 111.912 171.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.18 -34.89 77.3 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 120.06 1.3 . . . . 0.0 112.28 173.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -67.63 -53.61 26.53 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.796 1.639 . . . . 0.0 112.459 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.442 HG22 ' HE3' ' A' ' 37' ' ' LYS . 1.8 mt -66.66 -32.8 59.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 121.373 -0.83 . . . . 0.0 111.406 -179.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.92 -24.06 66.73 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.161 0.985 . . . . 0.0 112.131 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 pttm -80.01 -15.18 57.76 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -87.65 -12.96 43.97 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.899 0.88 . . . . 0.0 112.294 -178.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.442 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.1 ptpt -126.33 -20.51 4.42 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -173.478 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.13 -0.13 0.08 OUTLIER Glycine 0 N--CA 1.47 0.923 0 N-CA-C 115.812 1.085 . . . . 0.0 115.812 151.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -89.24 -31.47 17.87 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 118.634 1.217 . . . . 0.0 112.728 -167.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 28.55 43.69 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 130.338 3.455 . . . . 0.0 114.018 -171.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.567 HG21 HD22 ' A' ' 8' ' ' LEU . 2.7 p -81.25 142.31 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 174.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -82.92 163.55 21.02 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 128.365 2.666 . . . . 0.0 111.98 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -56.68 -36.17 69.29 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.909 1.283 . . . . 0.0 113.807 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -66.58 -32.41 73.73 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.356 1.062 . . . . 0.0 111.175 -169.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.5 m -80.93 -52.02 7.91 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.643 2.777 . . . . 0.0 109.842 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.35 -30.81 50.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.268 1.027 . . . . 0.0 110.949 -173.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.49 -37.18 74.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.107 2.163 . . . . 0.0 112.255 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.6 mtmm -79.56 -14.95 58.49 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -82.77 -40.27 20.69 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.3 ptt-85 -52.86 -26.28 14.19 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 175.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.9 -39.99 75.88 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.413 1.085 . . . . 0.0 112.957 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 23.9 ptp -80.25 -23.48 40.79 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.573 HD21 ' HG3' ' A' ' 9' ' ' MET . 4.2 mt -81.54 -61.42 1.94 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.113 1.365 . . . . 0.0 111.981 176.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.31 5.25 0.05 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 118.035 1.974 . . . . 0.0 118.035 168.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.0 mt -95.05 128.7 38.0 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 119.492 1.646 . . . . 0.0 111.452 -172.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -73.12 -49.36 0.23 Allowed 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.526 3.484 . . . . 0.0 113.445 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.3 p -139.84 -68.41 0.42 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.739 1.616 . . . . 0.0 109.88 169.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 62.8 m 121.2 -20.3 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.005 1 C-N-CA 134.351 5.06 . . . . 0.0 110.747 -164.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -74.78 -41.12 60.63 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.083 2.153 . . . . 0.0 109.697 174.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.17 -21.31 43.2 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.708 0.803 . . . . 0.0 112.948 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -69.76 -32.78 71.48 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.909 1.284 . . . . 0.0 112.055 173.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -82.46 -59.92 2.37 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.085 1.754 . . . . 0.0 113.16 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 C--O 1.253 1.25 0 C-N-CA 125.932 1.693 . . . . 0.0 114.64 -163.596 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.582 0 C4'-C3'-C2' 100.018 -3.182 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.537 0 N19-C1'-C2' 109.325 -3.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.8 1 O4'-C1'-N19 111.742 4.927 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.979 0 O4'-C1'-N19 110.626 3.533 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.026 0 O5'-C5'-C4' 114.485 3.061 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.412 0 P-O3'-C3' 124.052 3.627 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.117 0 O4'-C1'-N19 110.771 3.714 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.258 0 P-O3'-C3' 123.336 3.03 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.5 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.536 0 O4'-C1'-N19 110.978 3.973 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.515 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.175 0 C4'-C3'-C2' 99.293 -3.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.409 -3.376 0 O4'-C1'-N19 110.638 3.547 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.401 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.442 0 O4'-C4'-C3' 108.977 3.377 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.401 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.27 0 P-O3'-C3' 123.911 3.509 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.356 0 C4'-C3'-C2' 99.955 -3.245 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.692 0 N19-C1'-C2' 108.953 -3.279 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.415 0 C3'-C2'-C1' 106.956 3.04 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.544 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.426 0 O4'-C4'-C3' 109.213 3.613 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.544 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.128 0 O4'-C4'-C3' 108.217 2.617 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.515 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.324 1 O4'-C1'-N19 112.836 6.295 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.5 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.433 2 O4'-C1'-N19 116.719 11.148 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.853 0 O4'-C1'-N19 110.876 3.845 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.528 0 O4'-C4'-C3' 109.122 3.522 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.438 0 O4'-C4'-C3' 109.17 3.57 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.99 0 C4'-C3'-C2' 100.315 -2.885 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.566 0 O4'-C1'-N19 109.889 2.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.232 0 P-O3'-C3' 123.567 3.223 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.124 0 P-O3'-C3' 122.684 2.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.948 0 P-O3'-C3' 122.632 2.444 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 111.363 0.135 . . . . 0.0 111.363 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.2 mmt 48.76 37.08 8.99 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 127.036 2.134 . . . . 0.0 114.962 169.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.729 HD12 HD23 ' A' ' 8' ' ' LEU . 35.4 mt -64.62 173.06 2.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.494 1.918 . . . . 0.0 115.258 -177.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.1 p -71.83 -168.78 0.39 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 125.374 1.47 . . . . 0.0 112.671 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -49.04 -24.79 1.69 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.284 1.434 . . . . 0.0 114.469 173.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.92 46.25 0.12 Allowed Glycine 0 C--N 1.341 0.835 0 CA-C-O 118.228 -1.318 . . . . 0.0 115.552 170.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.21 -17.13 39.28 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.822 2.311 . . . . 0.0 113.175 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.729 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -109.33 -18.7 13.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.632 1.173 . . . . 0.0 112.582 170.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.7 ttm -71.18 -63.11 1.17 Allowed 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.586 1.555 . . . . 0.0 110.274 -175.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.497 ' C ' HD22 ' A' ' 11' ' ' LEU . 5.3 pttm -76.61 18.99 0.29 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.564 1.145 . . . . 0.0 113.547 -172.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.497 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.1 mm? -128.3 -39.02 1.73 Allowed 'General case' 0 C--O 1.233 0.229 0 C-N-CA 129.706 3.202 . . . . 0.0 110.726 -171.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -65.03 -35.45 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.027 0.831 . . . . 0.0 111.696 -176.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.82 -11.93 54.66 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -92.92 -17.95 23.37 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 127.297 2.239 . . . . 0.0 111.825 -170.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.15 -46.28 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 125.056 1.342 . . . . 0.0 109.671 168.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.4 t -65.99 -36.19 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-N 119.58 1.082 . . . . 0.0 111.309 -173.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -78.97 -1.19 34.19 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -107.11 -15.82 14.58 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.701 1.6 . . . . 0.0 112.998 -177.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -98.45 -93.06 0.25 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.781 0.832 . . . . 0.0 112.386 -170.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -136.38 92.09 2.74 Favored 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 124.63 1.172 . . . . 0.0 110.372 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.0 mttt -58.56 -20.38 46.18 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.737 0.815 . . . . 0.0 112.938 166.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.58 -20.46 60.61 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 127.745 2.418 . . . . 0.0 113.919 170.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -146.85 72.7 12.45 Favored Pre-proline 0 N--CA 1.477 0.877 0 C-N-CA 127.457 2.303 . . . . 0.0 109.754 -176.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.62 155.44 68.91 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.835 2.357 . . . . 0.0 112.4 -168.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -75.54 169.1 18.76 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.676 0.75 . . . . 0.0 110.19 164.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.464 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 81.1 p -124.63 168.55 12.99 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.359 1.464 . . . . 0.0 109.746 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.8 p30 -53.92 -32.13 52.54 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 175.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -67.98 -55.04 14.15 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 119.616 -1.927 . . . . 0.0 110.726 167.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.464 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.0 mm-40 -61.08 -50.05 74.85 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 120.81 -1.181 . . . . 0.0 112.784 -173.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.1 pt -59.54 -37.76 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 119.856 1.207 . . . . 0.0 112.278 173.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.54 -35.14 78.5 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.508 1.049 . . . . 0.0 111.74 177.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -68.39 -52.53 31.98 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.413 1.085 . . . . 0.0 112.7 -178.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.513 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -64.3 -32.69 58.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 121.347 -0.846 . . . . 0.0 111.621 -177.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -65.01 -21.67 66.88 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.631 1.572 . . . . 0.0 112.67 176.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -80.09 -15.55 56.9 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -86.39 -13.96 44.82 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 123.132 0.573 . . . . 0.0 111.926 -176.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.513 ' HE3' HG22 ' A' ' 33' ' ' ILE . 15.3 ptpt -130.15 -26.36 2.37 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 116.93 2.196 . . . . 0.0 116.93 -167.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 165.26 10.35 0.03 OUTLIER Glycine 0 N--CA 1.471 1.007 0 N-CA-C 117.126 1.61 . . . . 0.0 117.126 163.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -112.12 -36.11 5.44 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 118.895 1.347 . . . . 0.0 112.385 -167.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.27 1.4 ttpt 40.3 43.84 1.51 Allowed 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 128.33 2.652 . . . . 0.0 113.095 175.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.617 HG21 HD22 ' A' ' 8' ' ' LEU . 3.5 p -91.44 144.44 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.842 2.057 . . . . 0.0 109.129 177.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.444 ' H ' ' P ' ' C' ' 84' ' ' ' DT' . . . -89.54 170.73 10.25 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.612 2.765 . . . . 0.0 112.853 176.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -59.73 -33.84 72.15 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 125.694 1.598 . . . . 0.0 114.052 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -38.34 85.87 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.73 1.212 . . . . 0.0 111.278 -172.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.6 m -86.68 -47.96 8.7 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 127.137 2.175 . . . . 0.0 109.036 -172.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.15 -31.65 54.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.667 -174.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.57 -46.94 74.36 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 125.597 1.559 . . . . 0.0 111.118 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -68.06 -20.01 64.93 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.414 1.086 . . . . 0.0 112.595 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -82.78 -48.3 10.96 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.072 0.949 . . . . 0.0 112.072 178.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -54.53 -29.8 51.78 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 119.906 1.23 . . . . 0.0 112.08 171.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -71.91 -38.04 69.97 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.384 1.074 . . . . 0.0 113.364 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 15.0 ptm -84.97 -28.37 25.84 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.8 mp -69.76 -64.05 0.96 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.106 0.962 . . . . 0.0 111.478 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.47 2.59 0.03 OUTLIER Glycine 0 CA--C 1.538 1.509 0 N-CA-C 118.516 2.166 . . . . 0.0 118.516 175.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.6 mt -90.23 132.16 36.6 Favored Pre-proline 0 CA--C 1.547 0.85 0 CA-C-N 119.59 1.695 . . . . 0.0 110.912 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.73 -62.05 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.503 2.802 . . . . 0.0 110.594 173.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.4 p -151.9 -7.71 0.22 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 164.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 72.0 m 58.45 -16.45 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 127.872 2.469 . . . . 0.0 116.272 -166.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 -66.37 -43.01 87.15 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.14 1.376 . . . . 0.0 108.402 167.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -22.69 52.91 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.192 0.997 . . . . 0.0 113.587 -178.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.9 mtp180 -74.31 -42.99 58.57 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.208 1.403 . . . . 0.0 111.796 170.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -72.33 -59.24 2.83 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.497 1.519 . . . . 0.0 112.694 -176.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.784 1.634 . . . . 0.0 114.469 -169.266 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.645 0 C4'-C3'-C2' 100.049 -3.151 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.578 0 O4'-C4'-C3' 108.492 2.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.66 1 O4'-C1'-N19 111.74 4.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.817 1 O4'-C1'-N19 111.037 4.046 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . 0.424 ' H1 ' ' N4 ' ' C' ' 87' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.277 0 P-O3'-C3' 123.411 3.092 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.632 0 P-O3'-C3' 123.161 2.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.892 0 O4'-C1'-N19 110.592 3.49 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.053 0 P-O3'-C3' 123.157 2.881 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.519 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.535 1 O4'-C1'-N19 111.355 4.444 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.507 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.341 1 C4'-C3'-C2' 99.062 -4.138 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.314 0 O4'-C1'-N19 110.653 3.567 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.407 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.506 0 O4'-C4'-C3' 108.722 3.122 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.407 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.197 0 P-O3'-C3' 123.74 3.367 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.344 0 C4'-C3'-C2' 100.14 -3.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.754 0 N19-C1'-C2' 109.064 -3.21 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.236 0 C3'-C2'-C1' 106.946 3.033 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.539 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.217 0 O4'-C4'-C3' 109.497 3.897 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.539 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.221 0 O4'-C4'-C3' 108.92 3.32 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.507 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.788 1 O4'-C1'-N19 111.873 5.091 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.519 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.297 2 O4'-C1'-N19 118.03 12.788 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . 0.444 ' P ' ' H ' ' A' ' 42' ' ' ALA . . . . . . . . 0 C5'--C4' 1.536 3.153 1 O4'-C1'-N19 111.171 4.213 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.569 0 C3'-C2'-C1' 105.601 2.072 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.545 0 O4'-C4'-C3' 109.172 3.572 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . 0.424 ' N4 ' ' H1 ' ' B' ' 68' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.234 0 C4'-C3'-C2' 99.685 -3.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.741 0 O4'-C4'-C3' 108.38 2.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.08 0 P-O3'-C3' 123.343 3.036 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.348 0 O4'-C4'-C3' 108.287 2.687 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.187 0 P-O3'-C3' 122.559 2.382 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 . . . . . 0 N--CA 1.484 1.262 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 96.0 mmm -111.5 -28.08 8.32 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -160.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.735 HD12 HD23 ' A' ' 8' ' ' LEU . 18.4 mt -79.25 165.08 23.6 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -160.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.0 p -74.56 -170.4 1.02 Allowed 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.191 175.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.03 -26.81 1.95 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.349 1.46 . . . . 0.0 114.663 172.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -170.55 38.09 0.18 Allowed Glycine 0 C--N 1.34 0.77 0 CA-C-O 117.608 -1.662 . . . . 0.0 115.688 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.1 -13.77 19.53 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.902 2.351 . . . . 0.0 113.26 176.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.735 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -107.75 -18.56 13.79 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.176 0.99 . . . . 0.0 112.976 168.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.3 ttt -70.09 -62.62 1.31 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.633 1.573 . . . . 0.0 110.301 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.526 ' C ' HD22 ' A' ' 11' ' ' LEU . 18.3 pttt -76.78 17.06 0.44 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.04 1.336 . . . . 0.0 113.215 -172.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.526 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -129.45 -35.55 1.74 Allowed 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 129.236 3.014 . . . . 0.0 111.482 -171.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pt -61.59 -34.92 63.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 119.291 0.95 . . . . 0.0 111.312 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.0 -12.39 36.02 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -93.2 -17.89 23.18 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 127.125 2.17 . . . . 0.0 111.819 -174.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.51 -48.51 11.19 Favored 'Isoleucine or valine' 0 C--N 1.341 0.229 0 C-N-CA 124.863 1.265 . . . . 0.0 109.427 169.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 72.8 t -63.03 -39.26 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 119.671 1.123 . . . . 0.0 111.013 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -82.1 5.09 20.65 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -111.58 -15.48 13.48 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.312 1.845 . . . . 0.0 113.583 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -94.95 -86.25 0.29 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.341 1.056 . . . . 0.0 111.874 -174.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -139.7 87.95 2.21 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.85 1.26 . . . . 0.0 110.107 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -54.35 -27.63 37.42 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.441 1.096 . . . . 0.0 112.8 169.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -81.18 -12.93 59.07 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.035 2.134 . . . . 0.0 114.175 177.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -146.51 73.65 12.76 Favored Pre-proline 0 N--CA 1.481 1.11 0 C-N-CA 127.43 2.292 . . . . 0.0 110.514 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -73.11 167.95 26.01 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.07 2.513 . . . . 0.0 113.408 -169.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -88.29 -175.29 4.97 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.464 1.505 . . . . 0.0 111.619 171.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.478 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 26.6 p -139.98 171.64 13.9 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.798 2.039 . . . . 0.0 110.166 176.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.0 p-10 -48.04 -48.4 33.06 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -62.48 -48.74 78.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.293 -1.504 . . . . 0.0 110.449 174.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.478 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.9 mm-40 -63.22 -49.8 72.75 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 120.849 -1.157 . . . . 0.0 112.545 -174.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.6 pt -59.36 -38.16 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.322 0.964 . . . . 