data_2joc_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 2joc _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 6' ' ' LEU . . . . . 1.074 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.51 -0.589 0 CA-C-O 121.736 0.779 . . . . 15.0 110.915 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.923 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 14.8 Cg_exo -72.92 -60.42 0.05 OUTLIER 'Trans proline' 0 C--N 1.319 -0.977 0 C-N-CA 123.564 2.843 . . . . 15.0 113.066 -179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.929 ' HB2' ' HE1' ' A' ' 10' ' ' TRP . 1.4 Cg_endo -81.48 53.44 4.69 Favored 'Trans proline' 0 C--N 1.321 -0.877 0 C-N-CA 124.391 3.394 . . . . 15.0 112.767 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 51.32 65.39 3.16 Favored Glycine 0 C--O 1.23 -0.107 0 N-CA-C 109.164 -1.574 . . . . 15.0 109.164 -177.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.956 ' HB3' ' CD ' ' A' ' 12' ' ' LYS . 12.7 m95 -116.49 151.91 35.14 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.011 1.115 . . . . 15.0 114.011 -175.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.969 ' O ' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -98.46 94.12 6.54 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.203 -1.036 . . . . 15.0 108.203 176.415 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 1.074 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -118.07 150.91 38.53 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.364 -0.835 . . . . 15.0 110.26 -178.713 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.671 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 1.5 ptm85 -149.41 147.82 28.73 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.496 -0.775 . . . . 15.0 111.019 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.5 m -118.21 94.4 4.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.033 -0.53 . . . . 15.0 112.047 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.869 ' O ' ' N ' ' A' ' 18' ' ' GLY . 8.7 t70 -89.51 147.66 23.85 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.638 -0.875 . . . . 15.0 108.638 178.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 1.087 ' C ' ' N ' ' A' ' 18' ' ' GLY . 68.9 p -47.93 -19.19 0.22 Allowed 'General case' 0 CA--C 1.493 -1.244 0 CA-C-O 118.667 -0.682 . . . . 15.0 112.083 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.723 ' C ' ' O ' ' A' ' 16' ' ' SER . 47.2 t30 -41.12 -16.98 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.235 1 N-CA-C 96.475 -5.38 . . . . 15.0 96.475 169.439 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 1.087 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 52.01 58.5 10.45 Favored Glycine 0 N--CA 1.431 -1.65 1 CA-C-N 107.554 -4.384 . . . . 15.0 112.331 176.428 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.445 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 8.7 tpp180 -138.25 151.57 47.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 112.357 -1.922 . . . . 15.0 109.958 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.788 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 38.1 t -97.06 115.13 35.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.155 -0.475 . . . . 15.0 110.62 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.836 ' HE1' ' HB ' ' A' ' 23' ' ' VAL . 0.1 OUTLIER -115.82 152.06 34.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.32 -0.4 . . . . 15.0 111.937 -178.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.921 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 5.2 m-85 -126.51 121.26 31.81 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.769 -0.651 . . . . 15.0 112.411 -177.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.969 HG11 ' O ' ' A' ' 11' ' ' GLU . 11.0 p -112.74 97.76 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 109.281 -0.636 . . . . 15.0 109.281 177.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.502 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 2.9 t-20 -103.27 122.24 44.37 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 107.708 -1.219 . . . . 15.0 107.708 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.49 ' CD2' ' H ' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -117.0 83.75 2.03 Favored 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 118.32 -1.352 . . . . 15.0 113.66 -177.4 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.46 ' CG ' ' H ' ' A' ' 27' ' ' THR . 1.2 p30 -94.19 -81.82 0.37 Allowed 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 104.507 -2.405 . . . . 15.0 104.507 172.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.899 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -93.57 -78.02 0.44 Allowed 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 106.826 -1.546 . . . . 15.0 106.826 173.099 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.899 ' H ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -152.42 89.6 1.43 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 114.803 -1.09 . . . . 15.0 110.084 177.073 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.736 HD13 ' NH2' ' A' ' 28' ' ' ARG . 47.0 mm . . . . . 0 N--CA 1.467 0.414 0 N-CA-C 112.834 0.679 . . . . 15.0 112.834 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.728 HE21 ' C ' ' A' ' 31' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.396 0 N-CA-C 109.86 -0.422 . . . . 15.0 109.86 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.788 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 1.7 m95 -96.56 78.58 2.98 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 118.345 -1.342 . . . . 15.0 110.179 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.855 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 3.5 tt0 -159.57 151.65 20.75 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 113.572 0.953 . . . . 15.0 113.572 176.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.921 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 7.0 t0 -66.55 131.52 94.14 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 105.228 -2.138 . . . . 15.0 105.228 173.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.913 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 Cg_endo . . . . . 0 N--CA 1.459 -0.555 0 C-N-CA 122.307 2.005 . . . . 15.0 112.825 -175.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.993 ' HB3' ' HD3' ' A' ' 12' ' ' LYS . 1.6 pp . . . . . 0 CA--C 1.517 -0.293 0 N-CA-C 115.174 1.546 . . . . 15.0 115.174 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.972 ' CD ' ' HD3' ' A' ' 8' ' ' PRO . 33.6 Cg_exo -71.96 -51.31 0.23 Allowed 'Trans proline' 0 C--N 1.326 -0.628 0 C-N-CA 123.391 2.727 . . . . 15.0 112.356 174.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.972 ' HD3' ' CD ' ' A' ' 7' ' ' PRO . 1.9 Cg_endo -82.09 -174.83 2.26 Favored 'Trans proline' 0 C--N 1.326 -0.618 0 C-N-CA 125.109 3.873 . . . . 15.0 113.071 -179.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.96 90.39 0.25 Allowed Glycine 0 C--N 1.337 0.63 0 N-CA-C 109.688 -1.365 . . . . 15.0 109.688 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.991 ' CE2' ' HG2' ' A' ' 35' ' ' PRO . 32.4 m95 -133.74 152.93 52.01 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 113.571 0.952 . . . . 15.0 113.571 -176.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.729 ' N ' ' HZ1' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -99.94 89.6 4.12 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.85 -1.167 . . . . 15.0 107.85 175.032 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.993 ' HD3' ' HB3' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -110.36 150.52 28.67 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.003 -0.544 . . . . 15.0 110.177 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.663 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 28.9 ttm180 -146.84 150.55 35.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.803 -0.635 . . . . 15.0 112.165 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.7 p -124.54 89.61 3.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.333 -0.849 . . . . 15.0 110.802 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.848 ' O ' ' N ' ' A' ' 18' ' ' GLY . 11.4 t70 -103.4 150.74 23.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.877 -0.601 . . . . 15.0 109.882 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 1.044 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.2 t -48.69 -19.3 0.34 Allowed 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 118.853 -0.594 . . . . 15.0 111.395 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.753 ' C ' ' O ' ' A' ' 16' ' ' SER . 42.3 m-80 -40.31 -17.07 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.249 1 N-CA-C 96.437 -5.394 . . . . 15.0 96.437 169.625 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 1.044 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.68 57.32 10.91 Favored Glycine 0 N--CA 1.429 -1.783 1 CA-C-N 107.575 -4.375 . . . . 15.0 112.117 176.321 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.45 ' HB3' ' CZ3' ' A' ' 32' ' ' TRP . 0.0 OUTLIER -140.03 148.03 41.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 112.478 -1.861 . . . . 15.0 110.28 179.553 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.782 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 25.4 m -96.1 96.51 5.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.551 -0.537 . . . . 15.0 109.551 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.767 ' HB3' ' CE3' ' A' ' 32' ' ' TRP . 0.9 OUTLIER -107.81 151.08 26.21 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.719 0.637 . . . . 15.0 112.719 -177.518 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.881 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 6.6 m-85 -122.2 129.37 52.21 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.452 -0.795 . . . . 15.0 111.466 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.758 ' H ' ' HE3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -125.43 94.58 2.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.476 0.655 . . . . 15.0 110.756 178.11 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.632 ' ND2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 m-20 -109.51 135.29 50.75 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 115.037 -0.983 . . . . 15.0 108.394 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.8 m-70 -118.76 84.08 2.13 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 118.51 -1.276 . . . . 15.0 112.98 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -93.32 -81.16 0.37 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 104.056 -2.572 . . . . 15.0 104.056 172.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.926 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.8 OUTLIER -93.18 -79.96 0.39 Allowed 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.409 -1.7 . . . . 15.0 106.409 172.762 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.926 ' H ' HG23 ' A' ' 27' ' ' THR . 16.3 ptm180 -152.86 89.82 1.42 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.757 -1.111 . . . . 15.0 109.527 176.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.547 HD11 ' O ' ' A' ' 28' ' ' ARG . 51.2 mm . . . . . 0 N--CA 1.466 0.327 0 N-CA-C 113.362 0.875 . . . . 15.0 113.362 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.783 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.514 0 N-CA-C 109.593 -0.521 . . . . 15.0 109.593 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.782 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -91.96 78.91 5.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 118.246 -1.382 . . . . 15.0 109.586 179.279 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.796 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 7.3 tt0 -159.36 151.95 21.5 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 113.457 0.91 . . . . 15.0 113.457 177.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.796 ' N ' ' HG2' ' A' ' 33' ' ' GLU . 5.4 p-10 -69.93 138.08 87.61 Favored Pre-proline 0 C--N 1.331 -0.217 0 N-CA-C 104.996 -2.224 . . . . 15.0 104.996 172.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.991 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.7 Cg_endo . . . . . 0 N--CA 1.456 -0.732 0 C-N-CA 122.603 2.202 . . . . 15.0 112.701 -175.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 1.081 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.511 -0.551 0 CA-C-O 121.397 0.618 . . . . 15.0 111.449 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 1.048 ' HB2' ' HD3' ' A' ' 8' ' ' PRO . 36.1 Cg_exo -65.67 -57.78 0.23 Allowed 'Trans proline' 0 C--N 1.322 -0.837 0 C-N-CA 122.839 2.359 . . . . 15.0 110.032 178.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 1.048 ' HD3' ' HB2' ' A' ' 7' ' ' PRO . 1.3 Cg_endo -85.95 -176.17 2.08 Favored 'Trans proline' 0 C--N 1.32 -0.947 0 C-N-CA 124.998 3.798 . . . . 15.0 109.423 176.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.42 ' O ' ' ND2' ' A' ' 24' ' ' ASN . . . -59.75 83.27 0.01 OUTLIER Glycine 0 CA--C 1.517 0.165 0 N-CA-C 109.373 -1.491 . . . . 15.0 109.373 176.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.937 ' CE2' ' HG2' ' A' ' 35' ' ' PRO . 26.3 m95 -128.35 150.47 50.07 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 114.054 1.131 . . . . 15.0 114.054 -176.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.836 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -110.77 88.7 2.84 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 107.966 -1.124 . . . . 15.0 107.966 176.454 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 1.081 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -105.21 150.46 25.08 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.686 -0.688 . . . . 15.0 109.875 -178.986 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -150.47 150.42 31.29 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.716 -0.674 . . . . 15.0 111.967 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.631 ' O ' HG22 ' A' ' 14' ' ' THR . 10.2 t -118.28 89.48 3.13 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.686 -0.688 . . . . 15.0 111.068 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.912 ' O ' ' N ' ' A' ' 18' ' ' GLY . 14.4 t70 -94.22 150.58 20.17 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 109.086 -0.709 . . . . 15.0 109.086 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 1.093 ' C ' ' N ' ' A' ' 18' ' ' GLY . 67.2 p -44.39 -18.99 0.02 OUTLIER 'General case' 0 CA--C 1.492 -1.27 0 CA-C-O 118.612 -0.708 . . . . 15.0 111.676 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.722 ' C ' ' O ' ' A' ' 16' ' ' SER . 13.9 m120 -41.33 -16.92 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.252 1 N-CA-C 96.552 -5.351 . . . . 15.0 96.552 169.524 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 1.093 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 51.39 58.72 9.38 Favored Glycine 0 N--CA 1.429 -1.806 1 CA-C-N 107.492 -4.413 . . . . 15.0 112.366 176.498 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.4 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 1.3 tpp180 -150.18 151.81 33.67 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 112.429 -1.886 . . . . 15.0 110.252 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.755 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 34.0 m -97.97 100.66 11.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.704 -0.68 . . . . 15.0 110.295 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.859 ' HE1' ' HB ' ' A' ' 23' ' ' VAL . 0.1 OUTLIER -107.03 151.7 24.99 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.321 0.489 . . . . 15.0 112.321 -178.35 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.834 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 4.9 m-85 -114.42 120.65 41.03 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 112.658 0.614 . . . . 15.0 112.658 -178.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.859 ' HB ' ' HE1' ' A' ' 21' ' ' TYR . 7.1 p -114.56 96.65 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 115.68 -0.691 . . . . 15.0 109.413 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.6 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 26.6 t-20 -122.2 136.59 54.93 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.338 -0.846 . . . . 15.0 108.805 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.576 ' HE2' ' CG2' ' A' ' 23' ' ' VAL . 53.3 m-70 -126.41 84.46 2.27 Favored 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 118.49 -1.284 . . . . 15.0 113.242 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -93.33 -80.43 0.38 Allowed 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 103.836 -2.653 . . . . 15.0 103.836 172.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 52.3 p -92.98 -80.6 0.37 Allowed 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 106.235 -1.765 . . . . 15.0 106.235 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -153.59 90.1 1.38 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 114.885 -1.052 . . . . 15.0 110.343 176.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.576 HG22 ' O ' ' A' ' 24' ' ' ASN . 7.0 tp . . . . . 0 N--CA 1.469 0.482 0 CA-C-N 118.911 0.778 . . . . 15.0 112.775 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.801 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 15.8 pt20 . . . . . 0 CA--C 1.513 -0.455 0 N-CA-C 109.702 -0.481 . . . . 15.0 109.702 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.755 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -91.71 77.47 5.59 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 117.619 -1.632 . . . . 15.0 108.791 178.481 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.741 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 7.5 tt0 -160.19 152.27 20.41 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 113.047 0.758 . . . . 15.0 113.047 177.111 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.802 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 5.0 p-10 -63.79 134.37 95.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 105.36 -2.089 . . . . 15.0 105.36 173.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.937 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 2.2 Cg_endo . . . . . 0 N--CA 1.461 -0.43 0 C-N-CA 122.719 2.279 . . . . 15.0 113.346 -175.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.94 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.2 OUTLIER . . . . . 0 CA--C 1.51 -0.558 0 CA-C-O 121.534 0.683 . . . . 15.0 109.978 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.964 ' HB2' ' HD3' ' A' ' 8' ' ' PRO . 38.4 Cg_exo -63.59 -57.73 0.35 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.97 2.447 . . . . 15.0 110.923 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.964 ' HD3' ' HB2' ' A' ' 7' ' ' PRO . 1.9 Cg_endo -87.93 -177.25 1.88 Allowed 'Trans proline' 0 C--N 1.315 -1.225 0 C-N-CA 124.91 3.74 . . . . 15.0 109.481 176.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.415 ' C ' ' CD1' ' A' ' 10' ' ' TRP . . . -60.78 88.82 0.04 OUTLIER Glycine 0 CA--C 1.517 0.192 0 N-CA-C 108.968 -1.653 . . . . 15.0 108.968 176.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.938 ' O ' HD23 ' A' ' 6' ' ' LEU . 27.4 m95 -130.73 150.76 51.76 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 114.349 1.24 . . . . 15.0 114.349 -175.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.847 ' N ' ' HZ1' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -111.17 89.35 3.02 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 107.678 -1.23 . . . . 15.0 107.678 176.097 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.94 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -108.38 150.24 27.63 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.856 -0.611 . . . . 15.0 111.121 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.572 ' HD3' ' HE2' ' A' ' 21' ' ' TYR . 12.3 ptm180 -147.49 147.88 30.64 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.319 -0.855 . . . . 15.0 110.9 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.69 HG23 HG11 ' A' ' 20' ' ' VAL . 67.9 p -123.63 89.44 3.09 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.727 -0.67 . . . . 15.0 110.616 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.825 ' O ' ' N ' ' A' ' 18' ' ' GLY . 12.8 t70 -91.53 150.61 21.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.534 -0.757 . . . . 15.0 109.852 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 1.115 ' C ' ' N ' ' A' ' 18' ' ' GLY . 7.8 t -50.37 -19.2 0.77 Allowed 'General case' 0 CA--C 1.489 -1.393 0 CA-C-O 118.838 -0.601 . . . . 15.0 111.265 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.73 ' C ' ' O ' ' A' ' 16' ' ' SER . 46.7 m-80 -40.39 -17.28 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.232 1 N-CA-C 96.507 -5.368 . . . . 15.0 96.507 169.529 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 1.115 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 53.12 57.98 13.21 Favored Glycine 0 N--CA 1.43 -1.734 1 CA-C-N 107.335 -4.484 . . . . 15.0 112.612 176.222 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.38 148.91 43.49 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 112.474 -1.863 . . . . 15.0 109.841 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.728 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 34.3 m -100.83 106.33 19.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.497 -0.319 . . . . 15.0 110.171 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.69 ' HB3' ' CE3' ' A' ' 32' ' ' TRP . 0.4 OUTLIER -119.16 150.77 39.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.12 0.486 . . . . 15.0 112.084 -178.558 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.934 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 3.8 m-85 -119.16 133.73 55.61 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.55 -0.75 . . . . 15.0 111.781 -177.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.758 ' H ' ' HE3' ' A' ' 12' ' ' LYS . 1.3 m -122.58 102.13 11.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.243 0.544 . . . . 15.0 110.255 177.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.628 ' OD1' ' HB ' ' A' ' 29' ' ' ILE . 5.4 p30 -111.36 121.55 45.53 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.208 -0.906 . . . . 15.0 108.848 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -117.05 84.51 2.16 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 119.132 -1.027 . . . . 15.0 112.855 -178.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.676 ' CG ' ' H ' ' A' ' 27' ' ' THR . 1.8 p30 -92.55 -80.31 0.37 Allowed 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 103.622 -2.732 . . . . 15.0 103.622 172.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.732 HG23 ' HD2' ' A' ' 28' ' ' ARG . 96.9 m -92.84 -81.0 0.36 Allowed 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 106.336 -1.728 . . . . 15.0 106.336 172.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.732 ' HD2' HG23 ' A' ' 27' ' ' THR . 1.1 ptm180 -154.0 90.02 1.34 Allowed 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 114.927 -1.033 . . . . 15.0 110.441 176.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.628 ' HB ' ' OD1' ' A' ' 24' ' ' ASN . 47.3 mm . . . . . 0 N--CA 1.467 0.421 0 N-CA-C 113.635 0.976 . . . . 15.0 113.635 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.8 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.482 0 N-CA-C 109.67 -0.493 . . . . 15.0 109.67 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.728 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -93.83 77.54 4.21 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 117.822 -1.551 . . . . 15.0 109.661 178.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.804 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 5.3 tt0 -160.68 151.81 18.98 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.436 0.902 . . . . 15.0 113.436 176.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.934 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 1.6 p-10 -66.71 133.2 94.1 Favored Pre-proline 0 C--N 1.33 -0.251 0 N-CA-C 105.068 -2.197 . . . . 15.0 105.068 172.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.912 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 2.4 Cg_endo . . . . . 0 N--CA 1.454 -0.805 0 C-N-CA 122.793 2.329 . . . . 15.0 113.325 -175.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 1.03 ' HG ' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.506 0 CA-C-O 121.719 0.771 . . . . 15.0 111.179 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.951 ' HB2' ' HD3' ' A' ' 8' ' ' PRO . 21.9 Cg_exo -69.56 -59.42 0.09 OUTLIER 'Trans proline' 0 C--N 1.322 -0.842 0 C-N-CA 123.708 2.939 . . . . 15.0 111.872 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.955 ' HG2' ' NE1' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -81.92 176.49 8.26 Favored 'Trans proline' 0 C--N 1.32 -0.964 0 C-N-CA 124.317 3.345 . . . . 15.0 110.334 178.124 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.62 80.12 0.01 OUTLIER Glycine 0 C--N 1.33 0.235 0 C-N-CA 119.396 -1.383 . . . . 15.0 109.834 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 1.01 ' HB3' ' NZ ' ' A' ' 12' ' ' LYS . 23.3 m95 -118.77 149.02 42.18 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.796 1.036 . . . . 15.0 113.796 -176.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.872 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 43.0 tt0 -104.29 88.1 2.9 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.333 -0.988 . . . . 15.0 108.333 177.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 1.03 ' HB2' ' HG ' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -106.48 151.27 25.18 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.35 -0.841 . . . . 15.0 110.117 -179.469 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.813 ' HD3' ' H ' ' A' ' 14' ' ' THR . 12.1 tpp180 -143.12 143.55 31.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.563 -0.744 . . . . 15.0 111.753 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.813 ' H ' ' HD3' ' A' ' 13' ' ' ARG . 72.3 p -118.12 89.39 3.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.401 -0.818 . . . . 15.0 110.686 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.892 ' O ' ' N ' ' A' ' 18' ' ' GLY . 18.6 t70 -106.77 150.66 26.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.686 -0.688 . . . . 15.0 109.432 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 1.141 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.2 t -44.1 -19.06 0.02 OUTLIER 'General case' 0 CA--C 1.489 -1.367 0 CA-C-O 118.976 -0.535 . . . . 15.0 111.355 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.721 ' C ' ' O ' ' A' ' 16' ' ' SER . 2.6 t-20 -40.86 -16.89 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.254 1 N-CA-C 96.388 -5.412 . . . . 15.0 96.388 169.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 1.141 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.0 58.5 8.55 Favored Glycine 0 N--CA 1.429 -1.778 1 CA-C-N 107.522 -4.399 . . . . 15.0 112.38 176.321 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.403 ' HB3' ' CZ3' ' A' ' 32' ' ' TRP . 5.1 tpp85 -146.62 151.32 37.09 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 112.395 -1.903 . . . . 15.0 110.408 179.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.689 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 13.3 m -99.08 90.39 2.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.682 -0.69 . . . . 15.0 109.78 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.792 ' CE2' ' HB3' ' A' ' 13' ' ' ARG . 1.3 p90 -95.91 151.11 19.72 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.745 0.646 . . . . 