0.0 112.437 173.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.83 -35.85 77.58 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.387 0.994 . . . . 0.0 111.658 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -68.77 -52.83 26.17 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.502 1.121 . . . . 0.0 112.853 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.493 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -64.36 -32.65 58.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.337 -0.852 . . . . 0.0 111.793 -177.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mp -62.64 -23.81 67.28 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.504 1.522 . . . . 0.0 112.451 174.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -79.19 -15.67 57.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 176.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -86.95 -12.94 46.09 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.465 0.706 . . . . 0.0 112.08 -176.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.493 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.2 ptpt -127.56 -21.28 3.82 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -172.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.2 1.91 0.07 OUTLIER Glycine 0 N--CA 1.471 0.991 0 N-CA-C 116.05 1.18 . . . . 0.0 116.05 151.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.413 ' HB3' HD11 ' A' ' 3' ' ' LEU . 49.4 m-85 -91.29 -21.36 21.1 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.355 1.077 . . . . 0.0 113.803 -165.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.05 28.12 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 130.531 3.532 . . . . 0.0 115.62 -175.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.583 HG21 HD22 ' A' ' 8' ' ' LEU . 3.6 p -84.06 141.29 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 121.49 0.662 . . . . 0.0 109.254 -170.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.0 166.23 15.23 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 128.412 2.685 . . . . 0.0 112.562 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 44.2 ttp85 -58.77 -32.19 69.06 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 125.767 1.627 . . . . 0.0 114.263 -173.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -65.05 -39.68 93.64 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.142 0.972 . . . . 0.0 111.5 -174.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.421 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 1.9 m -77.85 -49.6 13.93 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 127.345 2.258 . . . . 0.0 108.943 -175.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -31.1 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.825 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.412 -173.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.6 -37.88 67.99 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.874 1.67 . . . . 0.0 111.961 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -68.95 -22.71 64.11 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 175.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -84.62 -47.99 9.96 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.316 1.047 . . . . 0.0 112.423 -176.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.6 ptm85 -54.78 -28.37 48.35 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.337 0.971 . . . . 0.0 112.28 171.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -72.91 -34.24 66.5 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.925 0.89 . . . . 0.0 112.914 176.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.8 ptt? -92.17 -29.39 16.5 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 mp -67.17 -63.93 0.96 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.82 0.848 . . . . 0.0 111.264 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 175.88 3.22 0.03 OUTLIER Glycine 0 CA--C 1.538 1.471 0 N-CA-C 118.414 2.126 . . . . 0.0 118.414 173.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 47.6 mt -79.54 128.26 75.56 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-N 119.826 1.813 . . . . 0.0 111.038 -176.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -50.29 -68.87 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 125.213 3.942 . . . . 0.0 112.34 165.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.3 m 165.66 106.64 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.174 1 C-N-CA 134.638 5.175 . . . . 0.0 105.395 167.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.6 m -42.33 -5.53 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 131.128 3.771 . . . . 0.0 119.122 -169.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -70.38 -15.76 62.89 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.972 1.309 . . . . 0.0 112.116 167.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -118.53 -11.93 9.86 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -69.07 -50.41 48.63 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.713 0.688 . . . . 0.0 112.516 169.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -74.11 -56.16 5.25 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.011 1.724 . . . . 0.0 113.267 -171.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.256 1.404 0 C-N-CA 126.291 1.836 . . . . 0.0 114.339 -167.848 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.825 0 C4'-C3'-C2' 100.19 -3.01 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.514 0 O4'-C4'-C3' 108.261 2.661 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 1 O4'-C1'-N19 112.119 5.399 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.388 0 O4'-C1'-N19 110.099 2.874 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.445 0 P-O3'-C3' 122.805 2.587 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.177 0 P-O3'-C3' 122.979 2.733 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.054 0 O4'-C1'-N19 110.566 3.458 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.273 0 P-O3'-C3' 123.1 2.834 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.507 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.58 1 O4'-C1'-N19 111.323 4.404 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.492 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.555 1 C4'-C3'-C2' 99.097 -4.103 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.243 0 O4'-C1'-N19 110.876 3.845 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.343 0 O4'-C4'-C3' 108.901 3.301 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.249 0 P-O3'-C3' 123.588 3.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.345 0 C4'-C3'-C2' 99.803 -3.397 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.643 0 N19-C1'-C2' 108.848 -3.345 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.429 0 C3'-C2'-C1' 106.797 2.926 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.526 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.432 0 O4'-C4'-C3' 109.31 3.71 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.526 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.535 3.055 0 O4'-C4'-C3' 108.458 2.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.492 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.241 1 O4'-C1'-N19 111.951 5.189 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.507 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.542 3.822 2 O4'-C1'-N19 117.801 12.502 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.061 1 O4'-C1'-N19 111.229 4.286 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.296 0 C3'-C2'-C1' 105.589 2.064 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.315 0 O4'-C4'-C3' 108.706 3.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.125 0 P-O3'-C3' 123.219 2.933 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.494 0 O4'-C4'-C3' 108.384 2.784 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.881 0 P-O3'-C3' 123.569 3.224 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.052 0 O4'-C4'-C3' 108.354 2.754 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.85 0 P-O3'-C3' 122.548 2.373 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 52.1 p-80 . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 121.033 0.444 . . . . 0.0 111.702 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 60.0 ttm -138.23 -40.0 0.53 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.27 1.428 . . . . 0.0 113.223 -174.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.726 HD12 HD23 ' A' ' 8' ' ' LEU . 21.2 mt -74.7 171.74 13.38 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.811 1.244 . . . . 0.0 114.141 -176.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.6 p -74.03 -168.96 0.68 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.416 1.486 . . . . 0.0 112.55 177.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -48.64 -25.05 1.57 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.82 1.648 . . . . 0.0 114.667 172.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.73 45.65 0.12 Allowed Glycine 0 C--N 1.341 0.817 0 CA-C-O 118.073 -1.404 . . . . 0.0 115.305 172.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.41 -15.19 34.48 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 120.38 2.09 . . . . 0.0 113.421 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.726 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -108.51 -19.18 13.53 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.777 1.231 . . . . 0.0 113.007 169.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.531 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.2 ttt -73.9 -58.38 3.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.077 1.751 . . . . 0.0 111.442 -174.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.447 ' C ' HD22 ' A' ' 11' ' ' LEU . 21.6 pttt -76.99 17.1 0.46 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.405 1.082 . . . . 0.0 112.971 -173.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.447 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -125.65 -43.93 1.85 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 129.908 3.283 . . . . 0.0 110.359 -170.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.9 pt -61.51 -36.45 73.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 118.344 0.52 . . . . 0.0 111.91 -177.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.07 -17.79 41.95 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 177.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -96.96 -15.45 21.12 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 127.117 2.167 . . . . 0.0 112.003 -168.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -102.04 -47.97 11.1 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 C-N-CA 124.63 1.172 . . . . 0.0 109.013 166.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.1 t -65.64 -35.77 76.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 119.903 1.229 . . . . 0.0 111.635 -172.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -82.03 4.7 21.89 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -118.95 -9.96 9.96 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.309 1.844 . . . . 0.0 114.042 -177.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -101.52 -82.62 0.47 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.97 0.908 . . . . 0.0 112.139 -174.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -139.22 84.11 1.98 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.526 1.13 . . . . 0.0 111.089 -173.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -58.31 -25.07 61.45 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.161 0.984 . . . . 0.0 113.181 171.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -16.66 56.03 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 127.152 2.181 . . . . 0.0 114.956 172.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -147.53 76.07 11.02 Favored Pre-proline 0 N--CA 1.479 1.025 0 C-N-CA 126.769 2.028 . . . . 0.0 110.126 -178.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -69.18 162.28 42.42 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.041 2.494 . . . . 0.0 112.86 -171.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -79.68 -173.13 3.65 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.731 1.212 . . . . 0.0 110.756 167.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.49 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 52.3 p -138.03 168.19 20.22 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.995 1.318 . . . . 0.0 111.154 171.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.2 p30 -52.1 -30.99 28.64 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 175.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -68.11 0.32 Allowed 'General case' 0 C--N 1.333 -0.124 0 O-C-N 120.322 -1.486 . . . . 0.0 110.08 165.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.49 ' HB2' ' H ' ' A' ' 26' ' ' SER . 38.1 mt-10 -57.5 -49.33 76.65 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.222 1.009 . . . . 0.0 112.86 -170.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.4 pt -59.32 -37.29 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 119.193 0.906 . . . . 0.0 112.166 174.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.15 -34.62 78.47 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.862 1.21 . . . . 0.0 111.878 175.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -68.02 -53.47 25.61 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.235 1.014 . . . . 0.0 112.604 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.482 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.2 mt -63.73 -32.68 57.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 121.572 -0.705 . . . . 0.0 111.617 -176.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.98 -23.1 67.21 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.394 1.477 . . . . 0.0 112.295 175.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 pttt -80.25 -15.77 56.23 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -86.24 -13.08 47.89 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.604 0.762 . . . . 0.0 112.163 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.482 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.0 ptpt -127.17 -21.99 3.83 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -172.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.54 2.6 0.07 OUTLIER Glycine 0 N--CA 1.47 0.916 0 N-CA-C 115.97 1.148 . . . . 0.0 115.97 151.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -89.38 -21.93 22.83 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 118.265 1.032 . . . . 0.0 113.443 -167.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.49 30.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 130.368 3.467 . . . . 0.0 115.298 -176.244 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.596 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -83.0 138.43 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 121.576 0.703 . . . . 0.0 109.238 -172.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.05 159.92 28.43 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 127.72 2.408 . . . . 0.0 112.21 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.83 -29.73 63.09 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.261 1.424 . . . . 0.0 113.543 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -32.27 72.71 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.61 1.164 . . . . 0.0 111.722 -175.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.1 m -87.14 -48.64 7.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.104 2.562 . . . . 0.0 110.059 -177.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.24 -30.11 49.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.096 -174.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.21 -37.96 86.81 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.223 1.409 . . . . 0.0 111.042 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -75.34 -17.94 60.12 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.456 1.102 . . . . 0.0 112.311 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.74 -50.13 7.41 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.46 1.104 . . . . 0.0 112.635 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.81 -23.58 18.85 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 175.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -68.78 -43.74 75.12 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.0 1.32 . . . . 0.0 112.585 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -87.63 -28.14 22.06 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -173.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.531 HD21 ' HG3' ' A' ' 9' ' ' MET . 0.9 OUTLIER -69.26 -59.21 3.16 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.319 1.048 . . . . 0.0 111.695 177.132 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.92 4.52 0.03 OUTLIER Glycine 0 CA--C 1.534 1.257 0 N-CA-C 118.312 2.085 . . . . 0.0 118.312 170.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 35.3 mt -91.81 121.47 67.01 Favored Pre-proline 0 CA--C 1.545 0.754 0 CA-C-N 120.014 1.907 . . . . 0.0 111.047 -173.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.94 -58.07 0.16 Allowed 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.382 2.721 . . . . 0.0 110.204 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.7 p -150.81 -8.87 0.25 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 160.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 77.4 p 60.61 -15.86 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 128.878 2.871 . . . . 0.0 116.151 -166.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 63.3 ttt180 -71.61 -43.74 65.68 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.345 1.458 . . . . 0.0 109.351 167.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -22.34 61.02 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -178.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -74.69 -39.5 61.94 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.776 1.63 . . . . 0.0 112.149 169.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -74.11 -59.09 2.88 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.568 1.547 . . . . 0.0 112.931 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.725 2.01 . . . . 0.0 114.483 -167.505 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.602 0 C4'-C3'-C2' 100.199 -3.001 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.401 0 O4'-C1'-N19 110.239 3.049 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.537 1 O4'-C1'-N19 112.072 5.34 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.859 0 O4'-C1'-N19 110.533 3.416 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.538 0 P-O3'-C3' 122.795 2.579 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.247 0 P-O3'-C3' 123.116 2.846 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 1 O4'-C1'-N19 111.01 4.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.356 0 P-O3'-C3' 122.997 2.747 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.476 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.643 1 O4'-C1'-N19 111.072 4.09 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.495 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.72 1 O4'-C4'-C3' 109.627 4.027 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.196 0 P-O3'-C3' 124.37 3.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.468 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.682 0 O4'-C4'-C3' 108.838 3.238 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.468 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.339 0 P-O3'-C3' 123.592 3.243 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.2 0 C4'-C3'-C2' 99.799 -3.401 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.729 0 N19-C1'-C2' 109.277 -3.077 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.317 0 C3'-C2'-C1' 106.82 2.943 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.519 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.333 0 C4'-C3'-C2' 99.697 -3.503 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.519 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.611 0 O4'-C4'-C3' 108.593 2.993 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.495 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.543 3.952 1 O4'-C1'-N19 111.58 4.725 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.476 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.337 2 O4'-C1'-N19 116.432 10.79 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.666 0 N19-C1'-C2' 118.19 2.494 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.557 0 O4'-C4'-C3' 108.337 2.737 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.571 0 O4'-C4'-C3' 109.311 3.711 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.154 0 P-O3'-C3' 122.967 2.723 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.332 0 O4'-C4'-C3' 108.536 2.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.836 0 P-O3'-C3' 123.46 3.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.879 0 O4'-C4'-C3' 108.424 2.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.801 0 P-O3'-C3' 122.691 2.492 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.3 p-80 . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 121.231 0.539 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 28.1 ttt -147.39 -46.72 0.17 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.268 1.427 . . . . 0.0 112.444 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.735 HD12 HD23 ' A' ' 8' ' ' LEU . 25.6 mt -72.73 171.39 12.68 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -171.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.8 p -73.88 -170.56 0.92 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.337 1.455 . . . . 0.0 112.245 176.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -49.23 -25.44 2.29 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.589 1.555 . . . . 0.0 114.599 172.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -171.68 40.66 0.17 Allowed Glycine 0 C--N 1.343 0.918 0 CA-C-O 117.682 -1.621 . . . . 0.0 115.682 175.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -61.61 -13.96 26.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 120.815 2.307 . . . . 0.0 113.467 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.735 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -108.72 -18.86 13.61 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.385 1.074 . . . . 0.0 113.151 168.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.617 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.4 ttp -71.64 -61.55 1.74 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.592 1.557 . . . . 0.0 111.104 -177.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.453 ' C ' HD22 ' A' ' 11' ' ' LEU . 19.6 pttt -75.17 17.01 0.27 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.305 1.042 . . . . 0.0 113.193 -171.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.453 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -125.4 -45.82 1.79 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 129.82 3.248 . . . . 0.0 110.392 -169.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.0 pt -59.64 -36.85 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt -82.76 -14.6 54.18 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 174.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -90.87 -17.76 25.96 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 125.55 1.54 . . . . 0.0 112.094 -174.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -101.39 -45.19 11.18 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 C-N-CA 124.167 0.987 . . . . 0.0 109.32 170.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.77 -31.18 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 O-C-N 120.891 -1.131 . . . . 0.0 111.225 -174.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -79.08 -2.39 40.32 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.253 -0.905 . . . . 0.0 112.816 174.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -108.73 -14.46 14.6 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.903 1.681 . . . . 0.0 112.851 -176.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -103.4 -102.59 0.29 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.201 0.909 . . . . 0.0 112.095 -168.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -139.96 80.82 1.79 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.495 1.118 . . . . 0.0 109.896 -172.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -62.62 -17.31 60.05 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 174.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -66.09 -22.29 66.4 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 127.212 2.205 . . . . 0.0 114.623 164.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -142.6 66.22 18.06 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 128.29 2.636 . . . . 0.0 109.637 177.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -70.23 162.0 43.93 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.318 2.679 . . . . 0.0 113.424 -163.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -77.53 170.01 17.3 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.845 0.831 . . . . 0.0 111.106 166.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.482 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 89.8 p -124.69 170.31 11.11 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 126.003 1.721 . . . . 0.0 109.846 178.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.4 p30 -53.98 -32.65 54.68 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -68.54 -54.67 15.25 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 119.776 -1.827 . . . . 0.0 110.789 168.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.482 ' HB2' ' H ' ' A' ' 26' ' ' SER . 91.9 mt-10 -62.55 -47.85 82.06 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 120.704 -1.247 . . . . 0.0 112.714 -173.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.3 pt -58.94 -38.92 76.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-N 119.871 1.214 . . . . 0.0 112.317 172.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.8 -35.41 78.11 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.543 1.065 . . . . 0.0 111.892 176.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -68.87 -52.62 27.69 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.518 1.127 . . . . 0.0 112.74 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.7 mt -64.03 -33.18 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 118.841 0.746 . . . . 0.0 111.269 -177.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.13 -24.93 68.12 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.369 1.468 . . . . 0.0 112.486 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -14.82 58.26 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 176.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -86.5 -13.19 46.73 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.436 0.694 . . . . 0.0 112.017 -178.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.1 ptpt -126.49 -22.55 3.95 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -172.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.04 2.54 0.08 OUTLIER Glycine 0 N--CA 1.47 0.933 0 CA-C-N 119.562 1.074 . . . . 0.0 115.668 151.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -87.16 -23.12 24.92 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 118.331 1.065 . . . . 0.0 113.303 -168.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.8 30.88 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 130.351 3.461 . . . . 0.0 115.109 -175.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.567 HG21 HD22 ' A' ' 8' ' ' LEU . 3.0 p -82.07 138.55 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.56 0.695 . . . . 0.0 109.226 -174.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.9 161.59 24.31 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 127.894 2.478 . . . . 0.0 112.033 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.63 -27.57 67.89 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 125.386 1.474 . . . . 0.0 113.853 -178.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.28 -32.51 72.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.118 0.967 . . . . 0.0 111.956 -177.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 m -84.09 -51.35 7.15 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 128.298 2.639 . . . . 0.0 109.914 -177.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.57 -29.06 45.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.848 -172.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.6 94.65 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.303 1.441 . . . . 0.0 110.91 176.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -71.43 -16.63 62.39 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.509 0.723 . . . . 0.0 112.487 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -85.97 -51.61 6.25 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.222 1.009 . . . . 0.0 112.267 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -54.36 -25.42 24.19 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.035 0.834 . . . . 0.0 112.679 175.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -68.77 -40.32 79.77 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.331 1.452 . . . . 0.0 113.025 178.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -92.88 -25.44 18.08 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -173.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.617 HD21 ' HG3' ' A' ' 9' ' ' MET . 0.8 OUTLIER -71.2 -60.56 2.17 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.625 1.17 . . . . 0.0 112.013 177.705 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 177.17 -0.6 0.03 OUTLIER Glycine 0 CA--C 1.534 1.254 0 N-CA-C 118.141 2.016 . . . . 0.0 118.141 172.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.8 mt -86.85 129.13 53.54 Favored Pre-proline 0 CA--C 1.546 0.794 0 CA-C-N 119.518 1.659 . . . . 0.0 110.628 -177.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.41 -60.02 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.827 2.351 . . . . 0.0 110.387 174.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.5 p -153.27 -7.47 0.17 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 163.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.403 ' HA ' ' HE ' ' A' ' 61' ' ' ARG . 28.9 m 59.26 -21.55 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.977 2.511 . . . . 0.0 116.199 -164.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.7 ttt85 -67.56 -43.15 81.34 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.923 1.238 . . . . 0.0 108.585 170.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -25.6 60.41 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.403 ' HE ' ' HA ' ' A' ' 58' ' ' SER . 57.3 mtm180 -71.3 -43.47 67.05 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.197 1.399 . . . . 0.0 112.244 169.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -74.19 -61.04 1.99 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.682 1.593 . . . . 0.0 113.31 -176.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.1 tp . . . . . 0 C--O 1.255 1.355 0 C-N-CA 126.515 1.926 . . . . 0.0 114.593 -166.108 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.793 0 C4'-C3'-C2' 100.425 -2.775 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.451 0 N19-C1'-C2' 109.71 -2.806 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.586 1 O4'-C1'-N19 112.198 5.497 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.899 0 O4'-C4'-C3' 108.365 2.765 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.734 0 O4'-C1'-N19 109.871 2.588 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.903 0 P-O3'-C3' 123.293 2.994 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.227 0 O4'-C1'-N19 110.137 2.921 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.101 0 P-O3'-C3' 122.919 2.682 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.497 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.684 1 O4'-C1'-N19 111.464 4.58 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.479 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.536 0 C4'-C3'-C2' 99.214 -3.986 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.259 0 O4'-C1'-N19 110.886 3.857 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.425 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.426 0 O4'-C4'-C3' 108.875 3.275 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.425 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.185 0 P-O3'-C3' 123.8 3.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.203 0 C4'-C3'-C2' 100.022 -3.178 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.706 0 N19-C1'-C2' 108.677 -3.452 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.107 0 C3'-C2'-C1' 106.674 2.839 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.469 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.538 0 C4'-C3'-C2' 99.637 -3.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.469 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.415 0 C3'-C2'-C1' 106.629 2.807 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.479 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.389 1 O4'-C1'-N19 112.565 5.956 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.497 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.522 2 O4'-C1'-N19 117.244 11.805 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.102 0 O4'-C1'-N19 109.935 2.668 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.69 0 N19-C1'-C2' 110.757 -2.152 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.717 0 O4'-C4'-C3' 109.147 3.547 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.296 0 P-O3'-C3' 122.911 2.675 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.796 0 O4'-C1'-N19 110.174 2.968 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.347 0 P-O3'-C3' 124.343 3.869 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.044 0 P-O3'-C3' 122.843 2.619 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.137 0 P-O3'-C3' 122.61 2.425 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 9.5 p-80 . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.2 mmt -127.75 -22.12 3.62 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.728 HD12 HD23 ' A' ' 8' ' ' LEU . 63.8 mt -123.73 -172.94 2.63 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.986 1.714 . . . . 0.0 113.23 -169.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 42.9 p -72.19 -163.09 0.1 Allowed 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 125.68 1.592 . . . . 0.0 112.635 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -48.16 -25.35 1.44 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.065 1.346 . . . . 0.0 114.335 169.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 176.14 53.96 0.06 OUTLIER Glycine 0 CA--C 1.527 0.808 0 CA-C-O 118.728 -1.04 . . . . 0.0 114.276 168.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -64.87 -13.54 56.66 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.688 1.744 . . . . 0.0 114.202 -175.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.728 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -106.0 -19.7 13.65 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.218 1.007 . . . . 0.0 113.113 168.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.583 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.0 ttp -72.25 -60.21 2.35 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.092 1.757 . . . . 0.0 110.68 -177.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.467 ' C ' HD22 ' A' ' 11' ' ' LEU . 9.3 pttp -75.28 15.78 0.41 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.601 1.16 . . . . 0.0 113.459 -173.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.467 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.6 mm? -127.03 -41.59 1.78 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 129.404 3.082 . . . . 0.0 111.391 -170.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.0 pt -60.95 -33.83 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 119.069 0.85 . . . . 0.0 112.125 178.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -17.58 44.65 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 175.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -96.71 -13.03 23.01 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 126.439 1.896 . . . . 0.0 111.929 -170.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.28 -48.7 9.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.183 0 C-N-CA 124.482 1.113 . . . . 0.0 108.776 167.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.2 -32.49 57.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 120.282 1.401 . . . . 0.0 111.434 -172.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -78.29 -2.76 39.52 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.381 -0.824 . . . . 0.0 112.893 175.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -117.22 -9.19 11.03 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.432 1.893 . . . . 0.0 113.816 -172.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -102.66 -97.78 0.29 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.003 0.82 . . . . 0.0 112.263 -170.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -137.33 83.21 1.98 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.588 1.155 . . . . 0.0 110.219 -177.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -62.46 -17.96 60.67 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 175.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.51 ' H ' ' HD3' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -79.96 -12.48 59.72 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.814 2.046 . . . . 0.0 114.799 168.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -145.06 67.06 13.17 Favored Pre-proline 0 N--CA 1.48 1.075 0 C-N-CA 127.368 2.267 . . . . 0.0 109.624 175.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.15 165.44 32.7 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.956 2.437 . . . . 0.0 112.99 -164.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -77.34 -175.49 3.74 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.684 1.194 . . . . 0.0 111.416 167.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.506 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 93.2 p -136.64 170.87 15.35 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.651 1.98 . . . . 0.0 109.634 171.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.5 p30 -54.03 -32.14 53.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 172.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -67.76 -54.11 21.88 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.011 -1.681 . . . . 0.0 110.691 169.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.506 ' HB2' ' H ' ' A' ' 26' ' ' SER . 22.1 mm-40 -62.45 -47.93 81.86 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 120.812 -1.18 . . . . 0.0 112.663 -174.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.4 pt -58.97 -39.13 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.625 1.102 . . . . 0.0 112.096 173.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.78 -35.37 79.62 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.578 1.081 . . . . 0.0 111.943 176.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -69.18 -52.34 28.89 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.439 1.096 . . . . 0.0 112.819 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.3 mt -64.22 -33.65 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 O-C-N 121.437 -0.789 . . . . 0.0 111.19 -178.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -62.11 -25.65 67.84 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.238 1.415 . . . . 0.0 112.644 176.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -79.01 -15.78 57.79 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -87.21 -12.73 45.96 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 123.446 0.698 . . . . 0.0 112.144 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.0 ptpt -126.79 -21.48 4.05 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -173.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.79 2.21 0.07 OUTLIER Glycine 0 N--CA 1.472 1.083 0 N-CA-C 115.932 1.133 . . . . 0.0 115.932 153.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -90.42 -19.75 23.57 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 118.334 1.067 . . . . 0.0 113.43 -167.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 35.82 25.17 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 130.699 3.6 . . . . 0.0 116.095 -175.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.548 HG21 HD22 ' A' ' 8' ' ' LEU . 2.6 p -81.75 137.93 20.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -169.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.39 158.73 31.13 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.148 2.179 . . . . 0.0 112.093 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -55.64 -30.81 61.63 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.841 1.257 . . . . 0.0 113.243 175.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -66.37 -34.36 77.8 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.117 1.367 . . . . 0.0 111.615 -174.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.8 m -83.66 -51.91 6.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 129.036 2.934 . . . . 0.0 109.882 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.93 -30.93 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.932 -173.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.84 -34.7 77.22 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.862 1.665 . . . . 0.0 111.788 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -84.18 -9.55 58.46 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.416 1.086 . . . . 0.0 112.989 176.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -90.03 -51.37 5.5 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.82 1.248 . . . . 0.0 112.297 176.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -20.31 5.96 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 174.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -65.26 -42.59 93.11 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.761 1.625 . . . . 0.0 113.143 173.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -94.61 -26.33 16.41 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.583 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.1 mt -73.73 -59.69 2.6 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.404 1.082 . . . . 0.0 112.166 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.89 -8.47 0.03 OUTLIER Glycine 0 CA--C 1.533 1.213 0 N-CA-C 118.142 2.017 . . . . 0.0 118.142 167.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.4 mt -69.6 121.63 83.04 Favored Pre-proline 0 CA--C 1.542 0.642 0 CA-C-N 119.439 1.62 . . . . 0.0 110.743 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.88 -64.36 0.05 OUTLIER 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.116 2.544 . . . . 0.0 109.308 178.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.1 p -150.94 -10.17 0.24 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.122 1.369 . . . . 0.0 114.422 158.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.3 m 56.85 -17.82 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 128.389 2.676 . . . . 0.0 116.455 -163.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -67.21 -42.34 84.29 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 120.308 1.413 . . . . 0.0 108.743 166.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.81 -22.11 60.87 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -71.27 -46.49 60.8 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.643 1.577 . . . . 0.0 111.667 166.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -75.37 -59.44 2.75 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.515 1.926 . . . . 0.0 113.405 -170.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 C--O 1.253 1.285 0 C-N-CA 127.384 2.274 . . . . 0.0 114.525 -167.596 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.633 0 C4'-C3'-C2' 100.396 -2.804 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.492 1 O4'-C1'-N19 111.133 4.166 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.61 1 O4'-C1'-N19 111.872 5.09 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.944 0 O4'-C1'-N19 110.038 2.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.107 0 P-O3'-C3' 123.609 3.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.703 0 P-O3'-C3' 122.893 2.661 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.145 0 O4'-C1'-N19 110.755 3.694 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.503 0 P-O3'-C3' 123.075 2.812 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.523 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.531 0 O4'-C1'-N19 110.571 3.464 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.409 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.073 1 C4'-C3'-C2' 99.076 -4.124 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.276 1 O4'-C1'-N19 111.371 4.463 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.485 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.496 0 O4'-C4'-C3' 108.806 3.206 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.485 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.314 0 P-O3'-C3' 123.459 3.132 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.411 0 C4'-C3'-C2' 99.774 -3.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.705 0 N19-C1'-C2' 109.288 -3.07 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.281 0 C3'-C2'-C1' 106.731 2.879 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.489 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.127 0 C4'-C3'-C2' 99.586 -3.614 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.489 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.309 0 C3'-C2'-C1' 106.408 2.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.409 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.416 0 P-O3'-C3' 123.468 3.14 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.523 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.953 1 O4'-C1'-N19 115.781 9.976 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.26 1 O4'-C1'-N19 111.03 4.038 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.583 0 O4'-C4'-C3' 108.961 3.361 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.173 0 O4'-C4'-C3' 108.742 3.142 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.976 0 C4'-C3'-C2' 100.134 -3.066 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C4'-C3' 108.379 2.779 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.261 0 P-O3'-C3' 124.111 3.676 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.912 0 O4'-C4'-C3' 108.291 2.691 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.739 0 P-O3'-C3' 122.596 2.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 . . . . . 0 N--CA 1.484 1.235 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -117.99 -27.51 6.13 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 -160.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.777 HD12 HD23 ' A' ' 8' ' ' LEU . 20.6 mt -86.56 169.14 13.04 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -174.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 60.2 p -73.44 -172.59 1.21 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.035 1.334 . . . . 0.0 111.582 171.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -51.86 -23.58 5.03 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.206 1.402 . . . . 0.0 114.73 172.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.64 29.44 0.24 Allowed Glycine 0 C--N 1.34 0.781 0 CA-C-O 117.339 -1.812 . . . . 0.0 116.939 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -62.01 -10.81 10.86 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 121.784 2.792 . . . . 0.0 113.82 178.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.777 HD23 HD12 ' A' ' 3' ' ' LEU . 1.9 pp -111.18 -16.89 13.33 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.624 1.17 . . . . 0.0 113.508 166.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.411 ' HG3' HD11 ' A' ' 53' ' ' LEU . 6.3 ttt -68.3 -67.06 0.49 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.224 1.41 . . . . 0.0 110.339 176.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.501 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.9 pttp -73.79 15.88 0.25 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.406 1.482 . . . . 0.0 113.673 -172.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.501 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -127.4 -35.15 2.2 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 128.798 2.839 . . . . 0.0 111.822 -172.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -61.3 -29.96 46.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.471 1.032 . . . . 0.0 112.023 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.52 -9.53 23.2 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -178.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -88.74 -16.61 31.78 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 125.64 1.576 . . . . 0.0 111.56 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 pp -101.45 -51.81 9.06 Favored 'Isoleucine or valine' 0 C--N 1.342 0.265 0 C-N-CA 123.974 0.91 . . . . 0.0 108.786 168.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.7 t -63.88 -35.48 73.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 120.378 1.444 . . . . 0.0 111.325 -172.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -80.77 -0.74 39.96 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -109.9 -19.78 12.99 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.752 1.621 . . . . 0.0 112.991 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -93.82 -95.47 0.16 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.741 0.816 . . . . 0.0 112.202 -167.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -139.98 85.53 2.03 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.194 0.998 . . . . 0.0 110.971 -175.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -58.05 -22.34 49.62 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.571 1.149 . . . . 0.0 113.354 168.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 -68.79 -23.83 64.33 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.079 2.152 . . . . 0.0 114.598 169.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -147.29 70.7 11.87 Favored Pre-proline 0 N--CA 1.481 1.115 0 C-N-CA 127.67 2.388 . . . . 0.0 109.771 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -76.82 173.58 14.24 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.167 2.578 . . . . 0.0 113.772 -165.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -89.8 -175.03 4.5 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.832 1.653 . . . . 0.0 112.158 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.7 p -140.08 175.99 9.13 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 126.749 2.02 . . . . 0.0 109.515 172.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 40.3 p-10 -49.28 -47.3 46.88 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 173.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -60.01 -51.17 70.78 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.025 -1.672 . . . . 0.0 110.706 173.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.418 ' O ' HD12 ' A' ' 33' ' ' ILE . 