15.0 112.745 -177.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.825 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 10.7 m-85 -120.63 125.55 48.01 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.687 -0.688 . . . . 15.0 111.839 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.817 ' H ' ' HE3' ' A' ' 12' ' ' LYS . 3.5 t -118.55 89.84 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 115.651 -0.704 . . . . 15.0 110.288 178.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.828 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 3.4 t-20 -111.45 125.57 54.03 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 108.191 -1.04 . . . . 15.0 108.191 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.75 ' NE2' HG12 ' A' ' 23' ' ' VAL . 55.2 m-70 -116.62 83.46 1.97 Allowed 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 118.36 -1.336 . . . . 15.0 113.289 -178.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.568 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.8 OUTLIER -94.3 -81.09 0.39 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 104.331 -2.47 . . . . 15.0 104.331 172.315 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.921 HG21 ' H ' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -93.05 -79.74 0.39 Allowed 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.065 -1.457 . . . . 15.0 107.065 173.375 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.921 ' H ' HG21 ' A' ' 27' ' ' THR . 0.4 OUTLIER -152.47 89.82 1.45 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.836 -1.075 . . . . 15.0 110.039 177.423 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.461 HG22 ' HH2' ' A' ' 10' ' ' TRP . 51.2 mt . . . . . 0 N--CA 1.464 0.269 0 N-CA-C 113.083 0.772 . . . . 15.0 113.083 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.716 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 3.6 pt20 . . . . . 0 CA--C 1.509 -0.6 0 N-CA-C 108.816 -0.809 . . . . 15.0 108.816 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.777 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -89.72 77.33 7.12 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 117.516 -1.673 . . . . 15.0 108.919 179.259 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.721 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 5.0 tt0 -160.54 152.16 19.66 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 113.218 0.822 . . . . 15.0 113.218 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.744 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -65.05 137.99 97.28 Favored Pre-proline 0 C--N 1.329 -0.319 0 N-CA-C 105.295 -2.113 . . . . 15.0 105.295 173.06 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.991 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 3.2 Cg_endo . . . . . 0 N--CA 1.454 -0.809 0 C-N-CA 123.189 2.593 . . . . 15.0 113.385 -175.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 1.065 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.51 -0.585 0 CA-C-O 121.611 0.719 . . . . 15.0 111.5 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.944 ' HB2' ' HD3' ' A' ' 8' ' ' PRO . 14.2 Cg_exo -73.16 -60.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.32 -0.931 0 C-N-CA 123.299 2.666 . . . . 15.0 112.881 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.944 ' HD3' ' HB2' ' A' ' 7' ' ' PRO . 1.3 Cg_endo -80.7 53.59 4.84 Favored 'Trans proline' 0 C--N 1.322 -0.838 0 C-N-CA 124.667 3.578 . . . . 15.0 112.745 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 49.59 63.73 3.91 Favored Glycine 0 C--O 1.23 -0.095 0 N-CA-C 109.217 -1.553 . . . . 15.0 109.217 -177.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.962 ' HB3' ' CD ' ' A' ' 12' ' ' LYS . 10.5 m95 -112.58 151.43 30.06 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.688 0.996 . . . . 15.0 113.688 -175.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.884 ' HB3' HG13 ' A' ' 23' ' ' VAL . 32.1 tt0 -96.63 88.92 4.79 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.474 -0.936 . . . . 15.0 108.474 176.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 1.065 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -114.23 151.35 32.93 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.598 -0.728 . . . . 15.0 110.677 -178.941 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.722 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 10.2 ptm180 -147.63 149.18 32.02 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.46 -0.791 . . . . 15.0 110.996 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.718 HG23 HG11 ' A' ' 20' ' ' VAL . 74.7 p -119.0 89.57 3.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.848 -0.615 . . . . 15.0 111.088 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.854 ' O ' ' N ' ' A' ' 18' ' ' GLY . 16.9 t70 -92.3 150.57 20.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.609 -0.723 . . . . 15.0 109.432 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 1.12 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.1 t -50.48 -19.25 0.82 Allowed 'General case' 0 CA--C 1.489 -1.376 0 CA-C-O 119.018 -0.515 . . . . 15.0 111.48 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.713 ' C ' ' O ' ' A' ' 16' ' ' SER . 2.7 t-20 -40.91 -17.06 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.205 1 N-CA-C 96.331 -5.433 . . . . 15.0 96.331 169.575 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 1.12 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 52.67 59.29 9.39 Favored Glycine 0 N--CA 1.431 -1.661 1 CA-C-N 107.458 -4.428 . . . . 15.0 112.553 176.181 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.421 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 8.3 tpt180 -141.86 151.21 42.5 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 112.418 -1.891 . . . . 15.0 109.859 179.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.718 HG11 HG23 ' A' ' 14' ' ' THR . 35.6 m -101.25 94.74 3.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.028 -0.533 . . . . 15.0 110.266 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.747 ' HA ' ' HA ' ' A' ' 32' ' ' TRP . 0.1 OUTLIER -100.69 151.08 22.07 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.203 0.445 . . . . 15.0 112.203 -178.319 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.925 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 4.6 m-85 -118.5 121.63 40.74 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 113.03 0.752 . . . . 15.0 113.03 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.884 HG13 ' HB3' ' A' ' 11' ' ' GLU . 1.0 OUTLIER -107.86 89.74 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 115.483 -0.781 . . . . 15.0 108.981 177.583 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.832 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 3.2 t-20 -110.79 122.53 48.05 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.495 -0.928 . . . . 15.0 108.495 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.547 ' CD2' HG12 ' A' ' 23' ' ' VAL . 29.4 m-70 -120.88 83.4 2.06 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 118.047 -1.461 . . . . 15.0 113.58 -178.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.716 ' CG ' ' H ' ' A' ' 27' ' ' THR . 2.4 p30 -94.7 -80.96 0.4 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.585 -2.376 . . . . 15.0 104.585 172.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.716 ' H ' ' CG ' ' A' ' 26' ' ' ASN . 93.6 m -93.38 -77.7 0.44 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.078 -1.419 . . . . 15.0 107.246 173.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 28' ' ' ARG . 8.8 tpt180 -152.1 90.06 1.49 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.643 -1.162 . . . . 15.0 110.105 177.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.656 HG13 HD22 ' A' ' 26' ' ' ASN . 38.5 mm . . . . . 0 N--CA 1.466 0.365 0 N-CA-C 112.93 0.715 . . . . 15.0 112.93 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.771 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.514 -0.42 0 N-CA-C 109.351 -0.611 . . . . 15.0 109.351 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.747 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -92.7 78.26 4.85 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 117.752 -1.579 . . . . 15.0 109.238 179.069 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.797 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 3.7 tt0 -160.14 151.8 19.92 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 113.032 0.753 . . . . 15.0 113.032 177.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.925 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 3.8 p30 -65.88 133.42 94.92 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 105.545 -2.02 . . . . 15.0 105.545 173.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.96 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 Cg_endo . . . . . 0 N--CA 1.459 -0.55 0 C-N-CA 122.79 2.327 . . . . 15.0 113.062 -175.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.913 HD12 ' HE3' ' A' ' 12' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.501 -0.908 0 CA-C-O 121.708 0.765 . . . . 15.0 110.604 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.947 ' HB2' ' HD3' ' A' ' 8' ' ' PRO . 32.0 Cg_exo -61.28 -53.99 2.07 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 122.532 2.155 . . . . 15.0 108.872 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 1.021 ' HG2' ' NE1' ' A' ' 10' ' ' TRP . 2.8 Cg_endo -90.55 -170.57 0.39 Allowed 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 125.229 3.952 . . . . 15.0 109.611 174.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.414 ' C ' ' CD1' ' A' ' 10' ' ' TRP . . . -68.33 93.2 0.28 Allowed Glycine 0 CA--C 1.519 0.296 0 N-CA-C 109.443 -1.463 . . . . 15.0 109.443 177.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 1.021 ' NE1' ' HG2' ' A' ' 8' ' ' PRO . 36.5 m95 -129.74 148.24 51.6 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 115.079 1.511 . . . . 15.0 115.079 -175.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.661 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -101.56 89.74 3.82 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 106.025 -1.842 . . . . 15.0 106.025 175.53 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 1.089 ' HD2' ' CE2' ' A' ' 22' ' ' PHE . 10.1 mtpp -110.04 155.3 22.03 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 114.735 1.383 . . . . 15.0 114.735 -174.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.784 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 9.7 ttp180 -150.38 147.05 27.11 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 112.729 -2.032 . . . . 15.0 112.05 -178.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.558 ' O ' HG22 ' A' ' 14' ' ' THR . 4.9 t -132.61 95.16 3.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.343 -0.844 . . . . 15.0 110.792 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.856 ' O ' ' N ' ' A' ' 18' ' ' GLY . 19.4 t70 -111.28 150.95 28.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.886 -0.597 . . . . 15.0 110.483 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 1.093 ' C ' ' N ' ' A' ' 18' ' ' GLY . 70.4 p -45.28 -18.76 0.03 OUTLIER 'General case' 0 CA--C 1.49 -1.332 0 CA-C-O 118.744 -0.646 . . . . 15.0 111.413 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.747 ' C ' ' O ' ' A' ' 16' ' ' SER . 12.3 m120 -39.89 -17.13 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.234 1 N-CA-C 96.497 -5.371 . . . . 15.0 96.497 169.451 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 1.093 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.36 55.56 15.93 Favored Glycine 0 N--CA 1.43 -1.752 1 CA-C-N 107.665 -4.334 . . . . 15.0 111.992 176.541 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.437 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -137.65 150.67 47.56 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 112.301 -1.949 . . . . 15.0 109.648 179.34 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.676 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 4.2 t -99.1 95.95 4.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.557 -0.534 . . . . 15.0 109.557 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.799 ' HA ' ' HA ' ' A' ' 32' ' ' TRP . 0.1 OUTLIER -101.13 150.76 22.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.198 0.523 . . . . 15.0 112.329 -177.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 1.089 ' CE2' ' HD2' ' A' ' 12' ' ' LYS . 5.0 m-85 -124.92 134.32 52.71 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.479 -0.782 . . . . 15.0 112.287 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.661 ' HB ' ' O ' ' A' ' 11' ' ' GLU . 13.5 t -122.5 89.27 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 115.546 -0.752 . . . . 15.0 109.681 178.188 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.765 ' O ' ' O ' ' A' ' 29' ' ' ILE . 9.3 t-20 -133.8 134.79 43.29 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 108.631 -0.877 . . . . 15.0 108.631 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.759 ' HB2' ' HA ' ' A' ' 28' ' ' ARG . 10.6 p80 -151.87 88.82 1.42 Allowed 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 118.161 -1.416 . . . . 15.0 114.275 -178.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.442 ' C ' ' O ' ' A' ' 25' ' ' HIS . 2.5 t-20 -50.62 -60.41 3.06 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 102.767 -3.049 . . . . 15.0 102.767 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.788 HG21 ' NE ' ' A' ' 28' ' ' ARG . 15.5 m -92.84 -81.94 0.34 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.882 -1.508 . . . . 15.0 106.999 173.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.788 ' NE ' HG21 ' A' ' 27' ' ' THR . 0.0 OUTLIER -154.71 100.41 2.23 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.815 -0.63 . . . . 15.0 111.672 177.135 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.765 ' O ' ' O ' ' A' ' 24' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.499 0 CA-C-N 119.538 1.063 . . . . 15.0 112.627 178.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.863 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 2.6 pt20 . . . . . 0 CA--C 1.511 -0.542 0 N-CA-C 109.256 -0.646 . . . . 15.0 109.256 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.799 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -91.67 78.23 5.54 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 117.67 -1.612 . . . . 15.0 109.366 178.808 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.778 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 8.0 tt0 -159.66 151.77 20.75 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 113.162 0.801 . . . . 15.0 113.162 176.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.83 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 5.0 p-10 -65.39 132.95 95.28 Favored Pre-proline 0 C--N 1.331 -0.224 0 N-CA-C 104.517 -2.401 . . . . 15.0 104.517 172.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.97 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 3.2 Cg_exo . . . . . 0 N--CA 1.457 -0.644 0 C-N-CA 122.048 1.832 . . . . 15.0 113.244 -174.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.515 ' HA2' ' O ' ' A' ' 5' ' ' PRO . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 112.446 -0.262 . . . . 15.0 112.446 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.684 ' C ' ' H ' ' A' ' 4' ' ' GLY . . . 60.79 -164.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.801 0.334 . . . . 15.0 111.026 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.781 ' HE2' ' N ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -63.0 15.81 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.305 -0.407 . . . . 15.0 110.776 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.771 ' N ' ' HE2' ' A' ' 3' ' ' MET . . . -127.94 -167.2 12.21 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.77 -0.728 . . . . 15.0 112.543 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.516 ' C ' ' CD1' ' A' ' 6' ' ' LEU . 63.2 Cg_exo -32.5 162.14 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.284 2.656 . . . . 15.0 112.993 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 1.074 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER 38.7 68.81 1.76 Allowed Pre-proline 0 CA--C 1.51 -0.589 0 CA-C-N 115.395 -0.82 . . . . 15.0 110.915 -179.527 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.923 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 14.8 Cg_exo -72.92 -60.42 0.05 OUTLIER 'Trans proline' 0 C--N 1.319 -0.977 0 C-N-CA 123.564 2.843 . . . . 15.0 113.066 -179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.929 ' HB2' ' HE1' ' A' ' 10' ' ' TRP . 1.4 Cg_endo -81.48 53.44 4.69 Favored 'Trans proline' 0 C--N 1.321 -0.877 0 C-N-CA 124.391 3.394 . . . . 15.0 112.767 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 51.32 65.39 3.16 Favored Glycine 0 C--O 1.23 -0.107 0 N-CA-C 109.164 -1.574 . . . . 15.0 109.164 -177.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.956 ' HB3' ' CD ' ' A' ' 12' ' ' LYS . 12.7 m95 -116.49 151.91 35.14 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.011 1.115 . . . . 15.0 114.011 -175.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.969 ' O ' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -98.46 94.12 6.54 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.203 -1.036 . . . . 15.0 108.203 176.415 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 1.074 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -118.07 150.91 38.53 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.364 -0.835 . . . . 15.0 110.26 -178.713 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.671 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 1.5 ptm85 -149.41 147.82 28.73 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.496 -0.775 . . . . 15.0 111.019 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.5 m -118.21 94.4 4.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.033 -0.53 . . . . 15.0 112.047 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.869 ' O ' ' N ' ' A' ' 18' ' ' GLY . 8.7 t70 -89.51 147.66 23.85 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.638 -0.875 . . . . 15.0 108.638 178.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 1.087 ' C ' ' N ' ' A' ' 18' ' ' GLY . 68.9 p -47.93 -19.19 0.22 Allowed 'General case' 0 CA--C 1.493 -1.244 0 CA-C-O 118.667 -0.682 . . . . 15.0 112.083 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.723 ' C ' ' O ' ' A' ' 16' ' ' SER . 47.2 t30 -41.12 -16.98 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.235 1 N-CA-C 96.475 -5.38 . . . . 15.0 96.475 169.439 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 1.087 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 52.01 58.5 10.45 Favored Glycine 0 N--CA 1.431 -1.65 1 CA-C-N 107.554 -4.384 . . . . 15.0 112.331 176.428 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.445 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 8.7 tpp180 -138.25 151.57 47.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 112.357 -1.922 . . . . 15.0 109.958 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.788 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 38.1 t -97.06 115.13 35.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.155 -0.475 . . . . 15.0 110.62 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.836 ' HE1' ' HB ' ' A' ' 23' ' ' VAL . 0.1 OUTLIER -115.82 152.06 34.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.32 -0.4 . . . . 15.0 111.937 -178.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.921 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 5.2 m-85 -126.51 121.26 31.81 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.769 -0.651 . . . . 15.0 112.411 -177.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.969 HG11 ' O ' ' A' ' 11' ' ' GLU . 11.0 p -112.74 97.76 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 109.281 -0.636 . . . . 15.0 109.281 177.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.502 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 2.9 t-20 -103.27 122.24 44.37 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 107.708 -1.219 . . . . 15.0 107.708 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.49 ' H ' ' CD2' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -117.0 83.75 2.03 Favored 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 118.32 -1.352 . . . . 15.0 113.66 -177.4 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.46 ' CG ' ' H ' ' A' ' 27' ' ' THR . 1.2 p30 -94.19 -81.82 0.37 Allowed 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 104.507 -2.405 . . . . 15.0 104.507 172.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.899 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -93.57 -78.02 0.44 Allowed 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 106.826 -1.546 . . . . 15.0 106.826 173.099 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.899 ' H ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -152.42 89.6 1.43 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 114.803 -1.09 . . . . 15.0 110.084 177.073 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.736 HD13 ' NH2' ' A' ' 28' ' ' ARG . 47.0 mm -125.46 127.54 71.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.834 0.679 . . . . 15.0 112.834 -178.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.728 ' C ' HE21 ' A' ' 31' ' ' GLN . 0.0 OUTLIER -150.32 148.6 29.02 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.891 -0.595 . . . . 15.0 109.86 179.4 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.788 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 1.7 m95 -96.56 78.58 2.98 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 118.345 -1.342 . . . . 15.0 110.179 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.855 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 3.5 tt0 -159.57 151.65 20.75 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 113.572 0.953 . . . . 15.0 113.572 176.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.921 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 7.0 t0 -66.55 131.52 94.14 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 105.228 -2.138 . . . . 15.0 105.228 173.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.913 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 Cg_endo -90.43 7.12 3.83 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.307 2.005 . . . . 15.0 112.825 -175.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.961 ' HG2' ' H ' ' A' ' 37' ' ' SER . 0.0 OUTLIER 17.14 -99.51 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.881 -0.6 . . . . 15.0 111.427 -179.527 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.961 ' H ' ' HG2' ' A' ' 36' ' ' ARG . 50.3 m . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.27 -0.871 . . . . 15.0 110.797 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.551 ' O ' ' HB3' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.491 2.307 0 N-CA-C 112.573 -0.211 . . . . 15.0 112.573 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 1' ' ' GLY . . . 76.73 100.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.952 0.406 . . . . 15.0 111.291 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.79 ' H ' ' HE3' ' A' ' 3' ' ' MET . 0.0 OUTLIER -154.37 108.8 3.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.946 -0.57 . . . . 15.0 110.411 179.761 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.445 ' O ' ' C ' ' A' ' 5' ' ' PRO . . . 132.35 -155.28 21.44 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.634 -0.793 . . . . 15.0 111.906 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.775 ' O ' HD13 ' A' ' 6' ' ' LEU . 56.8 Cg_exo -28.01 131.4 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.399 2.733 . . . . 15.0 112.082 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.993 ' HB3' ' HD3' ' A' ' 12' ' ' LYS . 1.6 pp 56.06 111.27 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 115.174 1.546 . . . . 15.0 115.174 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.972 ' CD ' ' HD3' ' A' ' 8' ' ' PRO . 33.6 Cg_exo -71.96 -51.31 0.23 Allowed 'Trans proline' 0 C--N 1.326 -0.628 0 C-N-CA 123.391 2.727 . . . . 15.0 112.356 174.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.972 ' HD3' ' CD ' ' A' ' 7' ' ' PRO . 1.9 Cg_endo -82.09 -174.83 2.26 Favored 'Trans proline' 0 C--N 1.326 -0.618 0 C-N-CA 125.109 3.873 . . . . 15.0 113.071 -179.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.96 90.39 0.25 Allowed Glycine 0 C--N 1.337 0.63 0 N-CA-C 109.688 -1.365 . . . . 15.0 109.688 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.991 ' CE2' ' HG2' ' A' ' 35' ' ' PRO . 32.4 m95 -133.74 152.93 52.01 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 113.571 0.952 . . . . 15.0 113.571 -176.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.729 ' N ' ' HZ1' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -99.94 89.6 4.12 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.85 -1.167 . . . . 15.0 107.85 175.032 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.993 ' HD3' ' HB3' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -110.36 150.52 28.67 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.003 -0.544 . . . . 15.0 110.177 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.663 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 28.9 ttm180 -146.84 150.55 35.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.803 -0.635 . . . . 15.0 112.165 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.7 p -124.54 89.61 3.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.333 -0.849 . . . . 15.0 110.802 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.848 ' O ' ' N ' ' A' ' 18' ' ' GLY . 11.4 t70 -103.4 150.74 23.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.877 -0.601 . . . . 15.0 109.882 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 1.044 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.2 t -48.69 -19.3 0.34 Allowed 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 118.853 -0.594 . . . . 15.0 111.395 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.753 ' C ' ' O ' ' A' ' 16' ' ' SER . 42.3 m-80 -40.31 -17.07 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.249 1 N-CA-C 96.437 -5.394 . . . . 15.0 96.437 169.625 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 1.044 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.68 57.32 10.91 Favored Glycine 0 N--CA 1.429 -1.783 1 CA-C-N 107.575 -4.375 . . . . 15.0 112.117 176.321 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.45 ' HB3' ' CZ3' ' A' ' 32' ' ' TRP . 0.0 OUTLIER -140.03 148.03 41.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 112.478 -1.861 . . . . 15.0 110.28 179.553 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.782 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 25.4 m -96.1 96.51 5.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.551 -0.537 . . . . 15.0 109.551 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.767 ' HB3' ' CE3' ' A' ' 32' ' ' TRP . 0.9 OUTLIER -107.81 151.08 26.21 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.719 0.637 . . . . 15.0 112.719 -177.518 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.881 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 6.6 m-85 -122.2 129.37 52.21 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.452 -0.795 . . . . 15.0 111.466 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.758 ' H ' ' HE3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -125.43 94.58 2.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.476 0.655 . . . . 