6.8 mm-40 -66.97 -43.39 83.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 120.934 -1.104 . . . . 0.0 113.366 -174.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 pt -60.07 -39.87 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 120.366 1.439 . . . . 0.0 111.881 171.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.84 -35.76 77.39 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.83 1.195 . . . . 0.0 112.257 174.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -67.66 -51.68 46.99 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.713 1.605 . . . . 0.0 112.323 -178.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.488 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -67.55 -32.68 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 O-C-N 121.372 -0.83 . . . . 0.0 111.598 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mp -63.53 -23.14 67.27 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.011 1.324 . . . . 0.0 112.022 175.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -82.37 -14.27 55.53 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 176.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -85.3 -13.33 50.03 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.463 0.705 . . . . 0.0 112.135 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.488 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.8 ptpt -127.38 -21.64 3.82 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -172.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.28 1.37 0.09 OUTLIER Glycine 0 N--CA 1.468 0.83 0 N-CA-C 115.521 0.968 . . . . 0.0 115.521 150.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.463 ' HB3' HD11 ' A' ' 3' ' ' LEU . 54.1 m-85 -85.1 -29.47 24.84 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.405 1.102 . . . . 0.0 112.59 -169.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.3 ptmt 28.84 41.81 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 130.388 3.475 . . . . 0.0 114.185 -173.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.665 HG21 HD22 ' A' ' 8' ' ' LEU . 2.4 p -79.78 139.73 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.305 1.042 . . . . 0.0 108.244 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.71 163.68 24.32 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.103 2.161 . . . . 0.0 112.515 177.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -61.78 -30.15 70.61 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 125.545 1.538 . . . . 0.0 114.205 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -71.96 -31.12 66.0 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.62 1.1 . . . . 0.0 111.791 -175.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 m -79.45 -48.89 13.17 Favored 'General case' 0 CA--C 1.505 -0.761 0 C-N-CA 125.853 1.661 . . . . 0.0 108.848 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -64.79 -32.06 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 CA-C-N 115.003 -0.998 . . . . 0.0 110.615 -176.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.95 -36.92 67.27 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 125.218 1.407 . . . . 0.0 112.354 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -75.64 -15.17 60.36 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.954 1.302 . . . . 0.0 112.655 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -90.28 -49.54 6.48 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.249 1.42 . . . . 0.0 111.991 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -22.8 26.63 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.426 1.012 . . . . 0.0 112.963 169.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -69.15 -45.3 70.41 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.706 1.202 . . . . 0.0 112.683 171.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 13.8 ptt? -87.08 -28.98 22.22 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.917 0.887 . . . . 0.0 113.283 -170.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.411 HD11 ' HG3' ' A' ' 9' ' ' MET . 1.3 mp -67.24 -65.52 0.67 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.505 1.122 . . . . 0.0 111.088 172.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.75 6.55 0.03 OUTLIER Glycine 0 CA--C 1.537 1.407 0 N-CA-C 119.594 2.598 . . . . 0.0 119.594 169.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 59.5 mt -82.91 124.13 77.16 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 120.399 2.099 . . . . 0.0 111.839 -173.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -51.57 -60.9 0.63 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 124.967 3.778 . . . . 0.0 112.852 170.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 90.7 p -162.41 -18.43 0.04 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 165.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 60.8 m 61.41 0.56 0.46 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.464 1.905 . . . . 0.0 115.181 -163.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -85.99 -16.28 38.82 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.797 1.639 . . . . 0.0 111.681 165.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.25 -14.01 9.28 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.311 1.444 . . . . 0.0 114.36 -176.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -70.8 -45.92 63.76 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.12 1.368 . . . . 0.0 112.032 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -76.07 -56.22 4.86 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.706 1.603 . . . . 0.0 112.728 -173.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 C--O 1.254 1.297 0 C-N-CA 126.923 2.089 . . . . 0.0 114.529 -168.543 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.694 0 C4'-C3'-C2' 100.2 -3.0 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.548 0 O4'-C1'-N19 110.881 3.851 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.154 1 O4'-C1'-N19 112.273 5.592 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.53 0 O4'-C4'-C3' 108.689 3.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . 0.466 ' H1 ' ' N4 ' ' C' ' 87' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.533 2.729 0 O5'-C5'-C4' 113.637 2.455 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.128 0 P-O3'-C3' 123.899 3.5 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.861 0 O4'-C1'-N19 110.611 3.513 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.981 0 P-O3'-C3' 122.971 2.726 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.54 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.137 1 O4'-C1'-N19 111.434 4.542 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.429 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.265 1 C4'-C3'-C2' 98.954 -4.246 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.408 -3.45 0 O4'-C1'-N19 110.79 3.737 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.438 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.174 0 O4'-C4'-C3' 108.991 3.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.438 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.179 0 P-O3'-C3' 123.411 3.093 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.163 0 C4'-C3'-C2' 99.814 -3.386 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.639 0 N19-C1'-C2' 108.539 -3.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.32 0 C3'-C2'-C1' 107.086 3.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.456 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.268 0 C4'-C3'-C2' 99.602 -3.598 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.456 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.54 0 P-O3'-C3' 122.526 2.355 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.429 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.554 1 O4'-C1'-N19 113.744 7.43 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.54 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.689 2 O4'-C1'-N19 117.836 12.544 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.31 1 O4'-C1'-N19 111.288 4.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.307 0 C3'-C2'-C1' 105.624 2.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.387 0 O4'-C4'-C3' 108.642 3.042 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . 0.466 ' N4 ' ' H1 ' ' B' ' 68' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.16 0 C4'-C3'-C2' 100.118 -3.082 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.378 0 O4'-C4'-C3' 108.411 2.811 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.847 0 O4'-C4'-C3' 108.558 2.958 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.275 0 O4'-C4'-C3' 108.572 2.972 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.804 0 P-O3'-C3' 122.694 2.495 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.8 p80 . . . . . 0 N--CA 1.483 1.204 0 CA-C-O 120.891 0.377 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 50.5 mtt -131.86 -47.6 0.95 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.905 1.282 . . . . 0.0 112.428 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.744 HD12 HD23 ' A' ' 8' ' ' LEU . 32.1 mt -100.32 177.91 4.91 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.541 1.536 . . . . 0.0 113.334 -174.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 38.9 p -73.44 -164.31 0.19 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.009 1.724 . . . . 0.0 112.571 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -49.06 -24.98 1.79 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.433 1.493 . . . . 0.0 114.468 169.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 178.83 51.23 0.08 OUTLIER Glycine 0 C--N 1.341 0.807 0 CA-C-O 118.598 -1.112 . . . . 0.0 114.53 169.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.64 -13.88 55.7 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.913 1.857 . . . . 0.0 113.947 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.744 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -106.37 -19.18 13.77 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.464 1.105 . . . . 0.0 113.106 167.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.472 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.5 ttt -72.65 -57.97 3.72 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.322 1.849 . . . . 0.0 111.196 -175.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.479 ' C ' HD22 ' A' ' 11' ' ' LEU . 9.0 pttp -77.08 15.71 0.66 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.691 1.196 . . . . 0.0 113.046 -174.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.479 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -126.27 -40.91 1.94 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 129.473 3.109 . . . . 0.0 110.899 -170.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 pt -61.68 -37.85 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 118.776 0.717 . . . . 0.0 111.356 -178.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.94 -16.47 50.4 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -98.25 -16.15 19.54 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 126.452 1.901 . . . . 0.0 112.016 -168.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -99.09 -43.5 11.55 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 C-N-CA 124.737 1.215 . . . . 0.0 109.379 167.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.65 -32.09 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 119.818 1.19 . . . . 0.0 111.139 -175.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -77.99 -3.92 44.43 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 121.453 -0.779 . . . . 0.0 112.92 174.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -105.33 -16.24 14.81 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.721 1.608 . . . . 0.0 112.551 -176.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -101.31 -97.48 0.27 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.713 0.688 . . . . 0.0 112.393 -169.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -137.01 87.8 2.31 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.391 1.077 . . . . 0.0 110.13 -177.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -59.79 -17.51 36.18 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.651 1.18 . . . . 0.0 114.163 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -93.87 -2.55 53.23 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.431 1.892 . . . . 0.0 114.595 171.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -142.57 63.94 15.06 Favored Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 127.755 2.422 . . . . 0.0 110.45 174.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -71.21 160.38 49.15 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.274 2.65 . . . . 0.0 112.743 -165.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -74.53 -178.59 3.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.998 0.919 . . . . 0.0 111.066 164.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.484 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 46.5 p -142.84 172.93 12.02 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.387 1.475 . . . . 0.0 109.96 172.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -55.11 -33.53 62.92 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.83 1.418 . . . . 0.0 114.83 -174.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.8 tp60 -67.2 -51.03 58.42 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 120.159 -1.588 . . . . 0.0 110.661 169.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.484 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.3 mm-40 -62.39 -50.56 71.04 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 120.959 -1.088 . . . . 0.0 111.949 -173.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 pt -58.97 -37.82 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.455 1.025 . . . . 0.0 112.424 174.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.86 -34.94 78.42 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.307 0.958 . . . . 0.0 112.047 177.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -69.1 -52.0 32.81 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.413 1.085 . . . . 0.0 112.659 -178.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.463 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -63.95 -32.88 58.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 O-C-N 121.413 -0.804 . . . . 0.0 111.4 -177.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.74 -22.89 67.14 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.28 1.432 . . . . 0.0 112.736 175.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.7 ptmt -81.31 -14.62 57.14 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.663 -0.648 . . . . 0.0 112.736 175.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -85.93 -14.02 46.0 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.305 0.642 . . . . 0.0 111.969 -178.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.1 ptpt -126.66 -22.23 3.95 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -171.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.95 1.99 0.07 OUTLIER Glycine 0 N--CA 1.47 0.961 0 N-CA-C 115.82 1.088 . . . . 0.0 115.82 151.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -87.82 -27.19 22.42 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.314 1.057 . . . . 0.0 112.839 -168.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.0 ptmt 30.49 40.51 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 130.101 3.36 . . . . 0.0 114.253 -173.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.629 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -82.51 141.43 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.412 ' H ' ' P ' ' C' ' 84' ' ' ' DT' . . . -82.35 166.35 19.54 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 127.433 2.293 . . . . 0.0 112.449 176.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -64.56 -24.87 67.74 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.309 1.444 . . . . 0.0 114.587 -174.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -70.28 -39.03 75.16 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.16 -0.963 . . . . 0.0 111.948 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.1 m -78.74 -45.82 20.3 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 126.588 1.955 . . . . 0.0 109.003 -175.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.47 -32.5 58.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.093 -176.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.2 -35.92 74.25 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.595 1.558 . . . . 0.0 111.949 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.0 mttm -78.54 -18.95 53.94 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.592 1.157 . . . . 0.0 112.41 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -82.01 -48.44 11.43 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.46 1.104 . . . . 0.0 112.616 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.05 -20.76 10.26 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 175.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -68.54 -46.6 69.1 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.76 1.224 . . . . 0.0 112.822 173.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -82.87 -27.14 30.97 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -173.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.472 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.3 mt -70.61 -59.77 2.64 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.476 1.11 . . . . 0.0 111.724 176.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.59 6.04 0.03 OUTLIER Glycine 0 CA--C 1.535 1.305 0 N-CA-C 118.714 2.246 . . . . 0.0 118.714 169.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.8 mt -90.15 126.58 56.53 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 119.898 1.849 . . . . 0.0 111.157 -173.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.48 -52.04 0.29 Allowed 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.447 2.765 . . . . 0.0 111.034 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.1 p -160.68 -10.68 0.05 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.386 1.624 . . . . 0.0 115.386 161.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.6 m 64.63 -19.5 0.08 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 128.059 2.544 . . . . 0.0 115.731 -166.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.8 ttp180 -69.13 -36.94 78.03 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.626 1.171 . . . . 0.0 109.373 171.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -24.71 33.25 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.555 1.142 . . . . 0.0 113.576 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -74.01 -40.07 63.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.212 1.405 . . . . 0.0 112.704 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -63.69 -63.48 1.16 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 126.053 1.741 . . . . 0.0 112.277 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.6 tp . . . . . 0 C--O 1.253 1.267 0 C-N-CA 126.729 2.012 . . . . 0.0 114.357 -167.715 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.758 0 O5'-C5'-C4' 114.267 2.905 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.482 1 O4'-C1'-N19 112.17 5.462 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.659 1 O4'-C1'-N19 111.731 4.914 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.971 0 O4'-C1'-N19 110.714 3.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . 0.46 ' H1 ' ' N4 ' ' C' ' 87' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.081 0 P-O3'-C3' 123.314 3.012 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.151 0 P-O3'-C3' 123.163 2.885 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.931 1 O4'-C1'-N19 111.143 4.179 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.251 0 P-O3'-C3' 123.215 2.929 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.497 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.582 1 O4'-C1'-N19 111.013 4.016 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.468 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.381 1 C4'-C3'-C2' 98.956 -4.244 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.275 1 O4'-C1'-N19 111.306 4.382 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.479 " H2'" ' H72' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.401 0 O4'-C4'-C3' 108.857 3.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.479 ' H72' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.217 0 P-O3'-C3' 123.578 3.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.317 0 C4'-C3'-C2' 99.847 -3.353 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.761 0 N19-C1'-C2' 108.707 -3.433 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.208 0 O4'-C1'-N19 110.246 3.058 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.547 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.418 0 P-O3'-C3' 123.747 3.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.547 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.362 0 O4'-C4'-C3' 108.649 3.049 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.468 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.744 0 O4'-C1'-N19 110.893 3.867 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.497 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.096 2 O4'-C1'-N19 117.474 12.093 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . 0.412 ' P ' ' H ' ' A' ' 42' ' ' ALA . . . . . . . . 0 C5'--C4' 1.536 3.165 0 O4'-C1'-N19 110.393 3.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.659 0 O4'-C4'-C3' 109.361 3.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.551 0 O4'-C4'-C3' 108.443 2.843 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . 0.46 ' N4 ' ' H1 ' ' B' ' 68' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.222 0 P-O3'-C3' 123.116 2.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.985 0 O4'-C1'-N19 110.891 3.864 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.503 0 P-O3'-C3' 122.978 2.732 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 0 O4'-C4'-C3' 108.345 2.745 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.927 0 P-O3'-C3' 122.799 2.583 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 119.767 -0.158 . . . . 0.0 111.041 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 10.5 ttt 57.07 15.9 2.64 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 117.384 2.365 . . . . 0.0 117.384 156.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.796 HD12 HD23 ' A' ' 8' ' ' LEU . 34.2 mt -61.63 170.41 1.95 Allowed 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 -175.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.7 p -75.15 -167.33 0.6 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.196 1.799 . . . . 0.0 113.004 -177.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -48.75 -24.68 1.49 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.638 1.575 . . . . 0.0 114.697 173.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.69 44.72 0.11 Allowed Glycine 0 C--N 1.341 0.857 0 CA-C-O 117.874 -1.514 . . . . 0.0 115.745 170.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -61.87 -13.98 29.49 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.612 2.206 . . . . 0.0 113.487 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.796 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -112.33 -17.55 12.7 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.969 1.308 . . . . 0.0 113.228 168.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.416 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.5 ttt -72.0 -60.54 2.18 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.198 1.399 . . . . 0.0 111.166 -176.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.458 ' C ' HD22 ' A' ' 11' ' ' LEU . 16.3 pttt -75.17 18.86 0.17 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.378 1.071 . . . . 0.0 113.624 -174.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.458 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -126.22 -43.77 1.77 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 129.318 3.047 . . . . 0.0 110.168 -171.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.5 pt -63.19 -32.02 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 118.268 0.486 . . . . 0.0 112.078 -173.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.46 -14.85 23.39 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -89.86 -14.28 34.67 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.785 2.034 . . . . 0.0 111.673 -176.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -105.47 -52.38 7.54 Favored 'Isoleucine or valine' 0 C--N 1.341 0.214 0 C-N-CA 124.34 1.056 . . . . 0.0 108.72 167.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.77 -36.88 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 120.608 1.549 . . . . 0.0 111.382 -170.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -87.24 9.28 20.72 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -116.96 -24.35 7.64 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.028 1.731 . . . . 0.0 112.99 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -85.6 -79.32 0.24 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.415 1.086 . . . . 0.0 111.282 -171.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -139.2 86.7 2.15 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.561 1.144 . . . . 0.0 110.747 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -59.68 -19.37 49.15 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.278 1.031 . . . . 0.0 113.615 170.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -16.94 39.03 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 127.217 2.207 . . . . 