15.0 110.756 178.11 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.632 ' ND2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 m-20 -109.51 135.29 50.75 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 115.037 -0.983 . . . . 15.0 108.394 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.8 m-70 -118.76 84.08 2.13 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 118.51 -1.276 . . . . 15.0 112.98 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -93.32 -81.16 0.37 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 104.056 -2.572 . . . . 15.0 104.056 172.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.926 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.8 OUTLIER -93.18 -79.96 0.39 Allowed 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.409 -1.7 . . . . 15.0 106.409 172.762 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.926 ' H ' HG23 ' A' ' 27' ' ' THR . 16.3 ptm180 -152.86 89.82 1.42 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.757 -1.111 . . . . 15.0 109.527 176.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.547 HD11 ' O ' ' A' ' 28' ' ' ARG . 51.2 mm -129.54 126.18 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 N-CA-C 113.362 0.875 . . . . 15.0 113.362 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TPO . . . . . 0.728 HG23 HG11 ' A' ' 23' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.783 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -131.29 148.9 52.73 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.593 -0.521 . . . . 15.0 109.593 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.782 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -91.96 78.91 5.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 118.246 -1.382 . . . . 15.0 109.586 179.279 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.796 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 7.3 tt0 -159.36 151.95 21.5 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 113.457 0.91 . . . . 15.0 113.457 177.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.796 ' N ' ' HG2' ' A' ' 33' ' ' GLU . 5.4 p-10 -69.93 138.08 87.61 Favored Pre-proline 0 C--N 1.331 -0.217 0 N-CA-C 104.996 -2.224 . . . . 15.0 104.996 172.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.991 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.7 Cg_endo -91.94 41.5 0.33 Allowed 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.603 2.202 . . . . 15.0 112.701 -175.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.752 ' HD2' ' N ' ' A' ' 37' ' ' SER . 1.3 ppt_? -35.7 -22.2 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.1 -0.5 . . . . 15.0 111.112 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.752 ' N ' ' HD2' ' A' ' 36' ' ' ARG . 81.0 p . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.285 -0.864 . . . . 15.0 110.873 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.48 ' HA3' ' SD ' ' A' ' 3' ' ' MET . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 112.487 -0.245 . . . . 15.0 112.487 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.29 5.52 2.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.826 0.345 . . . . 15.0 111.143 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.774 ' N ' ' HE3' ' A' ' 3' ' ' MET . 0.0 OUTLIER -97.55 31.75 2.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.211 -0.449 . . . . 15.0 110.962 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.689 ' N ' ' HE3' ' A' ' 3' ' ' MET . . . 172.21 -158.67 29.32 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.784 -0.722 . . . . 15.0 112.4 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.568 ' C ' ' CD1' ' A' ' 6' ' ' LEU . 88.0 Cg_exo -30.15 161.32 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.473 2.782 . . . . 15.0 112.707 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 1.081 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER 44.62 74.26 0.83 Allowed Pre-proline 0 CA--C 1.511 -0.551 0 CA-C-N 115.247 -0.888 . . . . 15.0 111.449 -179.503 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 1.048 ' HB2' ' HD3' ' A' ' 8' ' ' PRO . 36.1 Cg_exo -65.67 -57.78 0.23 Allowed 'Trans proline' 0 C--N 1.322 -0.837 0 C-N-CA 122.839 2.359 . . . . 15.0 110.032 178.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 1.048 ' HD3' ' HB2' ' A' ' 7' ' ' PRO . 1.3 Cg_endo -85.95 -176.17 2.08 Favored 'Trans proline' 0 C--N 1.32 -0.947 0 C-N-CA 124.998 3.798 . . . . 15.0 109.423 176.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.42 ' O ' ' ND2' ' A' ' 24' ' ' ASN . . . -59.75 83.27 0.01 OUTLIER Glycine 0 CA--C 1.517 0.165 0 N-CA-C 109.373 -1.491 . . . . 15.0 109.373 176.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.937 ' CE2' ' HG2' ' A' ' 35' ' ' PRO . 26.3 m95 -128.35 150.47 50.07 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 114.054 1.131 . . . . 15.0 114.054 -176.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.836 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -110.77 88.7 2.84 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 107.966 -1.124 . . . . 15.0 107.966 176.454 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 1.081 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -105.21 150.46 25.08 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.686 -0.688 . . . . 15.0 109.875 -178.986 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -150.47 150.42 31.29 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.716 -0.674 . . . . 15.0 111.967 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.631 ' O ' HG22 ' A' ' 14' ' ' THR . 10.2 t -118.28 89.48 3.13 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.686 -0.688 . . . . 15.0 111.068 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.912 ' O ' ' N ' ' A' ' 18' ' ' GLY . 14.4 t70 -94.22 150.58 20.17 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 109.086 -0.709 . . . . 15.0 109.086 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 1.093 ' C ' ' N ' ' A' ' 18' ' ' GLY . 67.2 p -44.39 -18.99 0.02 OUTLIER 'General case' 0 CA--C 1.492 -1.27 0 CA-C-O 118.612 -0.708 . . . . 15.0 111.676 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.722 ' C ' ' O ' ' A' ' 16' ' ' SER . 13.9 m120 -41.33 -16.92 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.252 1 N-CA-C 96.552 -5.351 . . . . 15.0 96.552 169.524 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 1.093 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 51.39 58.72 9.38 Favored Glycine 0 N--CA 1.429 -1.806 1 CA-C-N 107.492 -4.413 . . . . 15.0 112.366 176.498 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.4 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 1.3 tpp180 -150.18 151.81 33.67 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 112.429 -1.886 . . . . 15.0 110.252 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.755 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 34.0 m -97.97 100.66 11.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.704 -0.68 . . . . 15.0 110.295 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.859 ' HE1' ' HB ' ' A' ' 23' ' ' VAL . 0.1 OUTLIER -107.03 151.7 24.99 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.321 0.489 . . . . 15.0 112.321 -178.35 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.834 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 4.9 m-85 -114.42 120.65 41.03 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 112.658 0.614 . . . . 15.0 112.658 -178.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.859 ' HB ' ' HE1' ' A' ' 21' ' ' TYR . 7.1 p -114.56 96.65 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 115.68 -0.691 . . . . 15.0 109.413 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.6 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 26.6 t-20 -122.2 136.59 54.93 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.338 -0.846 . . . . 15.0 108.805 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.576 ' HE2' ' CG2' ' A' ' 23' ' ' VAL . 53.3 m-70 -126.41 84.46 2.27 Favored 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 118.49 -1.284 . . . . 15.0 113.242 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -93.33 -80.43 0.38 Allowed 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 103.836 -2.653 . . . . 15.0 103.836 172.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 52.3 p -92.98 -80.6 0.37 Allowed 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 106.235 -1.765 . . . . 15.0 106.235 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -153.59 90.1 1.38 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 114.885 -1.052 . . . . 15.0 110.343 176.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.576 HG22 ' O ' ' A' ' 24' ' ' ASN . 7.0 tp -127.65 125.85 66.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 118.911 0.778 . . . . 15.0 112.775 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.801 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 15.8 pt20 -150.52 150.38 31.19 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.946 -0.57 . . . . 15.0 109.702 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.755 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -91.71 77.47 5.59 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 117.619 -1.632 . . . . 15.0 108.791 178.481 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.741 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 7.5 tt0 -160.19 152.27 20.41 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 113.047 0.758 . . . . 15.0 113.047 177.111 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.802 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 5.0 p-10 -63.79 134.37 95.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 105.36 -2.089 . . . . 15.0 105.36 173.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.937 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 2.2 Cg_endo -89.38 33.18 0.36 Allowed 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.719 2.279 . . . . 15.0 113.346 -175.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.438 ' C ' ' O ' ' A' ' 35' ' ' PRO . 29.1 tpt180 -35.83 -70.94 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.777 0.322 . . . . 15.0 110.926 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 80.1 p . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.22 -0.895 . . . . 15.0 110.857 179.937 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.443 ' O ' ' HB3' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 112.481 -0.247 . . . . 15.0 112.481 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.593 ' O ' ' SD ' ' A' ' 3' ' ' MET . . . 70.68 -66.45 0.29 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.636 0.255 . . . . 15.0 111.299 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.612 ' O ' ' SD ' ' A' ' 3' ' ' MET . 0.0 OUTLIER 50.7 140.51 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.286 0.565 . . . . 15.0 111.567 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.694 ' O ' HD11 ' A' ' 6' ' ' LEU . . . -61.76 -179.94 3.68 Favored Glycine 0 C--N 1.33 0.249 0 CA-C-N 115.72 -0.673 . . . . 15.0 113.078 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.933 ' O ' ' HG2' ' A' ' 12' ' ' LYS . 85.1 Cg_exo -46.23 65.69 0.01 OUTLIER 'Trans proline' 0 CA--C 1.511 -0.637 0 C-N-CA 123.713 2.942 . . . . 15.0 113.618 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.94 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -150.53 76.41 8.32 Favored Pre-proline 0 C--N 1.308 -1.213 0 CA-C-N 115.625 -0.716 . . . . 15.0 109.978 179.117 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.964 ' HB2' ' HD3' ' A' ' 8' ' ' PRO . 38.4 Cg_exo -63.59 -57.73 0.35 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.97 2.447 . . . . 15.0 110.923 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.964 ' HD3' ' HB2' ' A' ' 7' ' ' PRO . 1.9 Cg_endo -87.93 -177.25 1.88 Allowed 'Trans proline' 0 C--N 1.315 -1.225 0 C-N-CA 124.91 3.74 . . . . 15.0 109.481 176.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.415 ' C ' ' CD1' ' A' ' 10' ' ' TRP . . . -60.78 88.82 0.04 OUTLIER Glycine 0 CA--C 1.517 0.192 0 N-CA-C 108.968 -1.653 . . . . 15.0 108.968 176.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.938 ' O ' HD23 ' A' ' 6' ' ' LEU . 27.4 m95 -130.73 150.76 51.76 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 114.349 1.24 . . . . 15.0 114.349 -175.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.847 ' N ' ' HZ1' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -111.17 89.35 3.02 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 107.678 -1.23 . . . . 15.0 107.678 176.097 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.94 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -108.38 150.24 27.63 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.856 -0.611 . . . . 15.0 111.121 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.572 ' HD3' ' HE2' ' A' ' 21' ' ' TYR . 12.3 ptm180 -147.49 147.88 30.64 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.319 -0.855 . . . . 15.0 110.9 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.69 HG23 HG11 ' A' ' 20' ' ' VAL . 67.9 p -123.63 89.44 3.09 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.727 -0.67 . . . . 15.0 110.616 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.825 ' O ' ' N ' ' A' ' 18' ' ' GLY . 12.8 t70 -91.53 150.61 21.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.534 -0.757 . . . . 15.0 109.852 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 1.115 ' C ' ' N ' ' A' ' 18' ' ' GLY . 7.8 t -50.37 -19.2 0.77 Allowed 'General case' 0 CA--C 1.489 -1.393 0 CA-C-O 118.838 -0.601 . . . . 15.0 111.265 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.73 ' C ' ' O ' ' A' ' 16' ' ' SER . 46.7 m-80 -40.39 -17.28 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.232 1 N-CA-C 96.507 -5.368 . . . . 15.0 96.507 169.529 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 1.115 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 53.12 57.98 13.21 Favored Glycine 0 N--CA 1.43 -1.734 1 CA-C-N 107.335 -4.484 . . . . 15.0 112.612 176.222 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.38 148.91 43.49 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 112.474 -1.863 . . . . 15.0 109.841 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.728 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 34.3 m -100.83 106.33 19.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.497 -0.319 . . . . 15.0 110.171 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.69 ' HB3' ' CE3' ' A' ' 32' ' ' TRP . 0.4 OUTLIER -119.16 150.77 39.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.12 0.486 . . . . 15.0 112.084 -178.558 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.934 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 3.8 m-85 -119.16 133.73 55.61 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.55 -0.75 . . . . 15.0 111.781 -177.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.758 ' H ' ' HE3' ' A' ' 12' ' ' LYS . 1.3 m -122.58 102.13 11.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.243 0.544 . . . . 15.0 110.255 177.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.628 ' OD1' ' HB ' ' A' ' 29' ' ' ILE . 5.4 p30 -111.36 121.55 45.53 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.208 -0.906 . . . . 15.0 108.848 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -117.05 84.51 2.16 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 119.132 -1.027 . . . . 15.0 112.855 -178.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.676 ' CG ' ' H ' ' A' ' 27' ' ' THR . 1.8 p30 -92.55 -80.31 0.37 Allowed 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 103.622 -2.732 . . . . 15.0 103.622 172.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.732 HG23 ' HD2' ' A' ' 28' ' ' ARG . 96.9 m -92.84 -81.0 0.36 Allowed 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 106.336 -1.728 . . . . 15.0 106.336 172.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.732 ' HD2' HG23 ' A' ' 27' ' ' THR . 1.1 ptm180 -154.0 90.02 1.34 Allowed 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 114.927 -1.033 . . . . 15.0 110.441 176.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.628 ' HB ' ' OD1' ' A' ' 24' ' ' ASN . 47.3 mm -146.22 135.46 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 N-CA-C 113.635 0.976 . . . . 15.0 113.635 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TPO . . . . . 0.501 HG23 ' HA ' ' A' ' 23' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.8 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -150.17 150.44 31.63 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.946 -0.57 . . . . 15.0 109.67 179.74 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.728 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -93.83 77.54 4.21 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 117.822 -1.551 . . . . 15.0 109.661 178.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.804 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 5.3 tt0 -160.68 151.81 18.98 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.436 0.902 . . . . 15.0 113.436 176.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.934 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 1.6 p-10 -66.71 133.2 94.1 Favored Pre-proline 0 C--N 1.33 -0.251 0 N-CA-C 105.068 -2.197 . . . . 15.0 105.068 172.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.912 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 2.4 Cg_endo -94.58 10.49 1.81 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.793 2.329 . . . . 15.0 113.325 -175.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 1.013 ' NE ' ' H ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -28.07 -53.57 0.09 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.755 0.312 . . . . 15.0 111.22 -179.145 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 1.013 ' H ' ' NE ' ' A' ' 36' ' ' ARG . 78.6 p . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.242 -0.885 . . . . 15.0 110.799 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 3' ' ' MET . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 112.487 -0.245 . . . . 15.0 112.487 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.3 -76.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.927 0.394 . . . . 15.0 111.083 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.572 ' O ' ' HG3' ' A' ' 3' ' ' MET . 23.6 ptm -161.12 93.56 0.97 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.109 -0.496 . . . . 15.0 110.735 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.503 ' O ' ' O ' ' A' ' 5' ' ' PRO . . . 154.37 -163.66 31.19 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.808 -0.71 . . . . 15.0 112.409 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.756 ' CB ' HD11 ' A' ' 6' ' ' LEU . 57.6 Cg_exo -29.55 156.0 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 123.345 2.696 . . . . 15.0 112.793 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 1.03 ' HG ' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER 36.86 74.18 0.63 Allowed Pre-proline 0 CA--C 1.512 -0.506 0 CA-C-N 115.211 -0.904 . . . . 15.0 111.179 -179.371 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.951 ' HB2' ' HD3' ' A' ' 8' ' ' PRO . 21.9 Cg_exo -69.56 -59.42 0.09 OUTLIER 'Trans proline' 0 C--N 1.322 -0.842 0 C-N-CA 123.708 2.939 . . . . 15.0 111.872 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.955 ' HG2' ' NE1' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -81.92 176.49 8.26 Favored 'Trans proline' 0 C--N 1.32 -0.964 0 C-N-CA 124.317 3.345 . . . . 15.0 110.334 178.124 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.62 80.12 0.01 OUTLIER Glycine 0 C--N 1.33 0.235 0 C-N-CA 119.396 -1.383 . . . . 15.0 109.834 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 1.01 ' HB3' ' NZ ' ' A' ' 12' ' ' LYS . 23.3 m95 -118.77 149.02 42.18 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.796 1.036 . . . . 15.0 113.796 -176.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.872 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 43.0 tt0 -104.29 88.1 2.9 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.333 -0.988 . . . . 15.0 108.333 177.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 1.03 ' HB2' ' HG ' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -106.48 151.27 25.18 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.35 -0.841 . . . . 15.0 110.117 -179.469 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.813 ' HD3' ' H ' ' A' ' 14' ' ' THR . 12.1 tpp180 -143.12 143.55 31.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.563 -0.744 . . . . 15.0 111.753 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.813 ' H ' ' HD3' ' A' ' 13' ' ' ARG . 72.3 p -118.12 89.39 3.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.401 -0.818 . . . . 15.0 110.686 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.892 ' O ' ' N ' ' A' ' 18' ' ' GLY . 18.6 t70 -106.77 150.66 26.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.686 -0.688 . . . . 15.0 109.432 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 1.141 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.2 t -44.1 -19.06 0.02 OUTLIER 'General case' 0 CA--C 1.489 -1.367 0 CA-C-O 118.976 -0.535 . . . . 15.0 111.355 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.721 ' C ' ' O ' ' A' ' 16' ' ' SER . 2.6 t-20 -40.86 -16.89 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.254 1 N-CA-C 96.388 -5.412 . . . . 15.0 96.388 169.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 1.141 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.0 58.5 8.55 Favored Glycine 0 N--CA 1.429 -1.778 1 CA-C-N 107.522 -4.399 . . . . 15.0 112.38 176.321 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.403 ' HB3' ' CZ3' ' A' ' 32' ' ' TRP . 5.1 tpp85 -146.62 151.32 37.09 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 112.395 -1.903 . . . . 15.0 110.408 179.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.689 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 13.3 m -99.08 90.39 2.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.682 -0.69 . . . . 15.0 109.78 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.792 ' CE2' ' HB3' ' A' ' 13' ' ' ARG . 1.3 p90 -95.91 151.11 19.72 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.745 0.646 . . . . 15.0 112.745 -177.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.825 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 10.7 m-85 -120.63 125.55 48.01 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.687 -0.688 . . . . 15.0 111.839 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.817 ' H ' ' HE3' ' A' ' 12' ' ' LYS . 3.5 t -118.55 89.84 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 115.651 -0.704 . . . . 15.0 110.288 178.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.828 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 3.4 t-20 -111.45 125.57 54.03 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 108.191 -1.04 . . . . 15.0 108.191 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.75 ' NE2' HG12 ' A' ' 23' ' ' VAL . 55.2 m-70 -116.62 83.46 1.97 Allowed 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 118.36 -1.336 . . . . 15.0 113.289 -178.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.568 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.8 OUTLIER -94.3 -81.09 0.39 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 104.331 -2.47 . . . . 15.0 104.331 172.315 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.921 HG21 ' H ' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -93.05 -79.74 0.39 Allowed 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.065 -1.457 . . . . 15.0 107.065 173.375 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.921 ' H ' HG21 ' A' ' 27' ' ' THR . 0.4 OUTLIER -152.47 89.82 1.45 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.836 -1.075 . . . . 15.0 110.039 177.423 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.461 HG22 ' HH2' ' A' ' 10' ' ' TRP . 51.2 mt -126.18 120.0 55.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 N-CA-C 113.083 0.772 . . . . 15.0 113.083 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.716 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 3.6 pt20 -147.27 150.31 34.57 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 108.816 -0.809 . . . . 15.0 108.816 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.777 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -89.72 77.33 7.12 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 117.516 -1.673 . . . . 15.0 108.919 179.259 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.721 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 5.0 tt0 -160.54 152.16 19.66 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 113.218 0.822 . . . . 15.0 113.218 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.744 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -65.05 137.99 97.28 Favored Pre-proline 0 C--N 1.329 -0.319 0 N-CA-C 105.295 -2.113 . . . . 15.0 105.295 173.06 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.991 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 3.2 Cg_endo -94.56 77.76 0.18 Allowed 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.189 2.593 . . . . 15.0 113.385 -175.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.623 ' HD3' ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -60.45 8.02 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.282 -0.417 . . . . 15.0 110.711 179.564 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.638 ' H ' ' C ' ' A' ' 35' ' ' PRO . 60.7 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.224 -0.893 . . . . 15.0 110.999 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.402 ' O ' ' HB3' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.488 2.117 0 N-CA-C 112.422 -0.271 . . . . 15.0 112.422 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.517 ' O ' ' O ' ' A' ' 3' ' ' MET . . . 67.71 110.53 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.688 0.28 . . . . 15.0 111.018 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.517 ' O ' ' O ' ' A' ' 2' ' ' ALA . 25.7 ptt? 46.16 178.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 15.0 110.656 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 101.8 -170.11 20.69 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.448 -0.882 . . . . 15.0 112.67 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.919 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 61.6 Cg_endo -70.85 162.66 41.84 Favored 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 122.945 2.43 . . . . 15.0 113.181 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 1.065 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER 41.04 69.65 1.9 Allowed Pre-proline 0 CA--C 1.51 -0.585 0 CA-C-N 115.254 -0.885 . . . . 15.0 111.5 -179.16 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.944 ' HB2' ' HD3' ' A' ' 8' ' ' PRO . 14.2 Cg_exo -73.16 -60.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.32 -0.931 0 C-N-CA 123.299 2.666 . . . . 15.0 112.881 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.944 ' HD3' ' HB2' ' A' ' 7' ' ' PRO . 1.3 Cg_endo -80.7 53.59 4.84 Favored 'Trans proline' 0 C--N 1.322 -0.838 0 C-N-CA 124.667 3.578 . . . . 15.0 112.745 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 49.59 63.73 3.91 Favored Glycine 0 C--O 1.23 -0.095 0 N-CA-C 109.217 -1.553 . . . . 15.0 109.217 -177.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.962 ' HB3' ' CD ' ' A' ' 12' ' ' LYS . 10.5 m95 -112.58 151.43 30.06 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.688 0.996 . . . . 15.0 113.688 -175.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.884 ' HB3' HG13 ' A' ' 23' ' ' VAL . 32.1 tt0 -96.63 88.92 4.79 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.474 -0.936 . . . . 15.0 108.474 176.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 1.065 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -114.23 151.35 32.93 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.598 -0.728 . . . . 15.0 110.677 -178.941 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.722 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 10.2 ptm180 -147.63 149.18 32.02 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.46 -0.791 . . . . 15.0 110.996 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.718 HG23 HG11 ' A' ' 20' ' ' VAL . 74.7 p -119.0 89.57 3.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.848 -0.615 . . . . 15.0 111.088 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.854 ' O ' ' N ' ' A' ' 18' ' ' GLY . 16.9 t70 -92.3 150.57 20.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.609 -0.723 . . . . 15.0 109.432 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 1.12 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.1 t -50.48 -19.25 0.82 Allowed 'General case' 0 CA--C 1.489 -1.376 0 CA-C-O 119.018 -0.515 . . . . 15.0 111.48 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.713 ' C ' ' O ' ' A' ' 16' ' ' SER . 2.7 t-20 -40.91 -17.06 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.205 1 N-CA-C 96.331 -5.433 . . . . 15.0 96.331 169.575 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 1.12 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 52.67 59.29 9.39 Favored Glycine 0 N--CA 1.431 -1.661 1 CA-C-N 107.458 -4.428 . . . . 15.0 112.553 176.181 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.421 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 8.3 tpt180 -141.86 151.21 42.5 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 112.418 -1.891 . . . . 15.0 109.859 179.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.718 HG11 HG23 ' A' ' 14' ' ' THR . 35.6 m -101.25 94.74 3.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.028 -0.533 . . . . 15.0 110.266 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.747 ' HA ' ' HA ' ' A' ' 32' ' ' TRP . 0.1 OUTLIER -100.69 151.08 22.07 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.203 0.445 . . . . 15.0 112.203 -178.319 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.925 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 4.6 m-85 -118.5 121.63 40.74 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 113.03 0.752 . . . . 15.0 113.03 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.884 HG13 ' HB3' ' A' ' 11' ' ' GLU . 1.0 OUTLIER -107.86 89.74 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 115.483 -0.781 . . . . 15.0 108.981 177.583 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.832 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 3.2 t-20 -110.79 122.53 48.05 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.495 -0.928 . . . . 15.0 108.495 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.547 ' CD2' HG12 ' A' ' 23' ' ' VAL . 29.4 m-70 -120.88 83.4 2.06 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 118.047 -1.461 . . . . 15.0 113.58 -178.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.716 ' CG ' ' H ' ' A' ' 27' ' ' THR . 2.4 p30 -94.7 -80.96 0.4 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.585 -2.376 . . . . 15.0 104.585 172.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.716 ' H ' ' CG ' ' A' ' 26' ' ' ASN . 93.6 m -93.38 -77.7 0.44 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.078 -1.419 . . . . 15.0 107.246 173.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 28' ' ' ARG . 8.8 tpt180 -152.1 90.06 1.49 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.643 -1.162 . . . . 15.0 110.105 177.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.656 HG13 HD22 ' A' ' 26' ' ' ASN . 38.5 mm -125.98 121.36 59.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 112.93 0.715 . . . . 15.0 112.93 -179.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TPO . . . . . 0.418 HG21 ' O ' ' A' ' 30' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.771 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -150.28 150.09 31.03 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.79 -0.641 . . . . 15.0 109.351 179.781 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.747 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -92.7 78.26 4.85 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 117.752 -1.579 . . . . 15.0 109.238 179.069 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.797 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 3.7 tt0 -160.14 151.8 19.92 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 113.032 0.753 . . . . 15.0 113.032 177.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.925 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 3.8 p30 -65.88 133.42 94.92 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 105.545 -2.02 . . . . 15.0 105.545 173.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.96 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 Cg_endo -90.54 58.4 1.42 Allowed 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.79 2.327 . . . . 15.0 113.062 -175.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.902 ' HE ' ' N ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -52.14 -20.61 2.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.449 -0.341 . . . . 15.0 111.253 -179.728 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.805 ' H ' ' HE ' ' A' ' 36' ' ' ARG . 81.5 p . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.26 -0.876 . . . . 15.0 110.904 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.517 ' O ' ' HB3' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.546 -0.222 . . . . 15.0 112.546 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 1' ' ' GLY . . . 74.43 -88.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.769 0.319 . . . . 15.0 111.364 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.558 ' N ' ' SD ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -129.53 -170.17 2.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 15.0 110.907 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.442 ' O ' ' C ' ' A' ' 5' ' ' PRO . . . 89.78 -162.36 30.14 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.635 -0.793 . . . . 15.0 112.276 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.724 ' HB3' ' HE3' ' A' ' 12' ' ' LYS . 90.9 Cg_exo -29.59 138.68 0.03 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.099 2.533 . . . . 15.0 112.223 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.913 HD12 ' HE3' ' A' ' 12' ' ' LYS . 0.0 OUTLIER 54.3 70.14 1.83 Allowed Pre-proline 0 CA--C 1.501 -0.908 0 CA-C-N 114.529 -1.214 . . . . 15.0 110.604 -179.855 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.947 ' HB2' ' HD3' ' A' ' 8' ' ' PRO . 32.0 Cg_exo -61.28 -53.99 2.07 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 122.532 2.155 . . . . 15.0 108.872 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 1.021 ' HG2' ' NE1' ' A' ' 10' ' ' TRP . 2.8 Cg_endo -90.55 -170.57 0.39 Allowed 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 125.229 3.952 . . . . 15.0 109.611 174.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.414 ' C ' ' CD1' ' A' ' 10' ' ' TRP . . . -68.33 93.2 0.28 Allowed Glycine 0 CA--C 1.519 0.296 0 N-CA-C 109.443 -1.463 . . . . 15.0 109.443 177.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 1.021 ' NE1' ' HG2' ' A' ' 8' ' ' PRO . 36.5 m95 -129.74 148.24 51.6 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 115.079 1.511 . . . . 15.0 115.079 -175.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.661 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -101.56 89.74 3.82 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 106.025 -1.842 . . . . 15.0 106.025 175.53 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 1.089 ' HD2' ' CE2' ' A' ' 22' ' ' PHE . 10.1 mtpp -110.04 155.3 22.03 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 114.735 1.383 . . . . 15.0 114.735 -174.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.784 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 9.7 ttp180 -150.38 147.05 27.11 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 112.729 -2.032 . . . . 15.0 112.05 -178.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.558 ' O ' HG22 ' A' ' 14' ' ' THR . 4.9 t -132.61 95.16 3.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.343 -0.844 . . . . 15.0 110.792 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.856 ' O ' ' N ' ' A' ' 18' ' ' GLY . 19.4 t70 -111.28 150.95 28.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.886 -0.597 . . . . 15.0 110.483 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 1.093 ' C ' ' N ' ' A' ' 18' ' ' GLY . 70.4 p -45.28 -18.76 0.03 OUTLIER 'General case' 0 CA--C 1.49 -1.332 0 CA-C-O 118.744 -0.646 . . . . 15.0 111.413 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.747 ' C ' ' O ' ' A' ' 16' ' ' SER . 12.3 m120 -39.89 -17.13 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.234 1 N-CA-C 96.497 -5.371 . . . . 15.0 96.497 169.451 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 1.093 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.36 55.56 15.93 Favored Glycine 0 N--CA 1.43 -1.752 1 CA-C-N 107.665 -4.334 . . . . 15.0 111.992 176.541 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.437 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -137.65 150.67 47.56 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 112.301 -1.949 . . . . 15.0 109.648 179.34 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.676 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 4.2 t -99.1 95.95 4.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.557 -0.534 . . . . 15.0 109.557 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.799 ' HA ' ' HA ' ' A' ' 32' ' ' TRP . 0.1 OUTLIER -101.13 150.76 22.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.198 0.523 . . . . 15.0 112.329 -177.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 1.089 ' CE2' ' HD2' ' A' ' 12' ' ' LYS . 5.0 m-85 -124.92 134.32 52.71 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.479 -0.782 . . . . 15.0 112.287 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.661 ' HB ' ' O ' ' A' ' 11' ' ' GLU . 13.5 t -122.5 89.27 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 115.546 -0.752 . . . . 15.0 109.681 178.188 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.765 ' O ' ' O ' ' A' ' 29' ' ' ILE . 9.3 t-20 -133.8 134.79 43.29 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 108.631 -0.877 . . . . 15.0 108.631 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.759 ' HB2' ' HA ' ' A' ' 28' ' ' ARG . 10.6 p80 -151.87 88.82 1.42 Allowed 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 118.161 -1.416 . . . . 15.0 114.275 -178.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.442 ' C ' ' O ' ' A' ' 25' ' ' HIS . 2.5 t-20 -50.62 -60.41 3.06 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 102.767 -3.049 . . . . 15.0 102.767 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.788 HG21 ' NE ' ' A' ' 28' ' ' ARG . 15.5 m -92.84 -81.94 0.34 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.882 -1.508 . . . . 15.0 106.999 173.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.788 ' NE ' HG21 ' A' ' 27' ' ' THR . 0.0 OUTLIER -154.71 100.41 2.23 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.815 -0.63 . . . . 15.0 111.672 177.135 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.817 HD12 ' N ' ' A' ' 30' ' ' TPO . 0.0 OUTLIER -146.96 138.45 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-N 119.538 1.063 . . . . 15.0 112.627 178.818 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TPO . . . . . 0.817 ' N ' HD12 ' A' ' 29' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.863 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 2.6 pt20 -150.32 150.05 30.94 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.483 -0.78 . . . . 15.0 109.256 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.799 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -91.67 78.23 5.54 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 117.67 -1.612 . . . . 15.0 109.366 178.808 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.778 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 8.0 tt0 -159.66 151.77 20.75 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 113.162 0.801 . . . . 15.0 113.162 176.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.83 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 5.0 p-10 -65.39 132.95 95.28 Favored Pre-proline 0 C--N 1.331 -0.224 0 N-CA-C 104.517 -2.401 . . . . 15.0 104.517 172.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.97 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 3.2 Cg_exo -88.66 29.12 0.45 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.048 1.832 . . . . 15.0 113.244 -174.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.615 ' O ' ' HB2' ' A' ' 37' ' ' SER . 4.3 ptp180 45.63 17.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.059 -0.519 . . . . 15.0 110.864 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.666 ' HA ' ' HG3' ' A' ' 8' ' ' PRO . 50.0 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.177 -0.916 . . . . 15.0 110.815 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 1.1 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.51 -0.589 0 CA-C-O 121.736 0.779 . . . . 15.0 110.915 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.941 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 14.8 Cg_exo -72.92 -60.42 0.05 OUTLIER 'Trans proline' 0 C--N 1.319 -0.977 0 C-N-CA 123.564 2.843 . . . . 15.0 113.066 -179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.952 ' HB2' ' HE1' ' A' ' 10' ' ' TRP . 1.4 Cg_endo -81.48 53.44 4.69 Favored 'Trans proline' 0 C--N 1.321 -0.877 0 C-N-CA 124.391 3.394 . . . . 15.0 112.767 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 51.32 65.39 3.16 Favored Glycine 0 C--O 1.23 -0.107 0 N-CA-C 109.164 -1.574 . . . . 15.0 109.164 -177.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.962 ' HB3' ' CD ' ' A' ' 12' ' ' LYS . 12.7 m95 -116.49 151.91 35.14 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.011 1.115 . . . . 15.0 114.011 -175.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.995 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -98.46 94.12 6.54 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.203 -1.036 . . . . 15.0 108.203 176.415 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 1.1 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -118.07 150.91 38.53 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.364 -0.835 . . . . 15.0 110.26 -178.713 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.669 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 1.5 ptm85 -149.41 147.82 28.73 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.496 -0.775 . . . . 15.0 111.019 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.5 m -118.21 94.4 4.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.033 -0.53 . . . . 15.0 112.047 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.869 ' O ' ' N ' ' A' ' 18' ' ' GLY . 8.7 t70 -89.51 147.66 23.85 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.638 -0.875 . . . . 15.0 108.638 178.228 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . 1.087 ' C ' ' N ' ' A' ' 18' ' ' GLY . 68.9 p -47.93 -19.19 0.22 Allowed 'General case' 0 CA--C 1.493 -1.244 0 CA-C-O 118.667 -0.682 . . . . 15.0 112.083 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.723 ' C ' ' O ' ' A' ' 16' ' ' SER . 47.2 t30 -41.12 -16.98 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.235 1 N-CA-C 96.475 -5.38 . . . . 15.0 96.475 169.439 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 1.087 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 52.01 58.5 10.45 Favored Glycine 0 N--CA 1.431 -1.65 1 CA-C-N 107.554 -4.384 . . . . 15.0 112.331 176.428 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 8.7 tpp180 -138.25 151.57 47.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 112.357 -1.922 . . . . 15.0 109.958 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.804 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 38.1 t -97.06 115.13 35.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.155 -0.475 . . . . 15.0 110.62 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.857 ' HE1' ' HB ' ' A' ' 23' ' ' VAL . 0.1 OUTLIER -115.82 152.06 34.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.32 -0.4 . . . . 15.0 111.937 -178.895 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.906 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 5.2 m-85 -126.51 121.26 31.81 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.769 -0.651 . . . . 15.0 112.411 -177.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.995 HG12 ' O ' ' A' ' 11' ' ' GLU . 11.0 p -112.74 97.76 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 109.281 -0.636 . . . . 15.0 109.281 177.37 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.519 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 51.3 t30 -103.27 122.24 44.37 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 107.708 -1.219 . . . . 15.0 107.708 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -117.0 83.75 2.03 Favored 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 118.32 -1.352 . . . . 15.0 113.66 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.472 ' OD1' HG12 ' A' ' 29' ' ' ILE . 1.2 p30 -94.19 -81.82 0.37 Allowed 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 104.507 -2.405 . . . . 15.0 104.507 172.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.982 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -93.57 -78.02 0.44 Allowed 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 106.826 -1.546 . . . . 15.0 106.826 173.099 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.982 ' H ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -152.42 89.6 1.43 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 114.803 -1.09 . . . . 15.0 110.084 177.073 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.809 HD11 ' NH2' ' A' ' 28' ' ' ARG . 47.0 mm . . . . . 0 N--CA 1.467 0.414 0 N-CA-C 112.834 0.679 . . . . 15.0 112.834 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.717 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.2 OUTLIER . . . . . 0 N--CA 1.467 0.396 0 N-CA-C 109.86 -0.422 . . . . 15.0 109.86 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.804 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 1.7 m95 -96.56 78.58 2.98 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 118.345 -1.342 . . . . 15.0 110.179 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.844 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 3.5 tt0 -159.57 151.65 20.75 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 113.572 0.953 . . . . 15.0 113.572 176.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.906 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 7.0 t0 -66.55 131.52 94.14 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 105.228 -2.138 . . . . 15.0 105.228 173.032 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.928 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 Cg_endo . . . . . 0 N--CA 1.459 -0.555 0 C-N-CA 122.307 2.005 . . . . 15.0 112.825 -175.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 1.081 HD23 ' CD ' ' A' ' 12' ' ' LYS . 1.6 pp . . . . . 0 CA--C 1.517 -0.293 0 N-CA-C 115.174 1.546 . . . . 15.0 115.174 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 1.002 ' CD ' ' HD3' ' A' ' 8' ' ' PRO . 33.6 Cg_exo -71.96 -51.31 0.23 Allowed 'Trans proline' 0 C--N 1.326 -0.628 0 C-N-CA 123.391 2.727 . . . . 15.0 112.356 174.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 1.002 ' HD3' ' CD ' ' A' ' 7' ' ' PRO . 1.9 Cg_endo -82.09 -174.83 2.26 Favored 'Trans proline' 0 C--N 1.326 -0.618 0 C-N-CA 125.109 3.873 . . . . 15.0 113.071 -179.239 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.96 90.39 0.25 Allowed Glycine 0 C--N 1.337 0.63 0 N-CA-C 109.688 -1.365 . . . . 15.0 109.688 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 1.012 ' CE2' ' HG2' ' A' ' 35' ' ' PRO . 32.4 m95 -133.74 152.93 52.01 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 113.571 0.952 . . . . 15.0 113.571 -176.172 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.725 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -99.94 89.6 4.12 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.85 -1.167 . . . . 15.0 107.85 175.032 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 1.081 ' CD ' HD23 ' A' ' 6' ' ' LEU . 0.1 OUTLIER -110.36 150.52 28.67 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.003 -0.544 . . . . 15.0 110.177 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.673 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 28.9 ttm180 -146.84 150.55 35.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.803 -0.635 . . . . 15.0 112.165 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.7 p -124.54 89.61 3.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.333 -0.849 . . . . 15.0 110.802 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.848 ' O ' ' N ' ' A' ' 18' ' ' GLY . 11.4 t70 -103.4 150.74 23.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.877 -0.601 . . . . 15.0 109.882 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . 1.044 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.2 t -48.69 -19.3 0.34 Allowed 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 118.853 -0.594 . . . . 15.0 111.395 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.753 ' C ' ' O ' ' A' ' 16' ' ' SER . 17.2 m120 -40.31 -17.07 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.249 1 N-CA-C 96.437 -5.394 . . . . 15.0 96.437 169.625 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 1.044 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.68 57.32 10.91 Favored Glycine 0 N--CA 1.429 -1.783 1 CA-C-N 107.575 -4.375 . . . . 15.0 112.117 176.321 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.467 ' HB3' ' CZ3' ' A' ' 32' ' ' TRP . 0.0 OUTLIER -140.03 148.03 41.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 112.478 -1.861 . . . . 15.0 110.28 179.553 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.802 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 25.4 m -96.1 96.51 5.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.551 -0.537 . . . . 15.0 109.551 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.799 ' HB3' ' CE3' ' A' ' 32' ' ' TRP . 0.9 OUTLIER -107.81 151.08 26.21 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.719 0.637 . . . . 15.0 112.719 -177.518 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.911 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 6.6 m-85 -122.2 129.37 52.21 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.452 -0.795 . . . . 15.0 111.466 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.745 ' H ' ' HE3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -125.43 94.58 2.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.476 0.655 . . . . 15.0 110.756 178.11 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.632 ' ND2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 m-20 -109.51 135.29 50.75 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 115.037 -0.983 . . . . 15.0 108.394 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.8 m-70 -118.76 84.08 2.13 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 118.51 -1.276 . . . . 15.0 112.98 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -93.32 -81.16 0.37 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 104.056 -2.572 . . . . 15.0 104.056 172.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' THR . . . . . 1.067 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.8 OUTLIER -93.18 -79.96 0.39 Allowed 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.409 -1.7 . . . . 15.0 106.409 172.762 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 1.067 ' H ' HG23 ' A' ' 27' ' ' THR . 16.3 ptm180 -152.86 89.82 1.42 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.757 -1.111 . . . . 15.0 109.527 176.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.554 HD13 ' O ' ' A' ' 28' ' ' ARG . 51.2 mm . . . . . 0 N--CA 1.466 0.327 0 N-CA-C 113.362 0.875 . . . . 15.0 113.362 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.794 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.514 0 N-CA-C 109.593 -0.521 . . . . 15.0 109.593 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.802 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -91.96 78.91 5.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 118.246 -1.382 . . . . 15.0 109.586 179.279 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.787 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 7.3 tt0 -159.36 151.95 21.5 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 113.457 0.91 . . . . 15.0 113.457 177.037 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.787 ' N ' ' HG2' ' A' ' 33' ' ' GLU . 5.4 p-10 -69.93 138.08 87.61 Favored Pre-proline 0 C--N 1.331 -0.217 0 N-CA-C 104.996 -2.224 . . . . 15.0 104.996 172.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 1.012 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.7 Cg_endo . . . . . 0 N--CA 1.456 -0.732 0 C-N-CA 122.603 2.202 . . . . 15.0 112.701 -175.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 1.1 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.511 -0.551 0 CA-C-O 121.397 0.618 . . . . 15.0 111.449 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.996 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 36.1 Cg_exo -65.67 -57.78 0.23 Allowed 'Trans proline' 0 C--N 1.322 -0.837 0 C-N-CA 122.839 2.359 . . . . 15.0 110.032 178.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.996 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.3 Cg_endo -85.95 -176.17 2.08 Favored 'Trans proline' 0 C--N 1.32 -0.947 0 C-N-CA 124.998 3.798 . . . . 15.0 109.423 176.066 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.42 ' O ' ' ND2' ' A' ' 24' ' ' ASN . . . -59.75 83.27 0.01 OUTLIER Glycine 0 CA--C 1.517 0.165 0 N-CA-C 109.373 -1.491 . . . . 15.0 109.373 176.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.994 ' HB3' ' HZ2' ' A' ' 12' ' ' LYS . 26.3 m95 -128.35 150.47 50.07 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 114.054 1.131 . . . . 15.0 114.054 -176.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.843 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.4 OUTLIER -110.77 88.7 2.84 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 107.966 -1.124 . . . . 15.0 107.966 176.454 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 1.1 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -105.21 150.46 25.08 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.686 -0.688 . . . . 15.0 109.875 -178.986 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -150.47 150.42 31.29 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.716 -0.674 . . . . 15.0 111.967 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.663 HG23 ' O ' ' A' ' 14' ' ' THR . 10.2 t -118.28 89.48 3.13 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.686 -0.688 . . . . 15.0 111.068 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.912 ' O ' ' N ' ' A' ' 18' ' ' GLY . 14.4 t70 -94.22 150.58 20.17 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 109.086 -0.709 . . . . 15.0 109.086 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . 1.093 ' C ' ' N ' ' A' ' 18' ' ' GLY . 67.2 p -44.39 -18.99 0.02 OUTLIER 'General case' 0 CA--C 1.492 -1.27 0 CA-C-O 118.612 -0.708 . . . . 