0.0 114.654 171.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -148.21 72.76 11.07 Favored Pre-proline 0 N--CA 1.481 1.116 0 C-N-CA 127.175 2.19 . . . . 0.0 110.386 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -72.75 168.35 24.79 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.054 2.503 . . . . 0.0 113.236 -170.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -78.93 -173.81 3.71 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.212 1.405 . . . . 0.0 110.629 166.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.485 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 91.1 p -133.93 172.54 12.67 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.898 1.679 . . . . 0.0 109.284 171.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -65.76 -23.52 66.75 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.292 -0.88 . . . . 0.0 112.453 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -68.74 -54.15 17.74 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.418 -1.426 . . . . 0.0 110.665 165.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.485 ' HB2' ' H ' ' A' ' 26' ' ' SER . 19.5 mm-40 -61.96 -48.0 82.32 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 120.843 -1.161 . . . . 0.0 112.606 -174.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 pt -60.83 -38.61 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-N 119.544 1.066 . . . . 0.0 112.207 173.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.74 -34.48 75.9 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.631 1.105 . . . . 0.0 111.712 177.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -67.81 -55.44 12.98 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.676 1.191 . . . . 0.0 112.886 178.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.447 HG22 ' HE2' ' A' ' 37' ' ' LYS . 1.9 mt -64.83 -32.54 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 O-C-N 121.463 -0.773 . . . . 0.0 111.167 -176.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.3 -22.64 66.2 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.74 1.216 . . . . 0.0 112.214 176.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 pttm -81.86 -13.03 58.17 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 175.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -90.01 -9.28 49.21 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.503 0.721 . . . . 0.0 112.191 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.447 ' HE2' HG22 ' A' ' 33' ' ' ILE . 23.6 pttt -127.61 -23.3 3.47 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 114.862 1.431 . . . . 0.0 114.862 -176.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 154.35 4.53 0.11 Allowed Glycine 0 N--CA 1.471 1.033 0 CA-C-N 119.377 0.99 . . . . 0.0 115.418 151.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.48 ' HB3' HD11 ' A' ' 3' ' ' LEU . 45.2 m-85 -84.46 -31.35 24.61 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 118.148 0.974 . . . . 0.0 111.943 -171.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.1 ptmt 26.11 50.7 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 129.802 3.241 . . . . 0.0 113.01 -172.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.694 HG21 HD22 ' A' ' 8' ' ' LEU . 4.8 p -88.12 140.62 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.648 1.579 . . . . 0.0 108.77 171.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.6 165.33 17.13 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 129.025 2.93 . . . . 0.0 113.309 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -25.62 68.08 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.471 1.908 . . . . 0.0 114.65 -175.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -34.45 75.93 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.823 1.249 . . . . 0.0 110.785 -178.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 m -87.18 -47.05 9.19 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 127.407 2.283 . . . . 0.0 110.509 -176.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.23 -28.7 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.875 -173.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.95 -37.23 72.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.176 1.79 . . . . 0.0 113.129 174.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -70.54 -23.65 62.66 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.262 1.025 . . . . 0.0 112.281 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -80.5 -40.72 25.56 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -175.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -55.4 -25.15 34.07 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 118.943 0.792 . . . . 0.0 112.629 174.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -70.15 -38.13 75.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 176.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.5 ptp -81.09 -26.66 36.07 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.416 HD21 ' HG3' ' A' ' 9' ' ' MET . 2.1 mt -73.61 -59.76 2.56 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.345 1.058 . . . . 0.0 111.758 172.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 156.12 15.03 0.05 OUTLIER Glycine 0 CA--C 1.536 1.344 0 N-CA-C 117.648 1.819 . . . . 0.0 117.648 167.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.1 mt -117.49 133.23 23.27 Favored Pre-proline 0 CA--C 1.548 0.874 0 CA-C-N 119.2 1.5 . . . . 0.0 111.328 -167.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -71.74 -52.83 0.19 Allowed 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.926 3.084 . . . . 0.0 113.793 -177.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.9 p -156.35 -9.2 0.1 Allowed 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.6 m 61.78 -13.97 0.05 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.144 2.178 . . . . 0.0 115.568 -166.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -85.23 -36.69 20.79 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.753 1.621 . . . . 0.0 110.476 176.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -20.23 57.7 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 177.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 64.4 mtp85 -70.43 -42.2 71.89 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.047 1.739 . . . . 0.0 111.977 167.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -70.65 -59.17 2.98 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.392 1.877 . . . . 0.0 113.224 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.9 tp . . . . . 0 C--O 1.255 1.355 0 C-N-CA 126.593 1.957 . . . . 0.0 114.595 -166.816 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.613 0 C4'-C3'-C2' 100.374 -2.826 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.548 0 O4'-C1'-N19 110.06 2.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.491 1 O4'-C1'-N19 113.303 6.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.501 0 O4'-C1'-N19 110.604 3.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.733 0 P-O3'-C3' 123.868 3.473 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.495 0 P-O3'-C3' 123.075 2.812 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.092 0 O4'-C1'-N19 110.83 3.788 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.803 0 P-O3'-C3' 123.155 2.879 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.52 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.454 0 O4'-C1'-N19 110.87 3.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.466 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.536 1 C4'-C3'-C2' 99.016 -4.184 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.533 1 O4'-C1'-N19 111.338 4.422 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.447 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.504 0 O4'-C4'-C3' 108.765 3.165 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.447 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.405 0 P-O3'-C3' 123.984 3.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.385 0 C4'-C3'-C2' 99.974 -3.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.737 0 N19-C1'-C2' 108.782 -3.386 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.394 0 C3'-C2'-C1' 106.883 2.988 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.5 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.47 0 C4'-C3'-C2' 99.566 -3.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.5 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.272 0 C3'-C2'-C1' 106.563 2.759 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.466 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.53 1 O4'-C1'-N19 112.052 5.315 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.52 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.535 2.959 2 O4'-C1'-N19 117.638 12.297 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.058 1 O4'-C1'-N19 111.878 5.098 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.804 0 O4'-C4'-C3' 109.538 3.938 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.595 0 C3'-C2'-C1' 106.158 2.47 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.542 0 C4'-C3'-C2' 100.654 -2.546 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.543 0 O4'-C1'-N19 110.469 3.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.248 0 P-O3'-C3' 123.805 3.421 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.229 0 O4'-C4'-C3' 108.239 2.639 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.045 0 P-O3'-C3' 122.599 2.416 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 . . . . . 0 N--CA 1.481 1.079 0 CA-C-O 119.517 -0.277 . . . . 0.0 111.553 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.7 ptt? 48.61 15.79 0.09 Allowed 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 118.238 2.681 . . . . 0.0 118.238 168.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.78 HD12 HD23 ' A' ' 8' ' ' LEU . 39.1 mt -54.47 171.57 0.12 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 127.642 2.377 . . . . 0.0 116.605 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.9 p -72.34 -168.11 0.39 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.102 1.761 . . . . 0.0 112.7 -178.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -48.7 -24.4 1.37 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.446 1.498 . . . . 0.0 114.72 172.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.54 41.18 0.11 Allowed Glycine 0 CA--C 1.527 0.817 0 CA-C-O 117.75 -1.583 . . . . 0.0 115.769 173.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -62.63 -13.01 26.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 121.25 2.525 . . . . 0.0 113.871 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.797 HD22 HG21 ' A' ' 41' ' ' VAL . 1.8 pp -109.35 -17.39 13.81 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.692 1.197 . . . . 0.0 113.627 167.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.6 ttt -67.7 -66.01 0.62 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.948 1.299 . . . . 0.0 109.982 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.542 ' C ' HD22 ' A' ' 11' ' ' LEU . 4.3 pttp -74.43 17.17 0.21 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.207 1.403 . . . . 0.0 113.829 -172.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.542 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -130.03 -34.34 1.69 Allowed 'General case' 0 C--O 1.234 0.289 0 C-N-CA 129.082 2.953 . . . . 0.0 111.946 -172.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 pt -62.8 -34.15 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 119.689 1.131 . . . . 0.0 111.656 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -9.93 41.88 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -178.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -91.13 -15.99 28.52 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.559 1.943 . . . . 0.0 111.943 -175.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -105.03 -47.93 9.4 Favored 'Isoleucine or valine' 0 C--N 1.342 0.252 0 C-N-CA 124.621 1.168 . . . . 0.0 109.337 168.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 63.6 t -66.56 -35.6 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 119.982 1.265 . . . . 0.0 111.249 -172.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -78.84 -0.59 31.23 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.561 -0.712 . . . . 0.0 112.612 176.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -109.65 -13.15 14.56 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.593 1.957 . . . . 0.0 113.544 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -101.92 -89.55 0.36 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.537 0.735 . . . . 0.0 112.531 -170.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -135.67 91.24 2.69 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 122.433 1.111 . . . . 0.0 112.371 -173.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -53.53 -30.98 44.35 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.61 1.564 . . . . 0.0 113.389 170.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.42 -8.69 49.92 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.613 1.965 . . . . 0.0 114.986 177.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -145.49 76.84 12.91 Favored Pre-proline 0 N--CA 1.481 1.114 0 C-N-CA 126.681 1.992 . . . . 0.0 110.345 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -72.02 164.43 35.69 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.796 2.331 . . . . 0.0 112.643 -172.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -78.69 -174.79 4.07 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.488 1.115 . . . . 0.0 110.91 166.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.485 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 81.2 p -136.88 169.87 17.03 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.127 1.771 . . . . 0.0 109.949 172.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 53.4 p30 -53.06 -33.77 53.48 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 176.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -68.16 -53.56 24.24 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 119.982 -1.698 . . . . 0.0 110.678 169.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.485 ' HB2' ' H ' ' A' ' 26' ' ' SER . 20.3 mm-40 -61.34 -49.12 78.26 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 120.929 -1.107 . . . . 0.0 112.504 -174.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.0 pt -59.64 -38.26 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-N 119.574 1.079 . . . . 0.0 112.222 174.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.94 -35.54 78.74 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.625 1.102 . . . . 0.0 111.829 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -69.26 -53.14 21.31 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.566 1.146 . . . . 0.0 112.656 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.437 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.4 mt -64.36 -32.74 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.112 0.869 . . . . 0.0 111.53 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 mp -63.11 -22.03 66.59 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.78 1.232 . . . . 0.0 112.181 176.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.3 pttt -79.43 -16.03 56.83 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 174.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -89.57 -11.22 43.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.945 0.898 . . . . 0.0 112.146 -176.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.437 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.0 ptpt -126.8 -22.32 3.89 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -173.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.46 0.92 0.06 OUTLIER Glycine 0 N--CA 1.472 1.043 0 N-CA-C 116.215 1.246 . . . . 0.0 116.215 153.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.432 ' HB3' HD11 ' A' ' 3' ' ' LEU . 48.2 m-85 -91.45 -30.97 16.18 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.76 1.28 . . . . 0.0 113.159 -166.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt 26.66 50.05 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 129.391 3.076 . . . . 0.0 113.081 -170.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.797 HG21 HD22 ' A' ' 8' ' ' LEU . 3.1 p -86.7 138.45 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.729 1.612 . . . . 0.0 108.849 174.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.54 161.91 26.69 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 128.344 2.658 . . . . 0.0 112.16 177.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -59.44 -27.58 66.2 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.409 1.483 . . . . 0.0 113.513 179.226 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -66.53 -34.29 77.59 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.405 1.482 . . . . 0.0 111.167 -174.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.0 m -87.1 -48.85 7.73 Favored 'General case' 0 CA--C 1.509 -0.601 0 C-N-CA 128.346 2.658 . . . . 0.0 110.397 -178.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.44 -29.45 46.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.994 -172.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.04 -42.8 80.01 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 125.608 1.563 . . . . 0.0 111.175 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -70.24 -19.61 63.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.775 1.23 . . . . 0.0 112.406 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -87.94 -46.7 9.16 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.634 1.174 . . . . 0.0 113.264 -177.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -22.81 40.94 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.389 0.995 . . . . 0.0 112.557 172.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -72.22 -42.31 65.88 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.661 1.185 . . . . 0.0 112.739 172.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.2 ptm -83.35 -30.14 27.69 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.829 0.852 . . . . 0.0 113.107 -173.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.9 mp -67.65 -67.82 0.43 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.665 1.186 . . . . 0.0 111.061 173.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.18 6.46 0.03 OUTLIER Glycine 0 CA--C 1.536 1.356 0 N-CA-C 118.427 2.131 . . . . 0.0 118.427 172.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.1 mt -84.74 125.42 71.15 Favored Pre-proline 0 CA--C 1.545 0.784 0 CA-C-N 119.87 1.835 . . . . 0.0 110.838 -177.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.6 -53.35 0.36 Allowed 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.923 2.416 . . . . 0.0 110.642 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 82.7 p -161.11 -10.82 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.484 1.514 . . . . 0.0 114.988 162.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.9 m 62.36 -19.71 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.38 2.672 . . . . 0.0 115.752 -165.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -67.75 -44.43 77.53 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.584 1.554 . . . . 0.0 108.688 169.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -22.85 59.24 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -178.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -73.75 -42.3 61.28 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.426 1.49 . . . . 0.0 111.821 170.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -73.61 -58.89 2.99 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.841 1.656 . . . . 0.0 113.036 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.253 1.26 0 C-N-CA 126.127 1.771 . . . . 0.0 114.459 -167.707 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.173 0 O5'-C5'-C4' 114.822 3.302 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.974 0 O4'-C1'-N19 110.825 3.782 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.515 1 O4'-C1'-N19 112.19 5.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.917 1 O4'-C1'-N19 111.087 4.108 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.111 0 O4'-C4'-C3' 108.607 3.007 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.269 0 C5'-C4'-C3' 109.988 -3.141 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.082 1 O4'-C1'-N19 111.405 4.506 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.017 0 P-O3'-C3' 123.238 2.949 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.512 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.526 1 O4'-C1'-N19 111.072 4.09 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.515 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.225 1 C4'-C3'-C2' 99.017 -4.183 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.224 0 O4'-C1'-N19 110.868 3.836 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.297 0 O4'-C4'-C3' 108.876 3.276 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.409 0 P-O3'-C3' 123.772 3.393 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.365 0 C4'-C3'-C2' 100.044 -3.156 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.694 0 N19-C1'-C2' 108.63 -3.481 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.396 0 C3'-C2'-C1' 107.06 3.114 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.539 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.513 0 O4'-C4'-C3' 109.209 3.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.539 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.39 0 O4'-C4'-C3' 108.812 3.212 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.515 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.878 1 O4'-C1'-N19 111.903 5.129 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.512 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.89 2 O4'-C1'-N19 117.257 11.821 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.823 1 O4'-C1'-N19 111.438 4.548 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.29 0 O4'-C4'-C3' 108.735 3.135 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.177 0 O4'-C4'-C3' 108.707 3.107 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.207 0 P-O3'-C3' 122.855 2.629 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.394 1 O4'-C1'-N19 111.083 4.103 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.409 0 O4'-C1'-N19 110.735 3.668 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.462 0 O4'-C4'-C3' 108.394 2.794 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.153 0 P-O3'-C3' 122.516 2.347 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . 0.46 ' HA ' " H4'" ' C' ' 83' ' ' ' DG' . 63.3 m80 . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.057 0.456 . . . . 0.0 112.085 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 80.4 mmm 64.96 11.59 7.17 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.584 2.354 . . . . 0.0 116.762 163.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.76 HD12 HD23 ' A' ' 8' ' ' LEU . 15.5 mt -61.82 165.12 5.55 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 122.134 0.969 . . . . 0.0 113.599 172.03 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.7 p -73.47 -169.31 0.65 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.705 1.202 . . . . 0.0 112.513 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -48.91 -24.66 1.56 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.554 1.542 . . . . 0.0 114.699 172.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.28 44.21 0.16 Allowed Glycine 0 C--N 1.341 0.841 0 CA-C-O 117.953 -1.471 . . . . 0.0 115.864 172.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -61.41 -14.92 31.91 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.7 2.25 . . . . 0.0 113.47 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.76 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -109.97 -17.21 13.66 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.716 1.206 . . . . 0.0 112.814 169.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.465 ' HG3' HD21 ' A' ' 53' ' ' LEU . 1.2 ttt -74.05 -59.17 2.84 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.914 1.686 . . . . 0.0 111.517 -175.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.486 ' C ' HD22 ' A' ' 11' ' ' LEU . 19.4 pttt -76.86 19.26 0.3 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.91 1.284 . . . . 0.0 112.918 -174.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.486 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -128.45 -41.33 1.55 Allowed 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 129.716 3.207 . . . . 0.0 110.574 -170.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 pt -61.33 -37.75 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 118.69 0.677 . . . . 0.0 111.274 -177.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.42 -14.01 44.57 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.715 1.005 . . . . 0.0 113.715 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.7 tp10 -95.21 -19.96 19.62 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 125.972 1.709 . . . . 0.0 111.761 -170.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -98.61 -46.53 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 C-N-CA 124.813 1.245 . . . . 0.0 109.149 169.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.81 -35.44 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.593 1.088 . . . . 0.0 111.324 -173.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -79.01 -2.64 41.24 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 177.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -104.85 -17.64 14.5 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.204 1.801 . . . . 0.0 112.87 -176.