15.0 111.676 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.722 ' C ' ' O ' ' A' ' 16' ' ' SER . 85.4 m-20 -41.33 -16.92 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.252 1 N-CA-C 96.552 -5.351 . . . . 15.0 96.552 169.524 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 1.093 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 51.39 58.72 9.38 Favored Glycine 0 N--CA 1.429 -1.806 1 CA-C-N 107.492 -4.413 . . . . 15.0 112.366 176.498 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 19' ' ' ARG . 1.3 tpp180 -150.18 151.81 33.67 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 112.429 -1.886 . . . . 15.0 110.252 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.773 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 34.0 m -97.97 100.66 11.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.704 -0.68 . . . . 15.0 110.295 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.878 ' HE1' ' HB ' ' A' ' 23' ' ' VAL . 0.1 OUTLIER -107.03 151.7 24.99 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.321 0.489 . . . . 15.0 112.321 -178.35 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.858 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 4.9 m-85 -114.42 120.65 41.03 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 112.658 0.614 . . . . 15.0 112.658 -178.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.878 ' HB ' ' HE1' ' A' ' 21' ' ' TYR . 7.1 p -114.56 96.65 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 115.68 -0.691 . . . . 15.0 109.413 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.621 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 26.6 t-20 -122.2 136.59 54.93 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.338 -0.846 . . . . 15.0 108.805 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.438 ' NE2' ' CG2' ' A' ' 23' ' ' VAL . 53.3 m-70 -126.41 84.46 2.27 Favored 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 118.49 -1.284 . . . . 15.0 113.242 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -93.33 -80.43 0.38 Allowed 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 103.836 -2.653 . . . . 15.0 103.836 172.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 52.3 p -92.98 -80.6 0.37 Allowed 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 106.235 -1.765 . . . . 15.0 106.235 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -153.59 90.1 1.38 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 114.885 -1.052 . . . . 15.0 110.343 176.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.577 HG23 ' O ' ' A' ' 24' ' ' ASN . 7.0 tp . . . . . 0 N--CA 1.469 0.482 0 CA-C-N 118.911 0.778 . . . . 15.0 112.775 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.809 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 15.8 pt20 . . . . . 0 CA--C 1.513 -0.455 0 N-CA-C 109.702 -0.481 . . . . 15.0 109.702 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.773 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -91.71 77.47 5.59 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 117.619 -1.632 . . . . 15.0 108.791 178.481 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.74 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 7.5 tt0 -160.19 152.27 20.41 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 113.047 0.758 . . . . 15.0 113.047 177.111 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.782 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 5.0 p-10 -63.79 134.37 95.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 105.36 -2.089 . . . . 15.0 105.36 173.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.952 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 2.2 Cg_endo . . . . . 0 N--CA 1.461 -0.43 0 C-N-CA 122.719 2.279 . . . . 15.0 113.346 -175.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 1.043 HD23 ' O ' ' A' ' 10' ' ' TRP . 0.2 OUTLIER . . . . . 0 CA--C 1.51 -0.558 0 CA-C-O 121.534 0.683 . . . . 15.0 109.978 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.963 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 38.4 Cg_exo -63.59 -57.73 0.35 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.97 2.447 . . . . 15.0 110.923 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.963 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.9 Cg_endo -87.93 -177.25 1.88 Allowed 'Trans proline' 0 C--N 1.315 -1.225 0 C-N-CA 124.91 3.74 . . . . 15.0 109.481 176.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.415 ' C ' ' CD1' ' A' ' 10' ' ' TRP . . . -60.78 88.82 0.04 OUTLIER Glycine 0 CA--C 1.517 0.192 0 N-CA-C 108.968 -1.653 . . . . 15.0 108.968 176.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 1.043 ' O ' HD23 ' A' ' 6' ' ' LEU . 27.4 m95 -130.73 150.76 51.76 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 114.349 1.24 . . . . 15.0 114.349 -175.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.675 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -111.17 89.35 3.02 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 107.678 -1.23 . . . . 15.0 107.678 176.097 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.965 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -108.38 150.24 27.63 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.856 -0.611 . . . . 15.0 111.121 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.565 ' HD3' ' HE2' ' A' ' 21' ' ' TYR . 12.3 ptm180 -147.49 147.88 30.64 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.319 -0.855 . . . . 15.0 110.9 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.703 HG22 HG12 ' A' ' 20' ' ' VAL . 67.9 p -123.63 89.44 3.09 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.727 -0.67 . . . . 15.0 110.616 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.825 ' O ' ' N ' ' A' ' 18' ' ' GLY . 12.8 t70 -91.53 150.61 21.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.534 -0.757 . . . . 15.0 109.852 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . 1.115 ' C ' ' N ' ' A' ' 18' ' ' GLY . 7.8 t -50.37 -19.2 0.77 Allowed 'General case' 0 CA--C 1.489 -1.393 0 CA-C-O 118.838 -0.601 . . . . 15.0 111.265 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.73 ' C ' ' O ' ' A' ' 16' ' ' SER . 20.3 m120 -40.39 -17.28 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.232 1 N-CA-C 96.507 -5.368 . . . . 15.0 96.507 169.529 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 1.115 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 53.12 57.98 13.21 Favored Glycine 0 N--CA 1.43 -1.734 1 CA-C-N 107.335 -4.484 . . . . 15.0 112.612 176.222 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.38 148.91 43.49 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 112.474 -1.863 . . . . 15.0 109.841 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.748 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 34.3 m -100.83 106.33 19.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.497 -0.319 . . . . 15.0 110.171 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.77 ' HE1' HG13 ' A' ' 23' ' ' VAL . 0.4 OUTLIER -119.16 150.77 39.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.12 0.486 . . . . 15.0 112.084 -178.558 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.916 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 3.8 m-85 -119.16 133.73 55.61 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.55 -0.75 . . . . 15.0 111.781 -177.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.77 HG13 ' HE1' ' A' ' 21' ' ' TYR . 1.3 m -122.58 102.13 11.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.243 0.544 . . . . 15.0 110.255 177.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.629 ' OD1' ' HB ' ' A' ' 29' ' ' ILE . 5.4 p30 -111.36 121.55 45.53 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.208 -0.906 . . . . 15.0 108.848 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -117.05 84.51 2.16 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 119.132 -1.027 . . . . 15.0 112.855 -178.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.661 ' CG ' ' H ' ' A' ' 27' ' ' THR . 1.8 p30 -92.55 -80.31 0.37 Allowed 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 103.622 -2.732 . . . . 15.0 103.622 172.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.748 HG22 ' HD2' ' A' ' 28' ' ' ARG . 96.9 m -92.84 -81.0 0.36 Allowed 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 106.336 -1.728 . . . . 15.0 106.336 172.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.748 ' HD2' HG22 ' A' ' 27' ' ' THR . 1.1 ptm180 -154.0 90.02 1.34 Allowed 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 114.927 -1.033 . . . . 15.0 110.441 176.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.654 HD13 ' O ' ' A' ' 28' ' ' ARG . 47.3 mm . . . . . 0 N--CA 1.467 0.421 0 N-CA-C 113.635 0.976 . . . . 15.0 113.635 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.812 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.4 OUTLIER . . . . . 0 CA--C 1.512 -0.482 0 N-CA-C 109.67 -0.493 . . . . 15.0 109.67 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.748 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -93.83 77.54 4.21 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 117.822 -1.551 . . . . 15.0 109.661 178.971 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.798 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 5.3 tt0 -160.68 151.81 18.98 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.436 0.902 . . . . 15.0 113.436 176.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.916 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 1.6 p-10 -66.71 133.2 94.1 Favored Pre-proline 0 C--N 1.33 -0.251 0 N-CA-C 105.068 -2.197 . . . . 15.0 105.068 172.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.928 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 2.4 Cg_endo . . . . . 0 N--CA 1.454 -0.805 0 C-N-CA 122.793 2.329 . . . . 15.0 113.325 -175.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 1.052 ' N ' HD13 ' A' ' 6' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.506 0 CA-C-O 121.719 0.771 . . . . 15.0 111.179 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.941 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 21.9 Cg_exo -69.56 -59.42 0.09 OUTLIER 'Trans proline' 0 C--N 1.322 -0.842 0 C-N-CA 123.708 2.939 . . . . 15.0 111.872 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.941 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -81.92 176.49 8.26 Favored 'Trans proline' 0 C--N 1.32 -0.964 0 C-N-CA 124.317 3.345 . . . . 15.0 110.334 178.124 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.62 80.12 0.01 OUTLIER Glycine 0 C--N 1.33 0.235 0 C-N-CA 119.396 -1.383 . . . . 15.0 109.834 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 1.03 ' HB3' ' HZ2' ' A' ' 12' ' ' LYS . 23.3 m95 -118.77 149.02 42.18 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.796 1.036 . . . . 15.0 113.796 -176.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.406 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 43.0 tt0 -104.29 88.1 2.9 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.333 -0.988 . . . . 15.0 108.333 177.185 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 1.049 ' HG2' HD12 ' A' ' 6' ' ' LEU . 0.1 OUTLIER -106.48 151.27 25.18 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.35 -0.841 . . . . 15.0 110.117 -179.469 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.816 ' HD3' ' H ' ' A' ' 14' ' ' THR . 12.1 tpp180 -143.12 143.55 31.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.563 -0.744 . . . . 15.0 111.753 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.816 ' H ' ' HD3' ' A' ' 13' ' ' ARG . 72.3 p -118.12 89.39 3.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.401 -0.818 . . . . 15.0 110.686 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.892 ' O ' ' N ' ' A' ' 18' ' ' GLY . 18.6 t70 -106.77 150.66 26.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.686 -0.688 . . . . 15.0 109.432 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . 1.141 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.2 t -44.1 -19.06 0.02 OUTLIER 'General case' 0 CA--C 1.489 -1.367 0 CA-C-O 118.976 -0.535 . . . . 15.0 111.355 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.721 ' C ' ' O ' ' A' ' 16' ' ' SER . 66.9 t30 -40.86 -16.89 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.254 1 N-CA-C 96.388 -5.412 . . . . 15.0 96.388 169.769 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 1.141 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.0 58.5 8.55 Favored Glycine 0 N--CA 1.429 -1.778 1 CA-C-N 107.522 -4.399 . . . . 15.0 112.38 176.321 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.42 ' HB3' ' CZ3' ' A' ' 32' ' ' TRP . 5.1 tpp85 -146.62 151.32 37.09 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 112.395 -1.903 . . . . 15.0 110.408 179.589 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.708 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 13.3 m -99.08 90.39 2.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.682 -0.69 . . . . 15.0 109.78 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.799 ' CE2' ' HB3' ' A' ' 13' ' ' ARG . 1.3 p90 -95.91 151.11 19.72 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.745 0.646 . . . . 15.0 112.745 -177.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.848 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 10.7 m-85 -120.63 125.55 48.01 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.687 -0.688 . . . . 15.0 111.839 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.818 ' H ' ' HE3' ' A' ' 12' ' ' LYS . 3.5 t -118.55 89.84 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 115.651 -0.704 . . . . 15.0 110.288 178.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.846 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 66.3 t30 -111.45 125.57 54.03 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 108.191 -1.04 . . . . 15.0 108.191 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.755 ' NE2' HG13 ' A' ' 23' ' ' VAL . 55.2 m-70 -116.62 83.46 1.97 Allowed 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 118.36 -1.336 . . . . 15.0 113.289 -178.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -94.3 -81.09 0.39 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 104.331 -2.47 . . . . 15.0 104.331 172.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.955 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -93.05 -79.74 0.39 Allowed 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.065 -1.457 . . . . 15.0 107.065 173.375 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.955 ' H ' HG23 ' A' ' 27' ' ' THR . 0.4 OUTLIER -152.47 89.82 1.45 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.836 -1.075 . . . . 15.0 110.039 177.423 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.485 HG21 ' HH2' ' A' ' 10' ' ' TRP . 51.2 mt . . . . . 0 N--CA 1.464 0.269 0 N-CA-C 113.083 0.772 . . . . 15.0 113.083 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.722 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 28.1 pt20 . . . . . 0 CA--C 1.509 -0.6 0 N-CA-C 108.816 -0.809 . . . . 15.0 108.816 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.794 ' CE3' ' HB3' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -89.72 77.33 7.12 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 117.516 -1.673 . . . . 15.0 108.919 179.259 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.708 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 5.0 tt0 -160.54 152.16 19.66 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 113.218 0.822 . . . . 15.0 113.218 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.731 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -65.05 137.99 97.28 Favored Pre-proline 0 C--N 1.329 -0.319 0 N-CA-C 105.295 -2.113 . . . . 15.0 105.295 173.06 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 1.013 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 3.2 Cg_endo . . . . . 0 N--CA 1.454 -0.809 0 C-N-CA 123.189 2.593 . . . . 15.0 113.385 -175.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 1.092 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.51 -0.585 0 CA-C-O 121.611 0.719 . . . . 15.0 111.5 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.959 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 14.2 Cg_exo -73.16 -60.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.32 -0.931 0 C-N-CA 123.299 2.666 . . . . 15.0 112.881 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.959 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.3 Cg_endo -80.7 53.59 4.84 Favored 'Trans proline' 0 C--N 1.322 -0.838 0 C-N-CA 124.667 3.578 . . . . 15.0 112.745 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 49.59 63.73 3.91 Favored Glycine 0 C--O 1.23 -0.095 0 N-CA-C 109.217 -1.553 . . . . 15.0 109.217 -177.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.999 ' HB3' ' HZ2' ' A' ' 12' ' ' LYS . 10.5 m95 -112.58 151.43 30.06 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.688 0.996 . . . . 15.0 113.688 -175.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.848 ' HB3' HG12 ' A' ' 23' ' ' VAL . 32.1 tt0 -96.63 88.92 4.79 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.474 -0.936 . . . . 15.0 108.474 176.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 1.092 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -114.23 151.35 32.93 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.598 -0.728 . . . . 15.0 110.677 -178.941 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.737 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 10.2 ptm180 -147.63 149.18 32.02 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.46 -0.791 . . . . 15.0 110.996 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.744 HG22 HG12 ' A' ' 20' ' ' VAL . 74.7 p -119.0 89.57 3.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.848 -0.615 . . . . 15.0 111.088 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.854 ' O ' ' N ' ' A' ' 18' ' ' GLY . 16.9 t70 -92.3 150.57 20.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.609 -0.723 . . . . 15.0 109.432 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . 1.12 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.1 t -50.48 -19.25 0.82 Allowed 'General case' 0 CA--C 1.489 -1.376 0 CA-C-O 119.018 -0.515 . . . . 15.0 111.48 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.713 ' C ' ' O ' ' A' ' 16' ' ' SER . 53.3 t30 -40.91 -17.06 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.205 1 N-CA-C 96.331 -5.433 . . . . 15.0 96.331 169.575 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 1.12 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 52.67 59.29 9.39 Favored Glycine 0 N--CA 1.431 -1.661 1 CA-C-N 107.458 -4.428 . . . . 15.0 112.553 176.181 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.434 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 8.3 tpt180 -141.86 151.21 42.5 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 112.418 -1.891 . . . . 15.0 109.859 179.484 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.744 HG12 HG22 ' A' ' 14' ' ' THR . 35.6 m -101.25 94.74 3.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.028 -0.533 . . . . 15.0 110.266 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.843 ' HE1' HG23 ' A' ' 23' ' ' VAL . 0.1 OUTLIER -100.69 151.08 22.07 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.203 0.445 . . . . 15.0 112.203 -178.319 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.921 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 4.6 m-85 -118.5 121.63 40.74 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 113.03 0.752 . . . . 15.0 113.03 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.848 HG12 ' HB3' ' A' ' 11' ' ' GLU . 1.0 OUTLIER -107.86 89.74 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 115.483 -0.781 . . . . 15.0 108.981 177.583 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.852 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 45.8 t30 -110.79 122.53 48.05 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.495 -0.928 . . . . 15.0 108.495 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.558 ' CD2' HG13 ' A' ' 23' ' ' VAL . 29.4 m-70 -120.88 83.4 2.06 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 118.047 -1.461 . . . . 15.0 113.58 -178.23 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.98 ' ND2' ' H ' ' A' ' 27' ' ' THR . 3.6 p-10 -94.7 -80.96 0.4 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.585 -2.376 . . . . 15.0 104.585 172.12 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.98 ' H ' ' ND2' ' A' ' 26' ' ' ASN . 93.6 m -93.38 -77.7 0.44 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.078 -1.419 . . . . 15.0 107.246 173.637 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 28' ' ' ARG . 8.8 tpt180 -152.1 90.06 1.49 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.643 -1.162 . . . . 15.0 110.105 177.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.558 HG21 ' CH2' ' A' ' 10' ' ' TRP . 38.5 mm . . . . . 0 N--CA 1.466 0.365 0 N-CA-C 112.93 0.715 . . . . 15.0 112.93 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.773 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.514 -0.42 0 N-CA-C 109.351 -0.611 . . . . 15.0 109.351 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.762 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -92.7 78.26 4.85 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 117.752 -1.579 . . . . 15.0 109.238 179.069 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.792 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 3.7 tt0 -160.14 151.8 19.92 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 113.032 0.753 . . . . 15.0 113.032 177.277 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.921 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 3.8 p30 -65.88 133.42 94.92 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 105.545 -2.02 . . . . 15.0 105.545 173.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.977 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 Cg_endo . . . . . 0 N--CA 1.459 -0.55 0 C-N-CA 122.79 2.327 . . . . 15.0 113.062 -175.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 1.031 HD23 ' O ' ' A' ' 10' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.501 -0.908 0 CA-C-O 121.708 0.765 . . . . 15.0 110.604 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.948 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 32.0 Cg_exo -61.28 -53.99 2.07 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 122.532 2.155 . . . . 15.0 108.872 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 1.01 ' HG2' ' NE1' ' A' ' 10' ' ' TRP . 2.8 Cg_endo -90.55 -170.57 0.39 Allowed 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 125.229 3.952 . . . . 15.0 109.611 174.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.414 ' C ' ' CD1' ' A' ' 10' ' ' TRP . . . -68.33 93.2 0.28 Allowed Glycine 0 CA--C 1.519 0.296 0 N-CA-C 109.443 -1.463 . . . . 15.0 109.443 177.041 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 1.031 ' O ' HD23 ' A' ' 6' ' ' LEU . 36.5 m95 -129.74 148.24 51.6 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 115.079 1.511 . . . . 15.0 115.079 -175.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.67 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -101.56 89.74 3.82 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 106.025 -1.842 . . . . 15.0 106.025 175.53 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 1.131 ' HD2' ' CE2' ' A' ' 22' ' ' PHE . 10.1 mtpp -110.04 155.3 22.03 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 114.735 1.383 . . . . 15.0 114.735 -174.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.787 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 9.7 ttp180 -150.38 147.05 27.11 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 112.729 -2.032 . . . . 15.0 112.05 -178.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.553 HG23 ' O ' ' A' ' 14' ' ' THR . 4.9 t -132.61 95.16 3.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.343 -0.844 . . . . 15.0 110.792 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.856 ' O ' ' N ' ' A' ' 18' ' ' GLY . 19.4 t70 -111.28 150.95 28.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.886 -0.597 . . . . 15.0 110.483 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . 1.093 ' C ' ' N ' ' A' ' 18' ' ' GLY . 70.4 p -45.28 -18.76 0.03 OUTLIER 'General case' 0 CA--C 1.49 -1.332 0 CA-C-O 118.744 -0.646 . . . . 15.0 111.413 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.747 ' C ' ' O ' ' A' ' 16' ' ' SER . 74.4 m-20 -39.89 -17.13 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.234 1 N-CA-C 96.497 -5.371 . . . . 15.0 96.497 169.451 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 1.093 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.36 55.56 15.93 Favored Glycine 0 N--CA 1.43 -1.752 1 CA-C-N 107.665 -4.334 . . . . 15.0 111.992 176.541 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -137.65 150.67 47.56 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 112.301 -1.949 . . . . 15.0 109.648 179.34 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.689 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 4.2 t -99.1 95.95 4.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.557 -0.534 . . . . 15.0 109.557 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.811 ' HA ' ' HA ' ' A' ' 32' ' ' TRP . 0.1 OUTLIER -101.13 150.76 22.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.198 0.523 . . . . 15.0 112.329 -177.927 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 1.131 ' CE2' ' HD2' ' A' ' 12' ' ' LYS . 5.0 m-85 -124.92 134.32 52.71 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.479 -0.782 . . . . 15.0 112.287 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.737 HG23 ' CE1' ' A' ' 21' ' ' TYR . 13.5 t -122.5 89.27 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 115.546 -0.752 . . . . 15.0 109.681 178.188 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.765 ' O ' ' O ' ' A' ' 29' ' ' ILE . 9.3 t-20 -133.8 134.79 43.29 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 108.631 -0.877 . . . . 15.0 108.631 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.787 ' HB2' ' HA ' ' A' ' 28' ' ' ARG . 10.6 p80 -151.87 88.82 1.42 Allowed 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 118.161 -1.416 . . . . 15.0 114.275 -178.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.442 ' C ' ' O ' ' A' ' 25' ' ' HIS . 44.9 t30 -50.62 -60.41 3.06 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 102.767 -3.049 . . . . 15.0 102.767 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.857 HG22 ' NE ' ' A' ' 28' ' ' ARG . 15.5 m -92.84 -81.94 0.34 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.882 -1.508 . . . . 15.0 106.999 173.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.857 ' NE ' HG22 ' A' ' 27' ' ' THR . 0.0 OUTLIER -154.71 100.41 2.23 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.815 -0.63 . . . . 15.0 111.672 177.135 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.765 ' O ' ' O ' ' A' ' 24' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.499 0 CA-C-N 119.538 1.063 . . . . 15.0 112.627 178.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.876 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 17.9 pt20 . . . . . 0 CA--C 1.511 -0.542 0 N-CA-C 109.256 -0.646 . . . . 15.0 109.256 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.811 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -91.67 78.23 5.54 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 117.67 -1.612 . . . . 15.0 109.366 178.808 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.771 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 8.0 tt0 -159.66 151.77 20.75 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 113.162 0.801 . . . . 