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -97.32 -91.73 0.25 Allowed 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.577 0.751 . . . . 0.0 112.256 -169.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -137.18 89.26 2.42 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 125.064 1.346 . . . . 0.0 110.218 177.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.3 mtmm -59.12 -18.81 39.06 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.62 1.168 . . . . 0.0 112.754 167.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -21.47 61.57 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 127.436 2.295 . . . . 0.0 114.051 169.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.5 mtmt -148.73 74.66 10.29 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 127.819 2.448 . . . . 0.0 109.747 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -68.75 161.56 44.89 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.09 2.526 . . . . 0.0 113.011 -169.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -76.5 -172.73 2.27 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.714 1.206 . . . . 0.0 110.671 167.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.432 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 59.7 p -136.78 167.51 21.3 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 126.316 1.847 . . . . 0.0 109.457 176.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 51.3 p30 -54.66 -30.96 56.83 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 175.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -68.17 -54.45 17.88 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.0 -1.688 . . . . 0.0 110.702 168.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.432 ' HB2' ' H ' ' A' ' 26' ' ' SER . 40.0 mt-10 -62.71 -47.78 82.13 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 120.659 -1.275 . . . . 0.0 112.757 -173.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.1 pt -59.27 -38.24 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-N 119.518 1.053 . . . . 0.0 112.142 173.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.8 -35.46 79.93 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.647 1.112 . . . . 0.0 112.138 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -67.31 -53.11 32.66 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.651 1.18 . . . . 0.0 112.952 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.478 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -64.74 -32.42 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 O-C-N 121.567 -0.708 . . . . 0.0 111.657 -176.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.29 -22.36 66.82 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 125.174 1.39 . . . . 0.0 112.149 175.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -81.28 -14.6 57.23 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 175.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -87.57 -11.51 48.47 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.562 0.745 . . . . 0.0 111.992 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.478 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.1 ptpt -127.49 -22.73 3.6 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -173.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.45 0.5 0.07 OUTLIER Glycine 0 N--CA 1.47 0.931 0 N-CA-C 115.93 1.132 . . . . 0.0 115.93 152.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -89.48 -29.4 19.0 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.426 1.113 . . . . 0.0 112.694 -167.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt 29.03 43.37 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 130.243 3.417 . . . . 0.0 114.181 -173.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.569 HG21 HD22 ' A' ' 8' ' ' LEU . 3.3 p -83.4 144.24 10.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.092 0.957 . . . . 0.0 109.132 175.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.45 165.5 14.29 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.307 2.643 . . . . 0.0 112.806 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.01 -29.5 69.74 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.494 1.518 . . . . 0.0 114.254 -175.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -68.42 -32.11 71.92 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.188 0.904 . . . . 0.0 111.747 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.402 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 2.1 m -84.15 -48.16 10.12 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 127.913 2.485 . . . . 0.0 110.174 -177.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.9 -28.98 44.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.641 -173.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.56 -33.4 72.7 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.804 1.642 . . . . 0.0 111.921 176.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -72.74 -22.5 60.85 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.734 0.814 . . . . 0.0 112.693 174.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -83.49 -44.17 14.99 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.514 0.726 . . . . 0.0 112.909 -174.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.17 -30.65 7.1 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 118.785 0.72 . . . . 0.0 112.926 172.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -72.64 -33.07 66.36 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.195 0.998 . . . . 0.0 112.853 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 23.6 ptt? -94.37 -22.74 18.13 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.861 1.059 . . . . 0.0 113.861 -176.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.465 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.2 mt -72.92 -63.64 1.13 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.148 0.979 . . . . 0.0 111.374 170.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 165.93 -2.78 0.05 OUTLIER Glycine 0 CA--C 1.536 1.349 0 N-CA-C 117.675 1.83 . . . . 0.0 117.675 169.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.8 mt -72.63 128.06 88.98 Favored Pre-proline 0 CA--C 1.547 0.861 0 CA-C-N 119.127 1.463 . . . . 0.0 111.074 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.73 -64.42 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 123.459 2.773 . . . . 0.0 109.887 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 77.2 p -149.04 -10.41 0.33 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.1 1.36 . . . . 0.0 114.58 164.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.9 m 59.24 -14.58 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 128.436 2.694 . . . . 0.0 116.259 -165.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -67.39 -45.21 76.87 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.421 1.489 . . . . 0.0 108.76 165.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -22.34 59.25 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -177.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -73.99 -41.93 61.19 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.543 1.537 . . . . 0.0 111.76 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -73.58 -58.38 3.35 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.441 1.496 . . . . 0.0 113.192 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.253 1.264 0 C-N-CA 126.622 1.969 . . . . 0.0 114.479 -168.031 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.823 0 C4'-C3'-C2' 100.316 -2.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.315 0 O4'-C1'-N19 110.552 3.44 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.508 1 O4'-C1'-N19 112.079 5.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.998 1 O4'-C1'-N19 111.125 4.156 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.679 0 O4'-C1'-N19 109.821 2.526 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.54 0 P-O3'-C3' 123.164 2.887 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.907 0 O4'-C1'-N19 110.487 3.358 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.015 0 P-O3'-C3' 123.165 2.888 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.517 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.574 1 O4'-C1'-N19 111.369 4.462 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.488 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.529 1 C4'-C3'-C2' 98.9 -4.3 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.39 1 O4'-C1'-N19 111.409 4.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.448 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.489 0 O4'-C4'-C3' 108.731 3.131 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.448 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.239 0 P-O3'-C3' 123.844 3.453 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.356 0 C4'-C3'-C2' 100.061 -3.139 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.679 0 N19-C1'-C2' 109.035 -3.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.408 0 C3'-C2'-C1' 107.184 3.203 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.554 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.455 0 O4'-C4'-C3' 109.145 3.545 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.554 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.064 0 O4'-C4'-C3' 108.673 3.073 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.488 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.465 1 O4'-C1'-N19 112.013 5.266 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.517 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.535 3.002 3 O4'-C1'-N19 117.526 12.157 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.092 0 O4'-C1'-N19 110.392 3.241 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.548 0 O4'-C4'-C3' 109.349 3.749 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.477 0 O4'-C4'-C3' 108.085 2.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.29 0 O4'-C1'-N19 110.097 2.872 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.553 0 O4'-C1'-N19 110.113 2.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.369 0 P-O3'-C3' 123.904 3.503 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.996 0 O4'-C4'-C3' 108.071 2.471 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.966 0 P-O3'-C3' 122.713 2.511 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 29.4 p80 . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.856 0.36 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 17.3 tpt -83.75 -55.35 4.31 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.495 1.118 . . . . 0.0 112.073 176.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.831 HD12 HD23 ' A' ' 8' ' ' LEU . 33.1 mt -104.87 176.35 5.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.236 1.814 . . . . 0.0 113.385 -169.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.3 p -73.97 -169.24 0.72 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.625 1.57 . . . . 0.0 112.645 177.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -49.19 -24.88 1.91 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.78 1.632 . . . . 0.0 114.626 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.63 45.76 0.12 Allowed Glycine 0 C--N 1.34 0.8 0 CA-C-O 118.174 -1.348 . . . . 0.0 114.833 171.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.36 -19.85 38.82 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 120.038 1.919 . . . . 0.0 113.552 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.831 HD23 HD12 ' A' ' 3' ' ' LEU . 1.8 pp -108.67 -17.63 13.91 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.146 1.378 . . . . 0.0 112.761 171.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.501 ' HG3' HD21 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -73.18 -57.33 4.1 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 126.09 1.756 . . . . 0.0 111.48 -175.512 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.484 ' C ' HD22 ' A' ' 11' ' ' LEU . 8.3 pttp -76.0 15.68 0.51 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.733 1.213 . . . . 0.0 113.161 -174.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.484 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.1 mm? -126.32 -42.03 1.86 Allowed 'General case' 0 C--O 1.233 0.203 0 C-N-CA 129.753 3.221 . . . . 0.0 110.436 -170.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.4 pt -62.99 -35.88 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-N 118.658 0.663 . . . . 0.0 111.679 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.07 -19.04 41.05 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 178.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -94.95 -17.47 21.94 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 127.091 2.156 . . . . 0.0 111.919 -168.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -100.8 -51.16 9.87 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 C-N-CA 123.955 0.902 . . . . 0.0 108.746 167.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 93.7 t -63.87 -39.11 84.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 119.81 1.186 . . . . 0.0 111.181 -170.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -82.39 3.74 26.82 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 120.076 -0.65 . . . . 0.0 112.273 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.67 -11.39 9.42 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.312 1.845 . . . . 0.0 114.17 -177.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -91.15 -86.95 0.21 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.243 1.017 . . . . 0.0 111.621 -176.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -131.99 96.66 3.96 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 122.53 1.157 . . . . 0.0 112.243 178.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -57.81 -15.72 9.18 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.273 1.429 . . . . 0.0 113.939 171.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -102.06 -10.2 19.92 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.921 2.088 . . . . 0.0 113.747 173.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -140.6 76.09 25.14 Favored Pre-proline 0 N--CA 1.483 1.195 0 C-N-CA 125.773 1.629 . . . . 0.0 111.076 172.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.51 161.9 44.38 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.254 2.636 . . . . 0.0 112.445 -176.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -81.89 -178.01 6.82 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.642 1.177 . . . . 0.0 111.255 169.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.471 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 93.2 p -131.18 169.01 16.5 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.889 1.676 . . . . 0.0 109.866 173.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -54.33 -31.96 55.55 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 174.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -68.83 -53.82 19.29 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.001 -1.687 . . . . 0.0 110.988 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.471 ' HB2' ' H ' ' A' ' 26' ' ' SER . 43.6 mt-10 -61.81 -47.64 84.19 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 120.578 -1.326 . . . . 0.0 112.597 -174.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.5 pt -59.98 -38.38 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 119.657 1.117 . . . . 0.0 112.06 173.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.89 -34.52 76.18 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.433 1.015 . . . . 0.0 112.197 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -68.16 -54.39 18.33 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.65 1.18 . . . . 0.0 112.771 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.462 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.0 mt -63.37 -33.46 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 121.496 -0.753 . . . . 0.0 111.509 -176.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -63.88 -23.03 67.19 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.499 1.52 . . . . 0.0 112.332 176.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -80.95 -15.46 56.2 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -84.39 -13.59 51.77 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.505 0.722 . . . . 0.0 112.179 -178.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.462 ' HE3' HG22 ' A' ' 33' ' ' ILE . 14.2 ptpt -127.0 -23.51 3.61 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.342 1.608 . . . . 0.0 115.342 -171.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 159.63 1.7 0.07 OUTLIER Glycine 0 N--CA 1.471 0.975 0 N-CA-C 115.752 1.061 . . . . 0.0 115.752 152.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -87.42 -30.7 20.52 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.412 1.106 . . . . 0.0 112.676 -169.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ptmt 29.01 44.81 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 129.947 3.299 . . . . 0.0 113.921 -171.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.558 HG21 HD22 ' A' ' 8' ' ' LEU . 2.7 p -82.08 140.46 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.078 1.351 . . . . 0.0 109.002 176.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.418 ' H ' ' P ' ' C' ' 84' ' ' ' DT' . . . -81.98 165.23 20.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.355 2.262 . . . . 0.0 112.328 176.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -25.75 68.4 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.267 1.427 . . . . 0.0 113.904 -177.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -67.3 -36.35 81.33 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.165 0.986 . . . . 0.0 111.516 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.1 m -84.89 -48.91 8.85 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 127.481 2.312 . . . . 0.0 109.4 -175.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.91 -30.05 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.27 -174.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.11 -48.88 72.09 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.105 1.362 . . . . 0.0 110.727 176.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -69.22 -16.26 63.56 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.522 0.729 . . . . 0.0 112.938 -178.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -81.54 -47.53 12.97 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.985 0.914 . . . . 0.0 112.158 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.9 ptp180 -56.27 -23.08 34.11 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 119.066 0.848 . . . . 0.0 113.081 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -66.85 -47.46 71.87 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.723 1.209 . . . . 0.0 112.654 174.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -84.65 -25.33 28.57 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -171.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.501 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.4 mt -71.0 -59.57 2.71 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.325 1.05 . . . . 0.0 111.868 175.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 167.42 8.6 0.03 OUTLIER Glycine 0 CA--C 1.534 1.262 0 N-CA-C 118.192 2.037 . . . . 0.0 118.192 171.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.8 mt -96.38 130.34 31.07 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 119.938 1.869 . . . . 0.0 110.928 -175.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -69.98 -58.7 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.669 2.912 . . . . 0.0 111.233 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.2 p -155.5 -4.13 0.13 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.722 1.609 . . . . 0.0 114.715 168.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 83.4 p 59.23 -10.6 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.785 2.834 . . . . 0.0 116.217 -168.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -82.17 -30.92 30.73 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 120.521 1.51 . . . . 0.0 111.057 172.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -23.73 59.07 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 174.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -72.95 -37.33 67.16 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.941 1.296 . . . . 0.0 112.417 170.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -72.85 -59.67 2.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.137 1.775 . . . . 0.0 112.88 179.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.7 tp . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.668 1.587 . . . . 0.0 114.415 -167.315 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.121 0 O4'-C1'-N19 110.483 3.353 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.564 0 O4'-C4'-C3' 108.565 2.965 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.619 1 O4'-C1'-N19 112.381 5.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.931 0 O4'-C4'-C3' 107.856 2.256 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.344 0 O4'-C1'-N19 109.87 2.588 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.49 0 P-O3'-C3' 123.591 3.242 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.357 0 O4'-C1'-N19 110.046 2.808 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.429 0 P-O3'-C3' 123.078 2.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.521 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.574 1 O4'-C1'-N19 111.174 4.217 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.505 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.57 1 C4'-C3'-C2' 98.965 -4.235 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.249 0 O4'-C4'-C3' 109.449 3.849 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.453 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.295 0 O4'-C4'-C3' 108.419 2.819 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.453 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.24 0 P-O3'-C3' 123.815 3.429 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.261 0 C4'-C3'-C2' 100.096 -3.104 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.782 0 N19-C1'-C2' 109.012 -3.242 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.295 0 C3'-C2'-C1' 107.244 3.246 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.502 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.699 0 P-O3'-C3' 124.087 3.656 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.502 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.544 0 O4'-C4'-C3' 108.287 2.687 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.505 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.543 3.962 1 O4'-C1'-N19 111.471 4.589 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.521 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.536 3.144 1 O4'-C1'-N19 116.125 10.407 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . 0.418 ' P ' ' H ' ' A' ' 42' ' ' ALA . . . . . . . . 0 C5'--C4' 1.533 2.72 0 N19-C1'-C2' 118.366 2.604 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.7 0 O4'-C4'-C3' 108.066 2.466 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.776 0 O4'-C4'-C3' 109.098 3.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.257 0 C4'-C3'-C2' 100.207 -2.993 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.408 0 O4'-C4'-C3' 108.436 2.836 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.917 0 P-O3'-C3' 124.44 3.95 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.752 0 P-O3'-C3' 122.945 2.704 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.768 0 P-O3'-C3' 123.389 3.074 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 53.1 m80 . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 121.019 0.438 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 56.5 tpp -139.8 -56.22 0.56 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.107 1.763 . . . . 0.0 110.887 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.763 HD12 HD23 ' A' ' 8' ' ' LEU . 30.6 mt -88.48 179.57 6.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.873 1.669 . . . . 0.0 112.468 175.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.5 p -71.53 -169.86 0.47 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.796 1.238 . . . . 0.0 112.502 175.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -48.7 -24.68 1.46 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.718 1.607 . . . . 0.0 114.655 173.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.2 45.83 0.11 Allowed Glycine 0 C--N 1.341 0.82 0 CA-C-O 117.954 -1.47 . . . . 0.0 115.205 170.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.59 -17.4 32.69 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.623 2.212 . . . . 0.0 113.425 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.763 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -107.85 -20.06 13.32 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.526 1.13 . . . . 0.0 112.635 171.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.402 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.5 ttt -68.79 -62.66 1.29 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 126.134 1.774 . . . . 0.0 110.718 -178.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.516 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.2 pttp -76.67 16.36 0.52 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.098 1.359 . . . . 0.0 113.675 -171.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.516 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -127.46 -39.67 1.84 Allowed 'General case' 0 C--O 1.233 0.214 0 C-N-CA 129.375 3.07 . . . . 0.0 110.745 -171.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pt -63.07 -36.8 77.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.947 0.794 . . . . 