15.0 113.162 176.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.808 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 5.0 p-10 -65.39 132.95 95.28 Favored Pre-proline 0 C--N 1.331 -0.224 0 N-CA-C 104.517 -2.401 . . . . 15.0 104.517 172.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.98 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 3.2 Cg_exo . . . . . 0 N--CA 1.457 -0.644 0 C-N-CA 122.048 1.832 . . . . 15.0 113.244 -174.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.525 ' HA2' ' O ' ' A' ' 5' ' ' PRO . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 112.446 -0.262 . . . . 15.0 112.446 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.642 ' C ' ' H ' ' A' ' 4' ' ' GLY . . . 60.79 -164.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.801 0.334 . . . . 15.0 111.026 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.757 ' HE2' ' N ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -63.0 15.81 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.305 -0.407 . . . . 15.0 110.776 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.642 ' H ' ' C ' ' A' ' 2' ' ' ALA . . . -127.94 -167.2 12.21 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.77 -0.728 . . . . 15.0 112.543 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.675 ' C ' HD12 ' A' ' 6' ' ' LEU . 63.2 Cg_exo -32.5 162.14 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.284 2.656 . . . . 15.0 112.993 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 1.1 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER 38.7 68.81 1.76 Allowed Pre-proline 0 CA--C 1.51 -0.589 0 CA-C-N 115.395 -0.82 . . . . 15.0 110.915 -179.527 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.941 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 14.8 Cg_exo -72.92 -60.42 0.05 OUTLIER 'Trans proline' 0 C--N 1.319 -0.977 0 C-N-CA 123.564 2.843 . . . . 15.0 113.066 -179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.952 ' HB2' ' HE1' ' A' ' 10' ' ' TRP . 1.4 Cg_endo -81.48 53.44 4.69 Favored 'Trans proline' 0 C--N 1.321 -0.877 0 C-N-CA 124.391 3.394 . . . . 15.0 112.767 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 51.32 65.39 3.16 Favored Glycine 0 C--O 1.23 -0.107 0 N-CA-C 109.164 -1.574 . . . . 15.0 109.164 -177.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.962 ' HB3' ' CD ' ' A' ' 12' ' ' LYS . 12.7 m95 -116.49 151.91 35.14 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.011 1.115 . . . . 15.0 114.011 -175.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.995 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -98.46 94.12 6.54 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.203 -1.036 . . . . 15.0 108.203 176.415 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 1.1 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -118.07 150.91 38.53 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.364 -0.835 . . . . 15.0 110.26 -178.713 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.669 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 1.5 ptm85 -149.41 147.82 28.73 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.496 -0.775 . . . . 15.0 111.019 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.5 m -118.21 94.4 4.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.033 -0.53 . . . . 15.0 112.047 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.869 ' O ' ' N ' ' A' ' 18' ' ' GLY . 8.7 t70 -89.51 147.66 23.85 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.638 -0.875 . . . . 15.0 108.638 178.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . 1.087 ' C ' ' N ' ' A' ' 18' ' ' GLY . 68.9 p -47.93 -19.19 0.22 Allowed 'General case' 0 CA--C 1.493 -1.244 0 CA-C-O 118.667 -0.682 . . . . 15.0 112.083 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.723 ' C ' ' O ' ' A' ' 16' ' ' SER . 47.2 t30 -41.12 -16.98 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.235 1 N-CA-C 96.475 -5.38 . . . . 15.0 96.475 169.439 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 1.087 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 52.01 58.5 10.45 Favored Glycine 0 N--CA 1.431 -1.65 1 CA-C-N 107.554 -4.384 . . . . 15.0 112.331 176.428 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 8.7 tpp180 -138.25 151.57 47.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 112.357 -1.922 . . . . 15.0 109.958 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.804 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 38.1 t -97.06 115.13 35.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.155 -0.475 . . . . 15.0 110.62 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.857 ' HE1' ' HB ' ' A' ' 23' ' ' VAL . 0.1 OUTLIER -115.82 152.06 34.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.32 -0.4 . . . . 15.0 111.937 -178.895 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.906 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 5.2 m-85 -126.51 121.26 31.81 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.769 -0.651 . . . . 15.0 112.411 -177.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.995 HG12 ' O ' ' A' ' 11' ' ' GLU . 11.0 p -112.74 97.76 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 109.281 -0.636 . . . . 15.0 109.281 177.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.519 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 51.3 t30 -103.27 122.24 44.37 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 107.708 -1.219 . . . . 15.0 107.708 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -117.0 83.75 2.03 Favored 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 118.32 -1.352 . . . . 15.0 113.66 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.472 ' OD1' HG12 ' A' ' 29' ' ' ILE . 1.2 p30 -94.19 -81.82 0.37 Allowed 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 104.507 -2.405 . . . . 15.0 104.507 172.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.982 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -93.57 -78.02 0.44 Allowed 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 106.826 -1.546 . . . . 15.0 106.826 173.099 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.982 ' H ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -152.42 89.6 1.43 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 114.803 -1.09 . . . . 15.0 110.084 177.073 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.809 HD11 ' NH2' ' A' ' 28' ' ' ARG . 47.0 mm -125.46 127.54 71.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.834 0.679 . . . . 15.0 112.834 -178.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.717 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -150.32 148.6 29.02 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.891 -0.595 . . . . 15.0 109.86 179.4 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.804 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 1.7 m95 -96.56 78.58 2.98 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 118.345 -1.342 . . . . 15.0 110.179 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.844 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 3.5 tt0 -159.57 151.65 20.75 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 113.572 0.953 . . . . 15.0 113.572 176.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.906 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 7.0 t0 -66.55 131.52 94.14 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 105.228 -2.138 . . . . 15.0 105.228 173.032 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.928 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 Cg_endo -90.43 7.12 3.83 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.307 2.005 . . . . 15.0 112.825 -175.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 1.008 ' HG2' ' H ' ' A' ' 37' ' ' SER . 0.0 OUTLIER 17.14 -99.51 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.881 -0.6 . . . . 15.0 111.427 -179.527 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . 1.008 ' H ' ' HG2' ' A' ' 36' ' ' ARG . 50.3 m . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.27 -0.871 . . . . 15.0 110.797 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.586 ' O ' ' HB3' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.491 2.307 0 N-CA-C 112.573 -0.211 . . . . 15.0 112.573 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.586 ' HB3' ' O ' ' A' ' 1' ' ' GLY . . . 76.73 100.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.952 0.406 . . . . 15.0 111.291 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . 1.01 ' HE2' ' H ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -154.37 108.8 3.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.946 -0.57 . . . . 15.0 110.411 179.761 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.445 ' O ' ' C ' ' A' ' 5' ' ' PRO . . . 132.35 -155.28 21.44 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.634 -0.793 . . . . 15.0 111.906 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.769 ' O ' HD12 ' A' ' 6' ' ' LEU . 56.8 Cg_exo -28.01 131.4 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.399 2.733 . . . . 15.0 112.082 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 1.081 HD23 ' CD ' ' A' ' 12' ' ' LYS . 1.6 pp 56.06 111.27 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 115.174 1.546 . . . . 15.0 115.174 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 1.002 ' CD ' ' HD3' ' A' ' 8' ' ' PRO . 33.6 Cg_exo -71.96 -51.31 0.23 Allowed 'Trans proline' 0 C--N 1.326 -0.628 0 C-N-CA 123.391 2.727 . . . . 15.0 112.356 174.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 1.002 ' HD3' ' CD ' ' A' ' 7' ' ' PRO . 1.9 Cg_endo -82.09 -174.83 2.26 Favored 'Trans proline' 0 C--N 1.326 -0.618 0 C-N-CA 125.109 3.873 . . . . 15.0 113.071 -179.239 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.96 90.39 0.25 Allowed Glycine 0 C--N 1.337 0.63 0 N-CA-C 109.688 -1.365 . . . . 15.0 109.688 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 1.012 ' CE2' ' HG2' ' A' ' 35' ' ' PRO . 32.4 m95 -133.74 152.93 52.01 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 113.571 0.952 . . . . 15.0 113.571 -176.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.725 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -99.94 89.6 4.12 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.85 -1.167 . . . . 15.0 107.85 175.032 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 1.081 ' CD ' HD23 ' A' ' 6' ' ' LEU . 0.1 OUTLIER -110.36 150.52 28.67 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.003 -0.544 . . . . 15.0 110.177 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.673 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 28.9 ttm180 -146.84 150.55 35.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.803 -0.635 . . . . 15.0 112.165 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.7 p -124.54 89.61 3.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.333 -0.849 . . . . 15.0 110.802 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.848 ' O ' ' N ' ' A' ' 18' ' ' GLY . 11.4 t70 -103.4 150.74 23.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.877 -0.601 . . . . 15.0 109.882 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . 1.044 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.2 t -48.69 -19.3 0.34 Allowed 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 118.853 -0.594 . . . . 15.0 111.395 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.753 ' C ' ' O ' ' A' ' 16' ' ' SER . 17.2 m120 -40.31 -17.07 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.249 1 N-CA-C 96.437 -5.394 . . . . 15.0 96.437 169.625 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 1.044 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.68 57.32 10.91 Favored Glycine 0 N--CA 1.429 -1.783 1 CA-C-N 107.575 -4.375 . . . . 15.0 112.117 176.321 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.467 ' HB3' ' CZ3' ' A' ' 32' ' ' TRP . 0.0 OUTLIER -140.03 148.03 41.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 112.478 -1.861 . . . . 15.0 110.28 179.553 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.802 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 25.4 m -96.1 96.51 5.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.551 -0.537 . . . . 15.0 109.551 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.799 ' HB3' ' CE3' ' A' ' 32' ' ' TRP . 0.9 OUTLIER -107.81 151.08 26.21 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.719 0.637 . . . . 15.0 112.719 -177.518 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.911 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 6.6 m-85 -122.2 129.37 52.21 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.452 -0.795 . . . . 15.0 111.466 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.749 HG12 HG22 ' A' ' 30' ' ' TPO . 0.2 OUTLIER -125.43 94.58 2.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.476 0.655 . . . . 15.0 110.756 178.11 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.632 ' ND2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 m-20 -109.51 135.29 50.75 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 115.037 -0.983 . . . . 15.0 108.394 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.8 m-70 -118.76 84.08 2.13 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 118.51 -1.276 . . . . 15.0 112.98 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -93.32 -81.16 0.37 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 104.056 -2.572 . . . . 15.0 104.056 172.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . 1.067 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.8 OUTLIER -93.18 -79.96 0.39 Allowed 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.409 -1.7 . . . . 15.0 106.409 172.762 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 1.067 ' H ' HG23 ' A' ' 27' ' ' THR . 16.3 ptm180 -152.86 89.82 1.42 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.757 -1.111 . . . . 15.0 109.527 176.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.554 HD13 ' O ' ' A' ' 28' ' ' ARG . 51.2 mm -129.54 126.18 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 N-CA-C 113.362 0.875 . . . . 15.0 113.362 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TPO . . . . . 0.749 HG22 HG12 ' A' ' 23' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.794 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -131.29 148.9 52.73 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.593 -0.521 . . . . 15.0 109.593 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.802 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -91.96 78.91 5.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 118.246 -1.382 . . . . 15.0 109.586 179.279 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.787 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 7.3 tt0 -159.36 151.95 21.5 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 113.457 0.91 . . . . 15.0 113.457 177.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.787 ' N ' ' HG2' ' A' ' 33' ' ' GLU . 5.4 p-10 -69.93 138.08 87.61 Favored Pre-proline 0 C--N 1.331 -0.217 0 N-CA-C 104.996 -2.224 . . . . 15.0 104.996 172.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 1.012 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.7 Cg_endo -91.94 41.5 0.33 Allowed 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.603 2.202 . . . . 15.0 112.701 -175.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.756 ' HD2' ' N ' ' A' ' 37' ' ' SER . 1.3 ppt_? -35.7 -22.2 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.1 -0.5 . . . . 15.0 111.112 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.756 ' N ' ' HD2' ' A' ' 36' ' ' ARG . 81.0 p . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.285 -0.864 . . . . 15.0 110.873 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.467 ' HA3' ' SD ' ' A' ' 3' ' ' MET . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 112.487 -0.245 . . . . 15.0 112.487 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.29 5.52 2.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.826 0.345 . . . . 15.0 111.143 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.689 ' HE2' ' N ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -97.55 31.75 2.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.211 -0.449 . . . . 15.0 110.962 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.556 ' O ' ' O ' ' A' ' 5' ' ' PRO . . . 172.21 -158.67 29.32 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.784 -0.722 . . . . 15.0 112.4 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.716 ' C ' HD12 ' A' ' 6' ' ' LEU . 88.0 Cg_exo -30.15 161.32 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.473 2.782 . . . . 15.0 112.707 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 1.1 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER 44.62 74.26 0.83 Allowed Pre-proline 0 CA--C 1.511 -0.551 0 CA-C-N 115.247 -0.888 . . . . 15.0 111.449 -179.503 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.996 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 36.1 Cg_exo -65.67 -57.78 0.23 Allowed 'Trans proline' 0 C--N 1.322 -0.837 0 C-N-CA 122.839 2.359 . . . . 15.0 110.032 178.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.996 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.3 Cg_endo -85.95 -176.17 2.08 Favored 'Trans proline' 0 C--N 1.32 -0.947 0 C-N-CA 124.998 3.798 . . . . 15.0 109.423 176.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.42 ' O ' ' ND2' ' A' ' 24' ' ' ASN . . . -59.75 83.27 0.01 OUTLIER Glycine 0 CA--C 1.517 0.165 0 N-CA-C 109.373 -1.491 . . . . 15.0 109.373 176.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.994 ' HB3' ' HZ2' ' A' ' 12' ' ' LYS . 26.3 m95 -128.35 150.47 50.07 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 114.054 1.131 . . . . 15.0 114.054 -176.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.843 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.4 OUTLIER -110.77 88.7 2.84 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 107.966 -1.124 . . . . 15.0 107.966 176.454 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 1.1 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -105.21 150.46 25.08 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.686 -0.688 . . . . 15.0 109.875 -178.986 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -150.47 150.42 31.29 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.716 -0.674 . . . . 15.0 111.967 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.663 HG23 ' O ' ' A' ' 14' ' ' THR . 10.2 t -118.28 89.48 3.13 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.686 -0.688 . . . . 15.0 111.068 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.912 ' O ' ' N ' ' A' ' 18' ' ' GLY . 14.4 t70 -94.22 150.58 20.17 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 109.086 -0.709 . . . . 15.0 109.086 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . 1.093 ' C ' ' N ' ' A' ' 18' ' ' GLY . 67.2 p -44.39 -18.99 0.02 OUTLIER 'General case' 0 CA--C 1.492 -1.27 0 CA-C-O 118.612 -0.708 . . . . 15.0 111.676 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.722 ' C ' ' O ' ' A' ' 16' ' ' SER . 85.4 m-20 -41.33 -16.92 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.252 1 N-CA-C 96.552 -5.351 . . . . 15.0 96.552 169.524 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 1.093 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 51.39 58.72 9.38 Favored Glycine 0 N--CA 1.429 -1.806 1 CA-C-N 107.492 -4.413 . . . . 15.0 112.366 176.498 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 19' ' ' ARG . 1.3 tpp180 -150.18 151.81 33.67 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 112.429 -1.886 . . . . 15.0 110.252 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.773 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 34.0 m -97.97 100.66 11.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.704 -0.68 . . . . 15.0 110.295 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.878 ' HE1' ' HB ' ' A' ' 23' ' ' VAL . 0.1 OUTLIER -107.03 151.7 24.99 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.321 0.489 . . . . 15.0 112.321 -178.35 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.858 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 4.9 m-85 -114.42 120.65 41.03 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 112.658 0.614 . . . . 15.0 112.658 -178.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.878 ' HB ' ' HE1' ' A' ' 21' ' ' TYR . 7.1 p -114.56 96.65 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 115.68 -0.691 . . . . 15.0 109.413 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.621 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 26.6 t-20 -122.2 136.59 54.93 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.338 -0.846 . . . . 15.0 108.805 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.438 ' NE2' ' CG2' ' A' ' 23' ' ' VAL . 53.3 m-70 -126.41 84.46 2.27 Favored 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 118.49 -1.284 . . . . 15.0 113.242 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -93.33 -80.43 0.38 Allowed 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 103.836 -2.653 . . . . 15.0 103.836 172.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 52.3 p -92.98 -80.6 0.37 Allowed 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 106.235 -1.765 . . . . 15.0 106.235 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -153.59 90.1 1.38 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 114.885 -1.052 . . . . 15.0 110.343 176.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.577 HG23 ' O ' ' A' ' 24' ' ' ASN . 7.0 tp -127.65 125.85 66.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 118.911 0.778 . . . . 15.0 112.775 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.809 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 15.8 pt20 -150.52 150.38 31.19 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.946 -0.57 . . . . 15.0 109.702 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.773 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -91.71 77.47 5.59 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 117.619 -1.632 . . . . 15.0 108.791 178.481 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.74 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 7.5 tt0 -160.19 152.27 20.41 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 113.047 0.758 . . . . 15.0 113.047 177.111 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.782 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 5.0 p-10 -63.79 134.37 95.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 105.36 -2.089 . . . . 15.0 105.36 173.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.952 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 2.2 Cg_endo -89.38 33.18 0.36 Allowed 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.719 2.279 . . . . 15.0 113.346 -175.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.438 ' C ' ' O ' ' A' ' 35' ' ' PRO . 29.1 tpt180 -35.83 -70.94 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.777 0.322 . . . . 15.0 110.926 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 80.1 p . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.22 -0.895 . . . . 15.0 110.857 179.937 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.477 ' O ' ' HB3' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 112.481 -0.247 . . . . 15.0 112.481 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.593 ' O ' ' SD ' ' A' ' 3' ' ' MET . . . 70.68 -66.45 0.29 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.636 0.255 . . . . 15.0 111.299 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.612 ' O ' ' SD ' ' A' ' 3' ' ' MET . 0.0 OUTLIER 50.7 140.51 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.286 0.565 . . . . 15.0 111.567 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.687 ' O ' ' N ' ' A' ' 6' ' ' LEU . . . -61.76 -179.94 3.68 Favored Glycine 0 C--N 1.33 0.249 0 CA-C-N 115.72 -0.673 . . . . 15.0 113.078 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 1.245 ' C ' HD12 ' A' ' 6' ' ' LEU . 85.1 Cg_exo -46.23 65.69 0.01 OUTLIER 'Trans proline' 0 CA--C 1.511 -0.637 0 C-N-CA 123.713 2.942 . . . . 15.0 113.618 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 1.245 HD12 ' C ' ' A' ' 5' ' ' PRO . 0.2 OUTLIER -150.53 76.41 8.32 Favored Pre-proline 0 C--N 1.308 -1.213 0 CA-C-N 115.625 -0.716 . . . . 15.0 109.978 179.117 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.963 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 38.4 Cg_exo -63.59 -57.73 0.35 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.97 2.447 . . . . 15.0 110.923 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.963 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.9 Cg_endo -87.93 -177.25 1.88 Allowed 'Trans proline' 0 C--N 1.315 -1.225 0 C-N-CA 124.91 3.74 . . . . 15.0 109.481 176.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.415 ' C ' ' CD1' ' A' ' 10' ' ' TRP . . . -60.78 88.82 0.04 OUTLIER Glycine 0 CA--C 1.517 0.192 0 N-CA-C 108.968 -1.653 . . . . 15.0 108.968 176.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 1.043 ' O ' HD23 ' A' ' 6' ' ' LEU . 27.4 m95 -130.73 150.76 51.76 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 114.349 1.24 . . . . 15.0 114.349 -175.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.675 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -111.17 89.35 3.02 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 107.678 -1.23 . . . . 15.0 107.678 176.097 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.965 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -108.38 150.24 27.63 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.856 -0.611 . . . . 15.0 111.121 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.565 ' HD3' ' HE2' ' A' ' 21' ' ' TYR . 12.3 ptm180 -147.49 147.88 30.64 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.319 -0.855 . . . . 15.0 110.9 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.703 HG22 HG12 ' A' ' 20' ' ' VAL . 67.9 p -123.63 89.44 3.09 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.727 -0.67 . . . . 15.0 110.616 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.825 ' O ' ' N ' ' A' ' 18' ' ' GLY . 12.8 t70 -91.53 150.61 21.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.534 -0.757 . . . . 15.0 109.852 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . 1.115 ' C ' ' N ' ' A' ' 18' ' ' GLY . 7.8 t -50.37 -19.2 0.77 Allowed 'General case' 0 CA--C 1.489 -1.393 0 CA-C-O 118.838 -0.601 . . . . 15.0 111.265 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.73 ' C ' ' O ' ' A' ' 16' ' ' SER . 20.3 m120 -40.39 -17.28 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.232 1 N-CA-C 96.507 -5.368 . . . . 15.0 96.507 169.529 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 1.115 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 53.12 57.98 13.21 Favored Glycine 0 N--CA 1.43 -1.734 1 CA-C-N 107.335 -4.484 . . . . 15.0 112.612 176.222 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.38 148.91 43.49 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 112.474 -1.863 . . . . 15.0 109.841 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.748 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 34.3 m -100.83 106.33 19.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.497 -0.319 . . . . 15.0 110.171 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.77 ' HE1' HG13 ' A' ' 23' ' ' VAL . 0.4 OUTLIER -119.16 150.77 39.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.12 0.486 . . . . 15.0 112.084 -178.558 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.916 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 3.8 m-85 -119.16 133.73 55.61 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.55 -0.75 . . . . 15.0 111.781 -177.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.77 HG13 ' HE1' ' A' ' 21' ' ' TYR . 1.3 m -122.58 102.13 11.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.243 0.544 . . . . 15.0 110.255 177.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.629 ' OD1' ' HB ' ' A' ' 29' ' ' ILE . 5.4 p30 -111.36 121.55 45.53 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.208 -0.906 . . . . 15.0 108.848 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -117.05 84.51 2.16 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 119.132 -1.027 . . . . 15.0 112.855 -178.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.661 ' CG ' ' H ' ' A' ' 27' ' ' THR . 1.8 p30 -92.55 -80.31 0.37 Allowed 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 103.622 -2.732 . . . . 15.0 103.622 172.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.748 HG22 ' HD2' ' A' ' 28' ' ' ARG . 96.9 m -92.84 -81.0 0.36 Allowed 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 106.336 -1.728 . . . . 15.0 106.336 172.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.748 ' HD2' HG22 ' A' ' 27' ' ' THR . 1.1 ptm180 -154.0 90.02 1.34 Allowed 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 114.927 -1.033 . . . . 15.0 110.441 176.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.654 HD13 ' O ' ' A' ' 28' ' ' ARG . 47.3 mm -146.22 135.46 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 N-CA-C 113.635 0.976 . . . . 15.0 113.635 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TPO . . . . . 0.534 HG22 ' HA ' ' A' ' 23' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.812 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -150.17 150.44 31.63 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.946 -0.57 . . . . 15.0 109.67 179.74 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.748 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -93.83 77.54 4.21 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 117.822 -1.551 . . . . 15.0 109.661 178.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.798 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 5.3 tt0 -160.68 151.81 18.98 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.436 0.902 . . . . 15.0 113.436 176.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.916 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 1.6 p-10 -66.71 133.2 94.1 Favored Pre-proline 0 C--N 1.33 -0.251 0 N-CA-C 105.068 -2.197 . . . . 15.0 105.068 172.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.928 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 2.4 Cg_endo -94.58 10.49 1.81 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.793 2.329 . . . . 15.0 113.325 -175.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 1.033 ' NE ' ' H ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -28.07 -53.57 0.09 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.755 0.312 . . . . 15.0 111.22 -179.145 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . 1.033 ' H ' ' NE ' ' A' ' 36' ' ' ARG . 78.6 p . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.242 -0.885 . . . . 15.0 110.799 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 3' ' ' MET . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 112.487 -0.245 . . . . 15.0 112.487 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.3 -76.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.927 0.394 . . . . 15.0 111.083 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.579 ' O ' ' HG3' ' A' ' 3' ' ' MET . 23.6 ptm -161.12 93.56 0.97 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.109 -0.496 . . . . 15.0 110.735 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.503 ' O ' ' O ' ' A' ' 5' ' ' PRO . . . 154.37 -163.66 31.19 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.808 -0.71 . . . . 15.0 112.409 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.933 ' C ' HD13 ' A' ' 6' ' ' LEU . 57.6 Cg_exo -29.55 156.0 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 123.345 2.696 . . . . 15.0 112.793 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 1.052 ' N ' HD13 ' A' ' 6' ' ' LEU . 0.0 OUTLIER 36.86 74.18 0.63 Allowed Pre-proline 0 CA--C 1.512 -0.506 0 CA-C-N 115.211 -0.904 . . . . 15.0 111.179 -179.371 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.941 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 21.9 Cg_exo -69.56 -59.42 0.09 OUTLIER 'Trans proline' 0 C--N 1.322 -0.842 0 C-N-CA 123.708 2.939 . . . . 15.0 111.872 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.941 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -81.92 176.49 8.26 Favored 'Trans proline' 0 C--N 1.32 -0.964 0 C-N-CA 124.317 3.345 . . . . 15.0 110.334 178.124 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.62 80.12 0.01 OUTLIER Glycine 0 C--N 1.33 0.235 0 C-N-CA 119.396 -1.383 . . . . 15.0 109.834 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 1.03 ' HB3' ' HZ2' ' A' ' 12' ' ' LYS . 23.3 m95 -118.77 149.02 42.18 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.796 1.036 . . . . 15.0 113.796 -176.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.406 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 43.0 tt0 -104.29 88.1 2.9 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.333 -0.988 . . . . 15.0 108.333 177.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 1.049 ' HG2' HD12 ' A' ' 6' ' ' LEU . 0.1 OUTLIER -106.48 151.27 25.18 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.35 -0.841 . . . . 15.0 110.117 -179.469 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.816 ' HD3' ' H ' ' A' ' 14' ' ' THR . 12.1 tpp180 -143.12 143.55 31.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.563 -0.744 . . . . 15.0 111.753 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.816 ' H ' ' HD3' ' A' ' 13' ' ' ARG . 72.3 p -118.12 89.39 3.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.401 -0.818 . . . . 15.0 110.686 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.892 ' O ' ' N ' ' A' ' 18' ' ' GLY . 18.6 t70 -106.77 150.66 26.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.686 -0.688 . . . . 15.0 109.432 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . 1.141 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.2 t -44.1 -19.06 0.02 OUTLIER 'General case' 0 CA--C 1.489 -1.367 0 CA-C-O 118.976 -0.535 . . . . 15.0 111.355 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.721 ' C ' ' O ' ' A' ' 16' ' ' SER . 66.9 t30 -40.86 -16.89 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.254 1 N-CA-C 96.388 -5.412 . . . . 15.0 96.388 169.769 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 1.141 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.0 58.5 8.55 Favored Glycine 0 N--CA 1.429 -1.778 1 CA-C-N 107.522 -4.399 . . . . 15.0 112.38 176.321 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.42 ' HB3' ' CZ3' ' A' ' 32' ' ' TRP . 5.1 tpp85 -146.62 151.32 37.09 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 112.395 -1.903 . . . . 15.0 110.408 179.589 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.708 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 13.3 m -99.08 90.39 2.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.682 -0.69 . . . . 15.0 109.78 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.799 ' CE2' ' HB3' ' A' ' 13' ' ' ARG . 1.3 p90 -95.91 151.11 19.72 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.745 0.646 . . . . 15.0 112.745 -177.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.848 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 10.7 m-85 -120.63 125.55 48.01 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.687 -0.688 . . . . 15.0 111.839 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.818 ' H ' ' HE3' ' A' ' 12' ' ' LYS . 3.5 t -118.55 89.84 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 115.651 -0.704 . . . . 15.0 110.288 178.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.846 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 66.3 t30 -111.45 125.57 54.03 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 108.191 -1.04 . . . . 15.0 108.191 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.755 ' NE2' HG13 ' A' ' 23' ' ' VAL . 55.2 m-70 -116.62 83.46 1.97 Allowed 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 118.36 -1.336 . . . . 15.0 113.289 -178.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -94.3 -81.09 0.39 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 104.331 -2.47 . . . . 15.0 104.331 172.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.955 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -93.05 -79.74 0.39 Allowed 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.065 -1.457 . . . . 15.0 107.065 173.375 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.955 ' H ' HG23 ' A' ' 27' ' ' THR . 0.4 OUTLIER -152.47 89.82 1.45 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.836 -1.075 . . . . 15.0 110.039 177.423 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.485 HG21 ' HH2' ' A' ' 10' ' ' TRP . 51.2 mt -126.18 120.0 55.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 N-CA-C 113.083 0.772 . . . . 15.0 113.083 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.722 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 28.1 pt20 -147.27 150.31 34.57 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 108.816 -0.809 . . . . 15.0 108.816 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.794 ' CE3' ' HB3' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -89.72 77.33 7.12 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 117.516 -1.673 . . . . 15.0 108.919 179.259 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.708 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 5.0 tt0 -160.54 152.16 19.66 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 113.218 0.822 . . . . 15.0 113.218 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.731 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -65.05 137.99 97.28 Favored Pre-proline 0 C--N 1.329 -0.319 0 N-CA-C 105.295 -2.113 . . . . 15.0 105.295 173.06 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 1.013 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 3.2 Cg_endo -94.56 77.76 0.18 Allowed 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.189 2.593 . . . . 15.0 113.385 -175.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.613 ' HD3' ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -60.45 8.02 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.282 -0.417 . . . . 15.0 110.711 179.564 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.605 ' H ' ' C ' ' A' ' 35' ' ' PRO . 60.7 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.224 -0.893 . . . . 15.0 110.999 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.423 ' O ' ' HB3' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.488 2.117 0 N-CA-C 112.422 -0.271 . . . . 15.0 112.422 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.517 ' O ' ' O ' ' A' ' 3' ' ' MET . . . 67.71 110.53 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.688 0.28 . . . . 15.0 111.018 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.517 ' O ' ' O ' ' A' ' 2' ' ' ALA . 25.7 ptt? 46.16 178.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 15.0 110.656 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 101.8 -170.11 20.69 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.448 -0.882 . . . . 15.0 112.67 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.908 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 61.6 Cg_endo -70.85 162.66 41.84 Favored 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 122.945 2.43 . . . . 15.0 113.181 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 1.092 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER 41.04 69.65 1.9 Allowed Pre-proline 0 CA--C 1.51 -0.585 0 CA-C-N 115.254 -0.885 . . . . 15.0 111.5 -179.16 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.959 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 14.2 Cg_exo -73.16 -60.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.32 -0.931 0 C-N-CA 123.299 2.666 . . . . 15.0 112.881 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.959 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.3 Cg_endo -80.7 53.59 4.84 Favored 'Trans proline' 0 C--N 1.322 -0.838 0 C-N-CA 124.667 3.578 . . . . 15.0 112.745 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 49.59 63.73 3.91 Favored Glycine 0 C--O 1.23 -0.095 0 N-CA-C 109.217 -1.553 . . . . 15.0 109.217 -177.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.999 ' HB3' ' HZ2' ' A' ' 12' ' ' LYS . 10.5 m95 -112.58 151.43 30.06 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.688 0.996 . . . . 15.0 113.688 -175.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.848 ' HB3' HG12 ' A' ' 23' ' ' VAL . 32.1 tt0 -96.63 88.92 4.79 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.474 -0.936 . . . . 15.0 108.474 176.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 1.092 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -114.23 151.35 32.93 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.598 -0.728 . . . . 15.0 110.677 -178.941 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.737 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 10.2 ptm180 -147.63 149.18 32.02 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.46 -0.791 . . . . 15.0 110.996 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.744 HG22 HG12 ' A' ' 20' ' ' VAL . 74.7 p -119.0 89.57 3.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.848 -0.615 . . . . 15.0 111.088 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.854 ' O ' ' N ' ' A' ' 18' ' ' GLY . 16.9 t70 -92.3 150.57 20.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.609 -0.723 . . . . 15.0 109.432 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . 1.12 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.1 t -50.48 -19.25 0.82 Allowed 'General case' 0 CA--C 1.489 -1.376 0 CA-C-O 119.018 -0.515 . . . . 15.0 111.48 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.713 ' C ' ' O ' ' A' ' 16' ' ' SER . 53.3 t30 -40.91 -17.06 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.205 1 N-CA-C 96.331 -5.433 . . . . 15.0 96.331 169.575 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 1.12 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 52.67 59.29 9.39 Favored Glycine 0 N--CA 1.431 -1.661 1 CA-C-N 107.458 -4.428 . . . . 15.0 112.553 176.181 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.434 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 8.3 tpt180 -141.86 151.21 42.5 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 112.418 -1.891 . . . . 15.0 109.859 179.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.744 HG12 HG22 ' A' ' 14' ' ' THR . 35.6 m -101.25 94.74 3.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.028 -0.533 . . . . 15.0 110.266 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.843 ' HE1' HG23 ' A' ' 23' ' ' VAL . 0.1 OUTLIER -100.69 151.08 22.07 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.203 0.445 . . . . 15.0 112.203 -178.319 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.921 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 4.6 m-85 -118.5 121.63 40.74 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 113.03 0.752 . . . . 15.0 113.03 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.848 HG12 ' HB3' ' A' ' 11' ' ' GLU . 1.0 OUTLIER -107.86 89.74 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 115.483 -0.781 . . . . 15.0 108.981 177.583 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.852 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 45.8 t30 -110.79 122.53 48.05 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.495 -0.928 . . . . 15.0 108.495 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.558 ' CD2' HG13 ' A' ' 23' ' ' VAL . 29.4 m-70 -120.88 83.4 2.06 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 118.047 -1.461 . . . . 15.0 113.58 -178.23 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.98 ' ND2' ' H ' ' A' ' 27' ' ' THR . 3.6 p-10 -94.7 -80.96 0.4 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.585 -2.376 . . . . 15.0 104.585 172.12 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.98 ' H ' ' ND2' ' A' ' 26' ' ' ASN . 93.6 m -93.38 -77.7 0.44 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.078 -1.419 . . . . 15.0 107.246 173.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 28' ' ' ARG . 8.8 tpt180 -152.1 90.06 1.49 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.643 -1.162 . . . . 15.0 110.105 177.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.558 HG21 ' CH2' ' A' ' 10' ' ' TRP . 38.5 mm -125.98 121.36 59.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 112.93 0.715 . . . . 15.0 112.93 -179.031 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TPO . . . . . 0.43 ' O ' HG22 ' A' ' 30' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.773 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -150.28 150.09 31.03 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.79 -0.641 . . . . 15.0 109.351 179.781 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.762 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -92.7 78.26 4.85 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 117.752 -1.579 . . . . 15.0 109.238 179.069 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.792 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 3.7 tt0 -160.14 151.8 19.92 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 113.032 0.753 . . . . 15.0 113.032 177.277 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.921 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 3.8 p30 -65.88 133.42 94.92 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 105.545 -2.02 . . . . 15.0 105.545 173.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.977 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 Cg_endo -90.54 58.4 1.42 Allowed 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.79 2.327 . . . . 15.0 113.062 -175.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.925 ' HE ' ' N ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -52.14 -20.61 2.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.449 -0.341 . . . . 15.0 111.253 -179.728 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.786 ' H ' ' HE ' ' A' ' 36' ' ' ARG . 81.5 p . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.26 -0.876 . . . . 15.0 110.904 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.543 ' O ' ' HB3' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.546 -0.222 . . . . 15.0 112.546 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 1' ' ' GLY . . . 74.43 -88.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.769 0.319 . . . . 15.0 111.364 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.558 ' N ' ' SD ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -129.53 -170.17 2.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 15.0 110.907 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.442 ' O ' ' C ' ' A' ' 5' ' ' PRO . . . 89.78 -162.36 30.14 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.635 -0.793 . . . . 15.0 112.276 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.787 ' C ' HD12 ' A' ' 6' ' ' LEU . 90.9 Cg_exo -29.59 138.68 0.03 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.099 2.533 . . . . 15.0 112.223 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 1.031 HD23 ' O ' ' A' ' 10' ' ' TRP . 0.0 OUTLIER 54.3 70.14 1.83 Allowed Pre-proline 0 CA--C 1.501 -0.908 0 CA-C-N 114.529 -1.214 . . . . 15.0 110.604 -179.855 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.948 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 32.0 Cg_exo -61.28 -53.99 2.07 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 122.532 2.155 . . . . 15.0 108.872 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 1.01 ' HG2' ' NE1' ' A' ' 10' ' ' TRP . 2.8 Cg_endo -90.55 -170.57 0.39 Allowed 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 125.229 3.952 . . . . 15.0 109.611 174.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.414 ' C ' ' CD1' ' A' ' 10' ' ' TRP . . . -68.33 93.2 0.28 Allowed Glycine 0 CA--C 1.519 0.296 0 N-CA-C 109.443 -1.463 . . . . 15.0 109.443 177.041 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 1.031 ' O ' HD23 ' A' ' 6' ' ' LEU . 36.5 m95 -129.74 148.24 51.6 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 115.079 1.511 . . . . 15.0 115.079 -175.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.67 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -101.56 89.74 3.82 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 106.025 -1.842 . . . . 15.0 106.025 175.53 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 1.131 ' HD2' ' CE2' ' A' ' 22' ' ' PHE . 10.1 mtpp -110.04 155.3 22.03 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 114.735 1.383 . . . . 15.0 114.735 -174.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.787 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 9.7 ttp180 -150.38 147.05 27.11 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 112.729 -2.032 . . . . 15.0 112.05 -178.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.553 HG23 ' O ' ' A' ' 14' ' ' THR . 4.9 t -132.61 95.16 3.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.343 -0.844 . . . . 15.0 110.792 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.856 ' O ' ' N ' ' A' ' 18' ' ' GLY . 19.4 t70 -111.28 150.95 28.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.886 -0.597 . . . . 15.0 110.483 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . 1.093 ' C ' ' N ' ' A' ' 18' ' ' GLY . 70.4 p -45.28 -18.76 0.03 OUTLIER 'General case' 0 CA--C 1.49 -1.332 0 CA-C-O 118.744 -0.646 . . . . 15.0 111.413 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.747 ' C ' ' O ' ' A' ' 16' ' ' SER . 74.4 m-20 -39.89 -17.13 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.234 1 N-CA-C 96.497 -5.371 . . . . 15.0 96.497 169.451 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 1.093 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.36 55.56 15.93 Favored Glycine 0 N--CA 1.43 -1.752 1 CA-C-N 107.665 -4.334 . . . . 15.0 111.992 176.541 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -137.65 150.67 47.56 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 112.301 -1.949 . . . . 15.0 109.648 179.34 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.689 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 4.2 t -99.1 95.95 4.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.557 -0.534 . . . . 15.0 109.557 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.811 ' HA ' ' HA ' ' A' ' 32' ' ' TRP . 0.1 OUTLIER -101.13 150.76 22.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.198 0.523 . . . . 15.0 112.329 -177.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 1.131 ' CE2' ' HD2' ' A' ' 12' ' ' LYS . 5.0 m-85 -124.92 134.32 52.71 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.479 -0.782 . . . . 15.0 112.287 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.737 HG23 ' CE1' ' A' ' 21' ' ' TYR . 13.5 t -122.5 89.27 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 115.546 -0.752 . . . . 15.0 109.681 178.188 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.765 ' O ' ' O ' ' A' ' 29' ' ' ILE . 9.3 t-20 -133.8 134.79 43.29 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 108.631 -0.877 . . . . 15.0 108.631 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.787 ' HB2' ' HA ' ' A' ' 28' ' ' ARG . 10.6 p80 -151.87 88.82 1.42 Allowed 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 118.161 -1.416 . . . . 15.0 114.275 -178.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.442 ' C ' ' O ' ' A' ' 25' ' ' HIS . 44.9 t30 -50.62 -60.41 3.06 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 102.767 -3.049 . . . . 15.0 102.767 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.857 HG22 ' NE ' ' A' ' 28' ' ' ARG . 15.5 m -92.84 -81.94 0.34 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.882 -1.508 . . . . 15.0 106.999 173.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.857 ' NE ' HG22 ' A' ' 27' ' ' THR . 0.0 OUTLIER -154.71 100.41 2.23 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.815 -0.63 . . . . 15.0 111.672 177.135 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.826 HD13 ' N ' ' A' ' 30' ' ' TPO . 0.0 OUTLIER -146.96 138.45 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-N 119.538 1.063 . . . . 15.0 112.627 178.818 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TPO . . . . . 0.826 ' N ' HD13 ' A' ' 29' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.876 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 17.9 pt20 -150.32 150.05 30.94 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.483 -0.78 . . . . 15.0 109.256 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.811 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -91.67 78.23 5.54 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 117.67 -1.612 . . . . 15.0 109.366 178.808 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.771 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 8.0 tt0 -159.66 151.77 20.75 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 113.162 0.801 . . . . 15.0 113.162 176.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.808 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 5.0 p-10 -65.39 132.95 95.28 Favored Pre-proline 0 C--N 1.331 -0.224 0 N-CA-C 104.517 -2.401 . . . . 15.0 104.517 172.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.98 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 3.2 Cg_exo -88.66 29.12 0.45 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.048 1.832 . . . . 15.0 113.244 -174.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.601 ' O ' ' HB2' ' A' ' 37' ' ' SER . 4.3 ptp180 45.63 17.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.059 -0.519 . . . . 15.0 110.864 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.658 ' HA ' ' HG3' ' A' ' 8' ' ' PRO . 50.0 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.177 -0.916 . . . . 15.0 110.815 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 1.1 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.51 -0.589 0 CA-C-O 121.736 0.779 . . . . 15.0 110.915 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.941 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 14.8 Cg_exo -72.92 -60.42 0.05 OUTLIER 'Trans proline' 0 C--N 1.319 -0.977 0 C-N-CA 123.564 2.843 . . . . 15.0 113.066 -179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.952 ' HB2' ' HE1' ' A' ' 10' ' ' TRP . 1.4 Cg_endo -81.48 53.44 4.69 Favored 'Trans proline' 0 C--N 1.321 -0.877 0 C-N-CA 124.391 3.394 . . . . 15.0 112.767 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 51.32 65.39 3.16 Favored Glycine 0 C--O 1.23 -0.107 0 N-CA-C 109.164 -1.574 . . . . 15.0 109.164 -177.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.962 ' HB3' ' CD ' ' A' ' 12' ' ' LYS . 12.7 m95 -116.49 151.91 35.14 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.011 1.115 . . . . 15.0 114.011 -175.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.995 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -98.46 94.12 6.54 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.203 -1.036 . . . . 15.0 108.203 176.415 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 1.1 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -118.07 150.91 38.53 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.364 -0.835 . . . . 