0.0 111.447 -176.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 -16.03 44.89 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -179.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -97.57 -17.06 19.77 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 127.828 2.451 . . . . 0.0 111.773 -167.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.0 pp -101.42 -46.51 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 C-N-CA 124.981 1.312 . . . . 0.0 109.762 167.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.6 t -62.81 -42.78 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-N 119.463 1.028 . . . . 0.0 110.471 -174.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -81.41 0.19 38.64 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.659 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -96.22 -21.49 17.84 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.22 1.408 . . . . 0.0 112.622 175.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -91.8 -84.64 0.26 Allowed 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.504 1.122 . . . . 0.0 112.005 -172.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -140.1 92.42 2.54 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.573 1.149 . . . . 0.0 110.465 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -53.13 -27.76 22.44 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 160.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -22.59 63.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.611 2.765 . . . . 0.0 114.208 173.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -148.11 73.36 11.11 Favored Pre-proline 0 N--CA 1.478 0.937 0 C-N-CA 127.398 2.279 . . . . 0.0 109.878 -174.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -69.26 155.96 66.06 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.848 2.365 . . . . 0.0 112.402 -168.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -78.96 172.25 14.06 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.639 0.733 . . . . 0.0 110.423 165.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.461 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 57.5 p -129.09 169.01 15.26 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.491 1.516 . . . . 0.0 110.008 179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 52.0 p30 -53.29 -34.15 56.14 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 178.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -67.64 -53.84 24.61 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 119.716 -1.865 . . . . 0.0 110.8 168.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.461 ' HB2' ' H ' ' A' ' 26' ' ' SER . 21.6 mm-40 -61.33 -49.66 76.08 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 120.807 -1.183 . . . . 0.0 112.558 -173.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.3 pt -59.22 -38.61 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-N 119.593 1.088 . . . . 0.0 112.28 173.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.92 -34.42 76.04 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.527 1.058 . . . . 0.0 112.01 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -68.36 -55.28 12.55 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.415 1.086 . . . . 0.0 112.826 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.471 HG22 ' HE2' ' A' ' 37' ' ' LYS . 1.5 mp -63.8 -33.03 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-N 118.826 0.739 . . . . 0.0 111.201 -176.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mp -61.01 -26.37 67.56 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.048 1.339 . . . . 0.0 112.629 176.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -78.89 -13.66 59.67 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.648 0.779 . . . . 0.0 112.76 176.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -90.01 -9.6 48.04 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.553 0.741 . . . . 0.0 112.341 -177.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.471 ' HE2' HG22 ' A' ' 33' ' ' ILE . 23.5 pttt -127.86 -22.62 3.5 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -175.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 153.56 5.14 0.11 Allowed Glycine 0 N--CA 1.47 0.902 0 CA-C-N 119.65 1.114 . . . . 0.0 115.499 151.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -85.09 -20.73 29.91 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.023 0.912 . . . . 0.0 112.905 -171.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 36.52 28.38 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 130.603 3.561 . . . . 0.0 115.342 -177.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.539 HG21 HD22 ' A' ' 8' ' ' LEU . 4.1 p -84.79 139.84 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-O 121.441 0.638 . . . . 0.0 109.978 -171.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.73 164.31 19.68 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.641 2.376 . . . . 0.0 112.363 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -57.1 -36.62 70.84 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.6 1.16 . . . . 0.0 113.839 -176.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -37.99 86.09 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.56 0.695 . . . . 0.0 110.54 -172.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.423 ' HB ' ' CG2' ' A' ' 41' ' ' VAL . 3.2 m -79.04 -48.82 13.7 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 127.972 2.509 . . . . 0.0 109.957 -175.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.06 -29.69 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.823 -175.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.52 -38.53 80.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.828 1.651 . . . . 0.0 111.757 178.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -64.78 -32.35 74.0 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.601 0.76 . . . . 0.0 111.396 175.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -79.52 -48.79 13.27 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 118.555 -0.736 . . . . 0.0 112.195 -171.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -53.54 -32.31 50.05 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.253 0.933 . . . . 0.0 112.286 172.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -72.37 -36.46 68.74 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.564 0.746 . . . . 0.0 112.372 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.0 ptt? -85.79 -31.69 22.21 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -175.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.402 HD21 ' HG3' ' A' ' 9' ' ' MET . 1.5 mp -67.1 -61.2 2.04 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.079 0.952 . . . . 0.0 111.312 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 174.29 -2.63 0.03 OUTLIER Glycine 0 CA--C 1.536 1.371 0 N-CA-C 117.763 1.865 . . . . 0.0 117.763 174.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.7 mt -77.23 131.98 71.15 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 119.476 1.638 . . . . 0.0 110.251 177.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.11 -65.28 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.181 2.587 . . . . 0.0 109.873 170.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.6 p -151.03 -2.48 0.34 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.01 1.724 . . . . 0.0 114.225 163.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.5 m 57.73 -8.59 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.79 2.836 . . . . 0.0 116.026 -167.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -73.28 -40.53 64.49 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.491 1.516 . . . . 0.0 108.854 174.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -78.94 -21.53 47.11 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -71.79 -41.93 67.71 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.867 0.867 . . . . 0.0 111.981 169.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -75.27 -59.97 2.51 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.063 1.345 . . . . 0.0 112.86 -176.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.254 1.33 0 C-N-CA 125.541 1.536 . . . . 0.0 114.553 -168.087 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.752 0 C4'-C3'-C2' 100.216 -2.984 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.348 0 O4'-C1'-N19 110.118 2.898 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.573 1 O4'-C1'-N19 112.367 5.709 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.71 1 O4'-C1'-N19 111.719 4.899 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.696 0 P-O3'-C3' 123.302 3.001 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.538 0 P-O3'-C3' 122.984 2.736 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.007 0 O4'-C1'-N19 110.52 3.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.979 0 P-O3'-C3' 123.032 2.777 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.492 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.54 1 O4'-C1'-N19 111.229 4.287 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.428 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.365 1 C4'-C3'-C2' 99.004 -4.196 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.679 1 O4'-C1'-N19 112.073 5.342 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.456 " H2'" ' H72' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.574 0 O4'-C1'-N19 110.249 3.062 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.456 ' H72' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.187 0 P-O3'-C3' 124.003 3.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.337 0 C4'-C3'-C2' 100.202 -2.998 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.811 0 N19-C1'-C2' 109.035 -3.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.367 0 C3'-C2'-C1' 107.019 3.085 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.485 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.541 1 C4'-C3'-C2' 98.96 -4.24 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.485 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.313 0 N19-C1'-C2' 109.079 -3.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.428 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.543 4.032 1 O4'-C1'-N19 112.388 5.735 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.492 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.573 3 O4'-C1'-N19 117.33 11.913 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.059 0 O4'-C1'-N19 110.987 3.984 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.356 0 C3'-C2'-C1' 105.565 2.046 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.25 0 O4'-C4'-C3' 108.335 2.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.324 0 O4'-C1'-N19 110.165 2.956 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.597 0 O4'-C4'-C3' 108.666 3.066 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.573 0 P-O3'-C3' 123.176 2.897 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 0 O4'-C4'-C3' 108.598 2.998 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.745 0 P-O3'-C3' 122.558 2.382 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.621 0.248 . . . . 0.0 110.73 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 15.7 tpt -69.02 -42.17 76.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.118 0.967 . . . . 0.0 113.467 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.831 HD12 HD23 ' A' ' 8' ' ' LEU . 26.3 mt -83.37 176.73 8.89 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.176 1.39 . . . . 0.0 113.257 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 48.2 p -70.28 -173.6 0.72 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.089 0.956 . . . . 0.0 112.148 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -43.06 -25.73 0.12 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.123 2.169 . . . . 0.0 115.897 170.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -172.58 40.44 0.16 Allowed Glycine 0 C--N 1.341 0.818 0 CA-C-O 117.747 -1.585 . . . . 0.0 115.657 170.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -64.5 -10.28 24.49 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 121.06 2.43 . . . . 0.0 114.127 -177.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.831 HD23 HD12 ' A' ' 3' ' ' LEU . 1.6 pp -112.64 -15.33 13.03 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.751 1.22 . . . . 0.0 113.687 166.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.706 ' HG3' HD21 ' A' ' 53' ' ' LEU . 3.0 ttp -71.73 -61.72 1.68 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.96 1.304 . . . . 0.0 110.489 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.46 ' C ' HD22 ' A' ' 11' ' ' LEU . 8.7 pttp -73.62 16.37 0.21 Allowed 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -173.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.46 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.2 mm? -124.23 -46.11 1.94 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 129.632 3.173 . . . . 0.0 110.931 -171.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.3 pp -63.98 -34.51 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.635 0.652 . . . . 0.0 112.166 -176.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.553 ' HG2' HD22 ' A' ' 53' ' ' LEU . 0.0 OUTLIER -80.78 -17.12 51.93 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 175.715 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -94.68 -16.23 23.28 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.609 1.964 . . . . 0.0 111.81 -168.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -104.0 -46.25 9.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 C-N-CA 124.601 1.16 . . . . 0.0 109.381 169.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.1 -32.33 55.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 119.848 1.204 . . . . 0.0 111.367 -174.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -80.28 -0.95 38.76 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.495 -0.753 . . . . 0.0 112.583 175.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -110.05 -14.49 14.22 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.124 1.769 . . . . 0.0 113.07 -176.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -101.43 -96.58 0.27 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.052 0.842 . . . . 0.0 112.386 -169.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -136.74 88.33 2.36 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.886 1.274 . . . . 0.0 109.971 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -58.93 -20.46 52.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.543 0.737 . . . . 0.0 112.691 165.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -23.08 61.91 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 128.889 2.875 . . . . 0.0 114.208 169.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -148.45 69.7 10.49 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 127.649 2.379 . . . . 0.0 109.722 -174.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -72.35 165.54 32.36 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.934 2.423 . . . . 0.0 113.645 -163.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -76.02 -170.97 1.52 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.735 1.214 . . . . 0.0 111.045 165.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.459 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 60.3 p -141.47 169.02 18.4 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.726 2.01 . . . . 0.0 109.39 174.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -55.2 -32.32 62.13 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -66.5 -53.85 30.43 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 119.846 -1.784 . . . . 0.0 110.919 168.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.459 ' HB2' ' H ' ' A' ' 26' ' ' SER . 41.1 mt-10 -62.62 -49.02 76.85 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 120.661 -1.274 . . . . 0.0 112.758 -173.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.4 pt -59.34 -37.49 69.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-N 119.888 1.222 . . . . 0.0 112.212 173.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.35 -35.16 79.48 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.585 1.084 . . . . 0.0 112.456 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -68.41 -51.09 47.84 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.806 1.242 . . . . 0.0 113.015 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.403 HG22 ' HE3' ' A' ' 37' ' ' LYS . 3.3 mt -63.6 -35.48 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 121.829 -0.544 . . . . 0.0 110.938 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.3 mp -62.58 -23.22 66.9 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.534 1.534 . . . . 0.0 112.643 176.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 pttm -78.02 -15.11 59.22 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -83.39 -19.96 35.06 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.458 0.703 . . . . 0.0 111.801 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.403 ' HE3' HG22 ' A' ' 33' ' ' ILE . 26.6 mmtt -89.3 -57.48 2.87 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.339 1.856 . . . . 0.0 108.735 -177.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 155.93 7.92 0.07 OUTLIER Glycine 0 CA--C 1.529 0.937 0 CA-C-N 114.185 -1.37 . . . . 0.0 114.152 173.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.406 ' HB3' HD11 ' A' ' 3' ' ' LEU . 48.6 m-85 -79.37 -24.42 42.67 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.492 1.146 . . . . 0.0 112.3 -175.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt 32.69 35.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 130.692 3.597 . . . . 0.0 114.586 -176.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.601 HG21 HD22 ' A' ' 8' ' ' LEU . 2.5 p -82.48 139.83 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -175.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.36 160.71 26.61 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.345 2.258 . . . . 0.0 112.22 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -34.9 64.48 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.726 1.211 . . . . 0.0 113.915 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.08 -31.49 72.39 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 118.735 0.698 . . . . 0.0 111.661 -173.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.8 m -83.86 -49.64 8.84 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 128.584 2.753 . . . . 0.0 109.745 -176.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.79 -26.9 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.193 -176.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.46 -36.16 76.32 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 126.718 2.007 . . . . 0.0 111.829 177.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -64.74 -39.04 92.96 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.982 -0.449 . . . . 0.0 111.626 172.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -73.47 -35.94 65.76 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -164.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.98 -30.84 6.51 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 170.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -71.11 -36.42 72.14 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.1 ptp -86.51 -20.62 27.78 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -175.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.706 HD21 ' HG3' ' A' ' 9' ' ' MET . 4.2 mt -86.45 -63.4 1.32 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.295 1.438 . . . . 0.0 111.623 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.92 -5.55 0.04 OUTLIER Glycine 0 CA--C 1.535 1.294 0 N-CA-C 117.851 1.901 . . . . 0.0 117.851 167.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.0 mt -76.73 122.7 86.99 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 119.329 1.564 . . . . 0.0 110.871 -176.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.23 -59.41 0.08 OUTLIER 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.556 2.838 . . . . 0.0 110.729 -178.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 83.2 p -146.24 -6.8 0.55 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.798 1.639 . . . . 0.0 113.884 159.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 85.1 p 60.45 -20.43 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 129.561 3.144 . . . . 0.0 116.17 -163.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -71.1 -43.6 67.36 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.801 1.64 . . . . 0.0 109.649 172.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -23.56 60.81 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.652 0.781 . . . . 0.0 112.768 -172.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -70.23 -46.29 64.76 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.989 1.716 . . . . 0.0 111.993 167.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -72.0 -58.98 2.99 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.188 1.795 . . . . 0.0 113.194 -174.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.833 2.053 . . . . 0.0 114.437 -167.602 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.8 0 O5'-C5'-C4' 114.422 3.016 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.522 0 O4'-C1'-N19 110.518 3.398 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.747 1 O4'-C1'-N19 112.44 5.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.138 1 O4'-C1'-N19 111.292 4.365 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.724 0 O4'-C1'-N19 110.392 3.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.891 0 O5'-C5'-C4' 114.253 2.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.073 0 O4'-C1'-N19 110.572 3.465 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.091 0 P-O3'-C3' 122.682 2.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.491 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.679 1 O4'-C1'-N19 111.626 4.783 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.447 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.784 0 C4'-C3'-C2' 99.681 -3.519 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.662 0 O4'-C1'-N19 110.95 3.937 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.433 0 O4'-C4'-C3' 109.106 3.506 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.378 0 P-O3'-C3' 123.95 3.542 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.655 0 C4'-C3'-C2' 100.061 -3.139 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.661 0 O4'-C4'-C3' 108.617 3.017 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.398 0 O4'-C4'-C3' 108.481 2.881 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.512 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.285 2 C4'-C3'-C2' 99.031 -4.169 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.512 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.269 0 O4'-C4'-C3' 109.161 3.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.447 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.483 2 O4'-C1'-N19 114.313 8.142 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.491 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.544 4.148 3 O4'-C1'-N19 117.24 11.8 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.111 1 O4'-C1'-N19 111.507 4.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.309 0 C3'-C2'-C1' 105.338 1.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.38 0 O4'-C4'-C3' 108.0 2.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.262 0 C4'-C3'-C2' 100.209 -2.991 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.31 0 O4'-C1'-N19 110.02 2.775 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.119 0 P-O3'-C3' 123.663 3.303 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.215 0 O4'-C4'-C3' 108.642 3.042 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.018 0 P-O3'-C3' 122.657 2.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 120.47 0.176 . . . . 0.0 110.821 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 51.6 mtt -137.87 -49.96 0.58 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.735 1.214 . . . . 0.0 112.518 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.732 HD12 HD23 ' A' ' 8' ' ' LEU . 36.1 mt -106.12 176.64 5.1 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.669 1.588 . . . . 0.0 113.72 -172.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 54.2 p -74.25 -168.03 0.6 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.821 1.648 . . . . 0.0 112.485 179.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -49.05 -25.7 2.19 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.204 1.402 . . . . 0.0 114.378 173.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.47 45.8 0.12 Allowed Glycine 0 C--N 1.34 0.776 0 CA-C-O 118.09 -1.394 . . . . 0.0 115.021 172.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -62.84 -15.77 55.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 120.504 2.152 . . . . 0.0 113.373 -178.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.732 HD23 HD12 ' A' ' 3' ' ' LEU . 1.4 pp -108.16 -18.07 13.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.111 0.964 . . . . 0.0 112.832 169.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.516 ' HG3' HD21 ' A' ' 53' ' ' LEU . 2.2 ttp -70.07 -61.78 1.64 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.411 1.484 . . . . 0.0 110.749 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.458 ' C ' HD22 ' A' ' 11' ' ' LEU . 16.6 pttt -76.71 15.89 0.58 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.996 0.918 . . . . 0.0 113.385 -171.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.458 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.4 mm? -124.96 -43.4 1.98 Allowed 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 129.305 3.042 . . . . 0.0 110.631 -171.128 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.8 pt -58.48 -37.79 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-N 118.67 0.668 . . . . 0.0 111.553 -177.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.37 -18.53 41.7 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -105.92 -12.22 15.91 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.344 1.857 . . . . 0.0 112.738 -167.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -94.54 -48.2 13.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 124.472 1.109 . . . . 0.0 108.777 162.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 82.7 t -64.33 -37.51 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 O-C-N 120.7 -1.25 . . . . 0.0 111.167 -173.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -83.85 5.35 25.5 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 178.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -109.29 -22.9 11.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.501 1.52 . . . . 0.0 112.756 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -89.23 -85.59 0.2 Allowed 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.798 1.239 . . . . 0.0 111.665 -173.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -142.97 82.67 1.77 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.764 1.226 . . . . 0.0 110.81 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -60.22 -19.29 53.73 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 166.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -72.06 -28.3 63.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.981 2.512 . . . . 0.0 114.755 169.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.88 79.02 12.33 Favored Pre-proline 0 N--CA 1.482 1.174 0 C-N-CA 127.509 2.324 . . . . 0.0 109.6 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.37 168.29 25.15 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.881 3.054 . . . . 0.0 113.769 -167.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -81.1 -171.0 3.0 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.077 1.751 . . . . 0.0 111.704 168.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.478 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 70.0 p -139.4 173.38 11.6 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 127.61 2.364 . . . . 0.0 108.959 172.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -66.86 -27.18 67.32 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 120.182 1.355 . . . . 0.0 112.085 -175.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -65.67 -52.73 49.29 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 119.888 -1.757 . . . . 0.0 110.968 166.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.478 ' HB2' ' H ' ' A' ' 26' ' ' SER . 42.5 mt-10 -62.26 -48.46 79.83 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 120.623 -1.298 . . . . 0.0 112.372 -173.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.3 pt -59.92 -38.11 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.575 1.079 . . . . 0.0 112.104 173.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.02 -35.61 79.08 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.283 0.947 . . . . 0.0 111.881 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -68.3 -52.36 34.47 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.322 1.049 . . . . 0.0 112.816 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.464 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.9 mt -64.84 -32.27 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 O-C-N 121.211 -0.93 . . . . 0.0 111.627 -178.042 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.45 -22.87 66.55 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.149 1.38 . . . . 0.0 112.369 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.1 pttt -79.86 -16.11 56.06 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 175.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -87.73 -12.26 45.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.887 0.875 . . . . 0.0 112.138 -176.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.464 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.7 ptpt -125.92 -21.73 4.3 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -174.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.6 1.07 0.08 OUTLIER Glycine 0 N--CA 1.471 0.976 0 N-CA-C 115.672 1.029 . . . . 0.0 115.672 151.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -86.75 -25.92 24.45 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.41 1.105 . . . . 0.0 113.036 -168.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.6 ptmt 30.56 40.45 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 130.371 3.468 . . . . 0.0 114.474 -173.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.566 HG21 HD22 ' A' ' 8' ' ' LEU . 4.0 p -84.3 156.71 3.62 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 124.489 1.116 . . . . 0.0 109.099 175.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -109.04 169.81 8.45 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.662 2.785 . . . . 0.0 112.646 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -59.17 -32.87 70.3 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.028 1.331 . . . . 0.0 114.079 -172.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -37.53 87.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.022 0.529 . . . . 0.0 110.2 -174.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.0 m -84.31 -44.09 14.15 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 126.584 1.954 . . . . 0.0 109.941 -174.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.91 -31.18 52.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.328 -178.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.13 -36.24 72.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.815 1.646 . . . . 0.0 112.789 174.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -65.77 -27.77 68.54 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.422 0.689 . . . . 0.0 112.097 172.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -84.2 -53.69 5.33 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 124.058 0.943 . . . . 0.0 111.778 -175.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.21 -26.82 19.0 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 118.837 0.744 . . . . 0.0 112.851 174.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.3 -39.78 89.56 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.943 0.897 . . . . 0.0 113.082 175.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -92.41 -22.15 19.81 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -174.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.516 HD21 ' HG3' ' A' ' 9' ' ' MET . 0.8 OUTLIER -71.86 -65.16 0.8 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.49 1.116 . . . . 0.0 111.761 172.223 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 173.53 15.98 0.02 OUTLIER Glycine 0 CA--C 1.535 1.327 0 N-CA-C 118.024 1.97 . . . . 0.0 118.024 175.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.4 mp -120.72 135.3 24.58 Favored Pre-proline 0 CA--C 1.552 1.028 0 CA-C-N 119.408 1.604 . . . . 0.0 113.077 -166.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.29 -47.99 0.14 Allowed 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 124.333 3.355 . . . . 0.0 113.701 177.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 88.2 p -163.46 -7.75 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.903 2.081 . . . . 0.0 114.126 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.9 m 63.99 -6.59 0.25 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.515 2.726 . . . . 0.0 115.569 -162.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -81.74 -39.21 24.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.82 1.248 . . . . 0.0 110.088 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -91.19 -6.09 53.98 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.374 1.469 . . . . 0.0 114.624 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.5 mtp85 -69.29 -33.09 72.65 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 121.298 -0.876 . . . . 0.0 112.15 161.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -83.45 -63.37 1.37 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.865 2.066 . . . . 0.0 112.384 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.9 mm . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.2 1.8 . . . . 0.0 112.261 -178.061 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.76 0 C4'-C3'-C2' 100.187 -3.013 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.3 0 O4'-C1'-N19 110.221 3.026 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.548 1 O4'-C1'-N19 111.244 4.305 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.33 0 O4'-C1'-N19 110.453 3.316 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . 0.411 ' H1 ' ' N4 ' ' C' ' 87' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.544 4.136 0 O5'-C5'-C4' 114.878 3.342 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.189 0 P-O3'-C3' 123.262 2.968 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.293 0 P-O3'-C3' 123.063 2.803 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.038 0 P-O3'-C3' 123.265 2.971 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.503 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.71 1 O4'-C1'-N19 111.413 4.516 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.468 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.675 1 C4'-C3'-C2' 99.07 -4.13 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.715 1 O4'-C1'-N19 111.358 4.447 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.414 " H2'" ' H71' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.684 0 O4'-C4'-C3' 108.647 3.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.414 ' H71' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.3 0 P-O3'-C3' 123.748 3.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.357 0 C4'-C3'-C2' 99.972 -3.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.733 0 N19-C1'-C2' 109.422 -2.986 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.254 0 C3'-C2'-C1' 106.855 2.968 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.502 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.411 0 C4'-C3'-C2' 99.343 -3.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.502 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.354 0 O4'-C4'-C3' 108.553 2.953 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.468 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.925 1 O4'-C1'-N19 112.678 6.098 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.503 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.545 4.244 2 O4'-C1'-N19 117.902 12.628 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 0 O4'-C1'-N19 110.383 3.229 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.452 0 C3'-C2'-C1' 105.905 2.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.656 0 O4'-C4'-C3' 108.877 3.277 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . 0.411 ' N4 ' ' H1 ' ' B' ' 68' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.325 0 C4'-C3'-C2' 100.306 -2.894 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.744 0 P-O3'-C3' 122.635 2.446 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.351 0 P-O3'-C3' 123.228 2.94 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.021 0 O4'-C4'-C3' 108.038 2.438 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.764 0 P-O3'-C3' 122.696 2.497 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 . . . . . 0 N--CA 1.484 1.272 0 N-CA-C 111.428 0.158 . . . . 0.0 111.428 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.0 mmt 43.67 41.42 3.55 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 127.968 2.507 . . . . 0.0 114.823 168.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.784 HD12 HD23 ' A' ' 8' ' ' LEU . 41.1 mt -63.38 176.54 0.79 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 127.177 2.191 . . . . 0.0 115.116 -179.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.3 p -69.91 -169.5 0.26 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.015 1.326 . . . . 0.0 112.581 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -48.44 -24.45 1.27 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.592 1.557 . . . . 0.0 114.627 172.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.67 42.09 0.13 Allowed Glycine 0 CA--C 1.527 0.823 0 CA-C-O 117.518 -1.712 . . . . 0.0 116.081 172.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.37 -12.82 23.57 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 121.431 2.615 . . . . 0.0 113.697 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.784 HD23 HD12 ' A' ' 3' ' ' LEU . 1.5 pp -112.02 -16.46 13.07 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.915 1.286 . . . . 0.0 113.242 168.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.44 ' HG3' HD11 ' A' ' 53' ' ' LEU . 5.8 ttt -69.15 -65.92 0.64 Allowed 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.211 1.405 . . . . 0.0 110.17 178.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.518 ' C ' HD22 ' A' ' 11' ' ' LEU . 6.1 pttp -74.05 17.33 0.18 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.599 1.56 . . . . 0.0 113.7 -173.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.518 HD22 ' C ' ' A' ' 10' ' ' LYS . 3.3 mm? -128.41 -37.54 1.81 Allowed 'General case' 0 C--O 1.233 0.219 0 C-N-CA 129.205 3.002 . . . . 0.0 111.733 -172.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.1 pt -62.95 -33.19 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.648 1.113 . . . . 0.0 111.514 -178.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.03 -11.24 39.4 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -96.94 -13.35 22.46 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.385 1.874 . . . . 0.0 111.879 -174.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.9 pp -103.27 -46.97 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 124.91 1.284 . . . . 0.0 109.473 167.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.23 -36.58 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 119.828 1.194 . . . . 0.0 111.028 -174.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -78.43 -1.63 34.51 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -106.71 -16.67 14.43 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.63 1.572 . . . . 0.0 113.03 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -96.41 -88.93 0.27 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.874 0.87 . . . . 0.0 112.331 -172.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -138.76 90.68 2.47 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.719 1.208 . . . . 0.0 110.367 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -57.36 -20.5 29.57 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.71 0.804 . . . . 0.0 113.04 164.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -75.37 -21.66 58.14 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.832 2.453 . . . . 0.0 113.822 171.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -147.81 75.79 10.86 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 127.286 2.235 . . . . 0.0 110.2 -174.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -70.05 162.19 43.16 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.143 2.562 . . . . 0.0 113.1 -170.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -78.34 -166.43 0.84 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.33 1.452 . . . . 0.0 110.943 169.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.489 ' H ' ' HB2' ' A' ' 29' ' ' GLU . 67.9 m -149.85 172.43 15.17 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.205 1.802 . . . . 0.0 109.61 173.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.4 ' CG ' ' HE ' ' A' ' 43' ' ' ARG . 23.7 p30 -62.55 -31.47 72.27 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -171.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -65.03 -50.89 64.46 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.078 -1.639 . . . . 0.0 110.67 165.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.489 ' HB2' ' H ' ' A' ' 26' ' ' SER . 46.1 mt-10 -61.95 -50.97 70.0 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 120.677 -1.264 . . . . 0.0 112.531 -173.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.7 pt -59.23 -37.27 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 119.363 0.983 . . . . 0.0 112.366 174.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.72 -35.6 80.29 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.403 1.001 . . . . 0.0 111.973 176.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -67.49 -53.25 30.37 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.202 1.001 . . . . 0.0 112.745 -178.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.478 HG22 ' HE3' ' A' ' 37' ' ' LYS . 2.6 mt -63.81 -32.36 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 O-C-N 121.42 -0.8 . . . . 0.0 111.449 -177.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.86 -21.65 66.55 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.031 1.332 . . . . 0.0 112.522 175.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.5 ptmt -80.84 -15.37 56.56 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 175.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -88.33 -12.31 43.81 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.821 0.849 . . . . 0.0 112.267 -177.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.478 ' HE3' HG22 ' A' ' 33' ' ' ILE . 13.9 ptpt -126.75 -22.51 3.87 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -173.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.33 1.83 0.07 OUTLIER Glycine 0 N--CA 1.469 0.899 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 152.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.444 ' HB3' HD11 ' A' ' 3' ' ' LEU . 47.7 m-85 -88.91 -34.65 16.86 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.395 1.097 . . . . 0.0 112.017 -168.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.8 ptmt 27.12 53.61 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 129.15 2.98 . . . . 0.0 112.486 -170.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.671 HG21 HD22 ' A' ' 8' ' ' LEU . 4.2 p -88.16 142.76 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 126.372 1.869 . . . . 0.0 108.858 168.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.43 ' H ' ' P ' ' C' ' 84' ' ' ' DT' . . . -87.32 169.87 11.91 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 129.384 3.073 . . . . 0.0 113.291 175.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.4 ' HE ' ' CG ' ' A' ' 27' ' ' ASP . 0.7 OUTLIER -64.14 -28.85 70.04 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 125.681 1.592 . . . . 0.0 114.39 -171.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -35.14 69.7 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.795 1.18 . . . . 0.0 111.132 -175.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.2 m -77.43 -48.65 16.65 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 125.816 1.646 . . . . 0.0 108.589 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.29 -30.9 51.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.82 -175.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.67 -43.65 72.09 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 126.311 1.844 . . . . 0.0 111.594 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -66.99 -25.64 66.41 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 173.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -79.4 -46.47 17.51 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.666 0.787 . . . . 0.0 112.673 -178.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 30.8 ptt85 -51.94 -31.68 29.91 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.765 1.166 . . . . 0.0 111.821 170.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -77.89 -23.51 48.72 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 178.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.9 ptm -93.05 -26.99 17.25 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.573 1.079 . . . . 0.0 112.823 177.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.44 HD11 ' HG3' ' A' ' 9' ' ' MET . 2.2 mp -73.73 -74.63 0.17 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.994 1.318 . . . . 0.0 111.322 172.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 176.12 14.53 0.02 OUTLIER Glycine 0 CA--C 1.537 1.44 0 N-CA-C 118.253 2.061 . . . . 0.0 118.253 178.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.9 mt -112.27 126.39 28.48 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 119.556 1.678 . . . . 0.0 111.773 -173.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.29 -70.36 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 124.143 3.229 . . . . 0.0 110.348 173.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 95.2 p -141.38 -7.05 1.02 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.41 2.284 . . . . 0.0 113.351 174.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.2 m 56.86 -1.58 0.05 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 128.488 2.715 . . . . 0.0 116.088 -161.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -82.45 -39.63 22.28 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 120.309 1.413 . . . . 0.0 110.369 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -73.44 -20.62 60.67 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.2 mtp180 -75.3 -42.54 54.47 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.678 1.191 . . . . 0.0 112.43 167.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -66.15 -58.67 4.92 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.231 1.812 . . . . 0.0 112.835 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 C--O 1.254 1.308 0 C-N-CA 125.498 1.519 . . . . 0.0 114.441 -169.432 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.719 0 C4'-C3'-C2' 100.162 -3.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.41 1 O4'-C1'-N19 111.439 4.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.801 1 O4'-C1'-N19 111.654 4.818 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C1'-N19 110.275 3.094 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.385 0 O4'-C4'-C3' 108.125 2.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.452 0 P-O3'-C3' 123.345 3.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.144 0 O4'-C1'-N19 110.787 3.734 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.082 0 P-O3'-C3' 123.498 3.165 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' ' DC' . . . . . 0.484 ' H42' ' H1 ' ' C' ' 83' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.716 1 O4'-C1'-N19 111.141 4.176 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' ' DG' . . . . . 0.463 ' H1 ' ' H42' ' C' ' 82' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.282 1 C4'-C3'-C2' 99.002 -4.198 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.329 1 O4'-C1'-N19 111.261 4.326 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' ' DT' . . . . . 0.404 " H2'" ' H72' ' B' ' 76' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.483 0 O4'-C4'-C3' 108.96 3.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' ' DT' . . . . . 0.404 ' H72' " H2'" ' B' ' 75' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.158 0 P-O3'-C3' 123.64 3.283 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 0 C4'-C3'-C2' 100.292 -2.908 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 78' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.718 0 N19-C1'-C2' 109.171 -3.143 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 79' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.188 0 C3'-C2'-C1' 106.753 2.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 80' ' ' ' DA' . . . . . 0.529 " H2'" ' C8 ' ' C' ' 81' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.294 0 O4'-C4'-C3' 109.299 3.699 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 81' ' ' ' DA' . . . . . 0.529 ' C8 ' " H2'" ' C' ' 80' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.154 0 O4'-C4'-C3' 108.64 3.04 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 82' ' ' ' DC' . . . . . 0.463 ' H42' ' H1 ' ' B' ' 73' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.59 1 O4'-C1'-N19 111.653 4.816 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 83' ' ' ' DG' . . . . . 0.484 ' H1 ' ' H42' ' B' ' 72' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.535 3.05 2 O4'-C1'-N19 118.094 12.868 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 84' ' ' ' DT' . . . . . 0.43 ' P ' ' H ' ' A' ' 42' ' ' ALA . . . . . . . . 0 C5'--C4' 1.537 3.256 1 O4'-C1'-N19 111.849 5.061 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 85' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.396 0 C3'-C2'-C1' 105.942 2.316 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 86' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.523 0 O4'-C4'-C3' 108.374 2.774 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 87' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.432 0 P-O3'-C3' 123.145 2.871 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 88' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.756 0 O4'-C1'-N19 110.105 2.881 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 89' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.578 0 P-O3'-C3' 123.355 3.046 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 90' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.11 0 O4'-C4'-C3' 108.679 3.079 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 91' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.943 0 C4'-C3'-C2' 100.502 -2.698 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_