15.0 110.26 -178.713 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.669 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 1.5 ptm85 -149.41 147.82 28.73 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.496 -0.775 . . . . 15.0 111.019 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.5 m -118.21 94.4 4.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.033 -0.53 . . . . 15.0 112.047 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.869 ' O ' ' N ' ' A' ' 18' ' ' GLY . 8.7 t70 -89.51 147.66 23.85 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.638 -0.875 . . . . 15.0 108.638 178.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 1.087 ' C ' ' N ' ' A' ' 18' ' ' GLY . 68.9 p -47.93 -19.19 0.22 Allowed 'General case' 0 CA--C 1.493 -1.244 0 CA-C-O 118.667 -0.682 . . . . 15.0 112.083 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.723 ' C ' ' O ' ' A' ' 16' ' ' SER . 47.2 t30 -41.12 -16.98 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.235 1 N-CA-C 96.475 -5.38 . . . . 15.0 96.475 169.439 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 1.087 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 52.01 58.5 10.45 Favored Glycine 0 N--CA 1.431 -1.65 1 CA-C-N 107.554 -4.384 . . . . 15.0 112.331 176.428 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 8.7 tpp180 -138.25 151.57 47.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 112.357 -1.922 . . . . 15.0 109.958 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.804 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 38.1 t -97.06 115.13 35.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.155 -0.475 . . . . 15.0 110.62 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.857 ' HE1' ' HB ' ' A' ' 23' ' ' VAL . 0.1 OUTLIER -115.82 152.06 34.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.32 -0.4 . . . . 15.0 111.937 -178.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.906 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 5.2 m-85 -126.51 121.26 31.81 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.769 -0.651 . . . . 15.0 112.411 -177.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.995 HG12 ' O ' ' A' ' 11' ' ' GLU . 11.0 p -112.74 97.76 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 109.281 -0.636 . . . . 15.0 109.281 177.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.519 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 2.9 t-20 -103.27 122.24 44.37 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 107.708 -1.219 . . . . 15.0 107.708 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.59 ' CD2' ' H ' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -117.0 83.75 2.03 Favored 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 118.32 -1.352 . . . . 15.0 113.66 -177.4 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.472 ' OD1' HG12 ' A' ' 29' ' ' ILE . 1.2 p30 -94.19 -81.82 0.37 Allowed 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 104.507 -2.405 . . . . 15.0 104.507 172.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.982 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -93.57 -78.02 0.44 Allowed 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 106.826 -1.546 . . . . 15.0 106.826 173.099 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.982 ' H ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -152.42 89.6 1.43 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 114.803 -1.09 . . . . 15.0 110.084 177.073 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.809 HD11 ' NH2' ' A' ' 28' ' ' ARG . 47.0 mm . . . . . 0 N--CA 1.467 0.414 0 N-CA-C 112.834 0.679 . . . . 15.0 112.834 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.762 HE21 ' C ' ' A' ' 31' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.396 0 N-CA-C 109.86 -0.422 . . . . 15.0 109.86 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.804 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 1.7 m95 -96.56 78.58 2.98 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 118.345 -1.342 . . . . 15.0 110.179 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.844 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 3.5 tt0 -159.57 151.65 20.75 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 113.572 0.953 . . . . 15.0 113.572 176.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.906 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 7.0 t0 -66.55 131.52 94.14 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 105.228 -2.138 . . . . 15.0 105.228 173.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.928 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 Cg_endo . . . . . 0 N--CA 1.459 -0.555 0 C-N-CA 122.307 2.005 . . . . 15.0 112.825 -175.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 1.081 HD23 ' CD ' ' A' ' 12' ' ' LYS . 1.6 pp . . . . . 0 CA--C 1.517 -0.293 0 N-CA-C 115.174 1.546 . . . . 15.0 115.174 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 1.002 ' CD ' ' HD3' ' A' ' 8' ' ' PRO . 33.6 Cg_exo -71.96 -51.31 0.23 Allowed 'Trans proline' 0 C--N 1.326 -0.628 0 C-N-CA 123.391 2.727 . . . . 15.0 112.356 174.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 1.002 ' HD3' ' CD ' ' A' ' 7' ' ' PRO . 1.9 Cg_endo -82.09 -174.83 2.26 Favored 'Trans proline' 0 C--N 1.326 -0.618 0 C-N-CA 125.109 3.873 . . . . 15.0 113.071 -179.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.96 90.39 0.25 Allowed Glycine 0 C--N 1.337 0.63 0 N-CA-C 109.688 -1.365 . . . . 15.0 109.688 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 1.012 ' CE2' ' HG2' ' A' ' 35' ' ' PRO . 32.4 m95 -133.74 152.93 52.01 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 113.571 0.952 . . . . 15.0 113.571 -176.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.725 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -99.94 89.6 4.12 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.85 -1.167 . . . . 15.0 107.85 175.032 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 1.081 ' CD ' HD23 ' A' ' 6' ' ' LEU . 0.1 OUTLIER -110.36 150.52 28.67 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.003 -0.544 . . . . 15.0 110.177 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.673 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 28.9 ttm180 -146.84 150.55 35.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.803 -0.635 . . . . 15.0 112.165 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.7 p -124.54 89.61 3.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.333 -0.849 . . . . 15.0 110.802 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.848 ' O ' ' N ' ' A' ' 18' ' ' GLY . 11.4 t70 -103.4 150.74 23.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.877 -0.601 . . . . 15.0 109.882 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 1.044 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.2 t -48.69 -19.3 0.34 Allowed 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 118.853 -0.594 . . . . 15.0 111.395 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.753 ' C ' ' O ' ' A' ' 16' ' ' SER . 42.3 m-80 -40.31 -17.07 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.249 1 N-CA-C 96.437 -5.394 . . . . 15.0 96.437 169.625 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 1.044 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.68 57.32 10.91 Favored Glycine 0 N--CA 1.429 -1.783 1 CA-C-N 107.575 -4.375 . . . . 15.0 112.117 176.321 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.467 ' HB3' ' CZ3' ' A' ' 32' ' ' TRP . 0.0 OUTLIER -140.03 148.03 41.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 112.478 -1.861 . . . . 15.0 110.28 179.553 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.802 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 25.4 m -96.1 96.51 5.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.551 -0.537 . . . . 15.0 109.551 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.799 ' HB3' ' CE3' ' A' ' 32' ' ' TRP . 0.9 OUTLIER -107.81 151.08 26.21 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.719 0.637 . . . . 15.0 112.719 -177.518 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.911 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 6.6 m-85 -122.2 129.37 52.21 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.452 -0.795 . . . . 15.0 111.466 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.745 ' H ' ' HE3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -125.43 94.58 2.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.476 0.655 . . . . 15.0 110.756 178.11 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.632 ' ND2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 m-20 -109.51 135.29 50.75 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 115.037 -0.983 . . . . 15.0 108.394 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.8 m-70 -118.76 84.08 2.13 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 118.51 -1.276 . . . . 15.0 112.98 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -93.32 -81.16 0.37 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 104.056 -2.572 . . . . 15.0 104.056 172.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 1.067 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.8 OUTLIER -93.18 -79.96 0.39 Allowed 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.409 -1.7 . . . . 15.0 106.409 172.762 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 1.067 ' H ' HG23 ' A' ' 27' ' ' THR . 16.3 ptm180 -152.86 89.82 1.42 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.757 -1.111 . . . . 15.0 109.527 176.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.554 HD13 ' O ' ' A' ' 28' ' ' ARG . 51.2 mm . . . . . 0 N--CA 1.466 0.327 0 N-CA-C 113.362 0.875 . . . . 15.0 113.362 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.794 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.514 0 N-CA-C 109.593 -0.521 . . . . 15.0 109.593 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.802 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -91.96 78.91 5.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 118.246 -1.382 . . . . 15.0 109.586 179.279 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.787 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 7.3 tt0 -159.36 151.95 21.5 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 113.457 0.91 . . . . 15.0 113.457 177.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.787 ' N ' ' HG2' ' A' ' 33' ' ' GLU . 5.4 p-10 -69.93 138.08 87.61 Favored Pre-proline 0 C--N 1.331 -0.217 0 N-CA-C 104.996 -2.224 . . . . 15.0 104.996 172.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 1.012 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.7 Cg_endo . . . . . 0 N--CA 1.456 -0.732 0 C-N-CA 122.603 2.202 . . . . 15.0 112.701 -175.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 1.1 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.511 -0.551 0 CA-C-O 121.397 0.618 . . . . 15.0 111.449 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.996 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 36.1 Cg_exo -65.67 -57.78 0.23 Allowed 'Trans proline' 0 C--N 1.322 -0.837 0 C-N-CA 122.839 2.359 . . . . 15.0 110.032 178.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.996 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.3 Cg_endo -85.95 -176.17 2.08 Favored 'Trans proline' 0 C--N 1.32 -0.947 0 C-N-CA 124.998 3.798 . . . . 15.0 109.423 176.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.42 ' O ' ' ND2' ' A' ' 24' ' ' ASN . . . -59.75 83.27 0.01 OUTLIER Glycine 0 CA--C 1.517 0.165 0 N-CA-C 109.373 -1.491 . . . . 15.0 109.373 176.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.994 ' HB3' ' HZ2' ' A' ' 12' ' ' LYS . 26.3 m95 -128.35 150.47 50.07 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 114.054 1.131 . . . . 15.0 114.054 -176.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.843 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.4 OUTLIER -110.77 88.7 2.84 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 107.966 -1.124 . . . . 15.0 107.966 176.454 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 1.1 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -105.21 150.46 25.08 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.686 -0.688 . . . . 15.0 109.875 -178.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -150.47 150.42 31.29 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.716 -0.674 . . . . 15.0 111.967 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.663 HG23 ' O ' ' A' ' 14' ' ' THR . 10.2 t -118.28 89.48 3.13 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.686 -0.688 . . . . 15.0 111.068 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.912 ' O ' ' N ' ' A' ' 18' ' ' GLY . 14.4 t70 -94.22 150.58 20.17 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 109.086 -0.709 . . . . 15.0 109.086 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 1.093 ' C ' ' N ' ' A' ' 18' ' ' GLY . 67.2 p -44.39 -18.99 0.02 OUTLIER 'General case' 0 CA--C 1.492 -1.27 0 CA-C-O 118.612 -0.708 . . . . 15.0 111.676 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.722 ' C ' ' O ' ' A' ' 16' ' ' SER . 13.9 m120 -41.33 -16.92 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.252 1 N-CA-C 96.552 -5.351 . . . . 15.0 96.552 169.524 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 1.093 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 51.39 58.72 9.38 Favored Glycine 0 N--CA 1.429 -1.806 1 CA-C-N 107.492 -4.413 . . . . 15.0 112.366 176.498 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 19' ' ' ARG . 1.3 tpp180 -150.18 151.81 33.67 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 112.429 -1.886 . . . . 15.0 110.252 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.773 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 34.0 m -97.97 100.66 11.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.704 -0.68 . . . . 15.0 110.295 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.878 ' HE1' ' HB ' ' A' ' 23' ' ' VAL . 0.1 OUTLIER -107.03 151.7 24.99 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.321 0.489 . . . . 15.0 112.321 -178.35 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.858 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 4.9 m-85 -114.42 120.65 41.03 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 112.658 0.614 . . . . 15.0 112.658 -178.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.878 ' HB ' ' HE1' ' A' ' 21' ' ' TYR . 7.1 p -114.56 96.65 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 115.68 -0.691 . . . . 15.0 109.413 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.621 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 26.6 t-20 -122.2 136.59 54.93 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.338 -0.846 . . . . 15.0 108.805 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.438 ' NE2' ' CG2' ' A' ' 23' ' ' VAL . 53.3 m-70 -126.41 84.46 2.27 Favored 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 118.49 -1.284 . . . . 15.0 113.242 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -93.33 -80.43 0.38 Allowed 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 103.836 -2.653 . . . . 15.0 103.836 172.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 52.3 p -92.98 -80.6 0.37 Allowed 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 106.235 -1.765 . . . . 15.0 106.235 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -153.59 90.1 1.38 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 114.885 -1.052 . . . . 15.0 110.343 176.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.577 HG23 ' O ' ' A' ' 24' ' ' ASN . 7.0 tp . . . . . 0 N--CA 1.469 0.482 0 CA-C-N 118.911 0.778 . . . . 15.0 112.775 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.809 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 15.8 pt20 . . . . . 0 CA--C 1.513 -0.455 0 N-CA-C 109.702 -0.481 . . . . 15.0 109.702 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.773 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -91.71 77.47 5.59 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 117.619 -1.632 . . . . 15.0 108.791 178.481 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.74 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 7.5 tt0 -160.19 152.27 20.41 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 113.047 0.758 . . . . 15.0 113.047 177.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.782 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 5.0 p-10 -63.79 134.37 95.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 105.36 -2.089 . . . . 15.0 105.36 173.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.952 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 2.2 Cg_endo . . . . . 0 N--CA 1.461 -0.43 0 C-N-CA 122.719 2.279 . . . . 15.0 113.346 -175.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 1.043 HD23 ' O ' ' A' ' 10' ' ' TRP . 0.2 OUTLIER . . . . . 0 CA--C 1.51 -0.558 0 CA-C-O 121.534 0.683 . . . . 15.0 109.978 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.963 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 38.4 Cg_exo -63.59 -57.73 0.35 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.97 2.447 . . . . 15.0 110.923 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.963 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.9 Cg_endo -87.93 -177.25 1.88 Allowed 'Trans proline' 0 C--N 1.315 -1.225 0 C-N-CA 124.91 3.74 . . . . 15.0 109.481 176.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.415 ' C ' ' CD1' ' A' ' 10' ' ' TRP . . . -60.78 88.82 0.04 OUTLIER Glycine 0 CA--C 1.517 0.192 0 N-CA-C 108.968 -1.653 . . . . 15.0 108.968 176.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 1.043 ' O ' HD23 ' A' ' 6' ' ' LEU . 27.4 m95 -130.73 150.76 51.76 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 114.349 1.24 . . . . 15.0 114.349 -175.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.675 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -111.17 89.35 3.02 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 107.678 -1.23 . . . . 15.0 107.678 176.097 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.965 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -108.38 150.24 27.63 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.856 -0.611 . . . . 15.0 111.121 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.565 ' HD3' ' HE2' ' A' ' 21' ' ' TYR . 12.3 ptm180 -147.49 147.88 30.64 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.319 -0.855 . . . . 15.0 110.9 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.703 HG22 HG12 ' A' ' 20' ' ' VAL . 67.9 p -123.63 89.44 3.09 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.727 -0.67 . . . . 15.0 110.616 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.825 ' O ' ' N ' ' A' ' 18' ' ' GLY . 12.8 t70 -91.53 150.61 21.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.534 -0.757 . . . . 15.0 109.852 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 1.115 ' C ' ' N ' ' A' ' 18' ' ' GLY . 7.8 t -50.37 -19.2 0.77 Allowed 'General case' 0 CA--C 1.489 -1.393 0 CA-C-O 118.838 -0.601 . . . . 15.0 111.265 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.73 ' C ' ' O ' ' A' ' 16' ' ' SER . 46.7 m-80 -40.39 -17.28 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.232 1 N-CA-C 96.507 -5.368 . . . . 15.0 96.507 169.529 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 1.115 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 53.12 57.98 13.21 Favored Glycine 0 N--CA 1.43 -1.734 1 CA-C-N 107.335 -4.484 . . . . 15.0 112.612 176.222 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.38 148.91 43.49 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 112.474 -1.863 . . . . 15.0 109.841 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.748 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 34.3 m -100.83 106.33 19.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.497 -0.319 . . . . 15.0 110.171 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.77 ' HE1' HG13 ' A' ' 23' ' ' VAL . 0.4 OUTLIER -119.16 150.77 39.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.12 0.486 . . . . 15.0 112.084 -178.558 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.916 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 3.8 m-85 -119.16 133.73 55.61 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.55 -0.75 . . . . 15.0 111.781 -177.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.77 HG13 ' HE1' ' A' ' 21' ' ' TYR . 1.3 m -122.58 102.13 11.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.243 0.544 . . . . 15.0 110.255 177.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.629 ' OD1' ' HB ' ' A' ' 29' ' ' ILE . 5.4 p30 -111.36 121.55 45.53 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.208 -0.906 . . . . 15.0 108.848 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -117.05 84.51 2.16 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 119.132 -1.027 . . . . 15.0 112.855 -178.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.661 ' CG ' ' H ' ' A' ' 27' ' ' THR . 1.8 p30 -92.55 -80.31 0.37 Allowed 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 103.622 -2.732 . . . . 15.0 103.622 172.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.748 HG22 ' HD2' ' A' ' 28' ' ' ARG . 96.9 m -92.84 -81.0 0.36 Allowed 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 106.336 -1.728 . . . . 15.0 106.336 172.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.748 ' HD2' HG22 ' A' ' 27' ' ' THR . 1.1 ptm180 -154.0 90.02 1.34 Allowed 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 114.927 -1.033 . . . . 15.0 110.441 176.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.654 HD13 ' O ' ' A' ' 28' ' ' ARG . 47.3 mm . . . . . 0 N--CA 1.467 0.421 0 N-CA-C 113.635 0.976 . . . . 15.0 113.635 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.812 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.482 0 N-CA-C 109.67 -0.493 . . . . 15.0 109.67 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.748 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -93.83 77.54 4.21 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 117.822 -1.551 . . . . 15.0 109.661 178.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.798 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 5.3 tt0 -160.68 151.81 18.98 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.436 0.902 . . . . 15.0 113.436 176.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.916 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 1.6 p-10 -66.71 133.2 94.1 Favored Pre-proline 0 C--N 1.33 -0.251 0 N-CA-C 105.068 -2.197 . . . . 15.0 105.068 172.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.928 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 2.4 Cg_endo . . . . . 0 N--CA 1.454 -0.805 0 C-N-CA 122.793 2.329 . . . . 15.0 113.325 -175.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 1.052 ' N ' HD13 ' A' ' 6' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.506 0 CA-C-O 121.719 0.771 . . . . 15.0 111.179 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.941 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 21.9 Cg_exo -69.56 -59.42 0.09 OUTLIER 'Trans proline' 0 C--N 1.322 -0.842 0 C-N-CA 123.708 2.939 . . . . 15.0 111.872 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.941 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -81.92 176.49 8.26 Favored 'Trans proline' 0 C--N 1.32 -0.964 0 C-N-CA 124.317 3.345 . . . . 15.0 110.334 178.124 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.62 80.12 0.01 OUTLIER Glycine 0 C--N 1.33 0.235 0 C-N-CA 119.396 -1.383 . . . . 15.0 109.834 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 1.03 ' HB3' ' HZ2' ' A' ' 12' ' ' LYS . 23.3 m95 -118.77 149.02 42.18 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.796 1.036 . . . . 15.0 113.796 -176.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.406 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 43.0 tt0 -104.29 88.1 2.9 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.333 -0.988 . . . . 15.0 108.333 177.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 1.049 ' HG2' HD12 ' A' ' 6' ' ' LEU . 0.1 OUTLIER -106.48 151.27 25.18 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.35 -0.841 . . . . 15.0 110.117 -179.469 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.816 ' HD3' ' H ' ' A' ' 14' ' ' THR . 12.1 tpp180 -143.12 143.55 31.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.563 -0.744 . . . . 15.0 111.753 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.816 ' H ' ' HD3' ' A' ' 13' ' ' ARG . 72.3 p -118.12 89.39 3.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.401 -0.818 . . . . 15.0 110.686 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.892 ' O ' ' N ' ' A' ' 18' ' ' GLY . 18.6 t70 -106.77 150.66 26.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.686 -0.688 . . . . 15.0 109.432 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 1.141 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.2 t -44.1 -19.06 0.02 OUTLIER 'General case' 0 CA--C 1.489 -1.367 0 CA-C-O 118.976 -0.535 . . . . 15.0 111.355 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.721 ' C ' ' O ' ' A' ' 16' ' ' SER . 2.6 t-20 -40.86 -16.89 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.254 1 N-CA-C 96.388 -5.412 . . . . 15.0 96.388 169.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 1.141 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.0 58.5 8.55 Favored Glycine 0 N--CA 1.429 -1.778 1 CA-C-N 107.522 -4.399 . . . . 15.0 112.38 176.321 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.42 ' HB3' ' CZ3' ' A' ' 32' ' ' TRP . 5.1 tpp85 -146.62 151.32 37.09 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 112.395 -1.903 . . . . 15.0 110.408 179.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.708 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 13.3 m -99.08 90.39 2.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.682 -0.69 . . . . 15.0 109.78 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.799 ' CE2' ' HB3' ' A' ' 13' ' ' ARG . 1.3 p90 -95.91 151.11 19.72 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.745 0.646 . . . . 15.0 112.745 -177.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.848 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 10.7 m-85 -120.63 125.55 48.01 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.687 -0.688 . . . . 15.0 111.839 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.818 ' H ' ' HE3' ' A' ' 12' ' ' LYS . 3.5 t -118.55 89.84 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 115.651 -0.704 . . . . 15.0 110.288 178.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.846 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 3.4 t-20 -111.45 125.57 54.03 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 108.191 -1.04 . . . . 15.0 108.191 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.755 ' NE2' HG13 ' A' ' 23' ' ' VAL . 55.2 m-70 -116.62 83.46 1.97 Allowed 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 118.36 -1.336 . . . . 15.0 113.289 -178.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.584 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.8 OUTLIER -94.3 -81.09 0.39 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 104.331 -2.47 . . . . 15.0 104.331 172.315 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.955 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -93.05 -79.74 0.39 Allowed 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.065 -1.457 . . . . 15.0 107.065 173.375 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.955 ' H ' HG23 ' A' ' 27' ' ' THR . 0.4 OUTLIER -152.47 89.82 1.45 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.836 -1.075 . . . . 15.0 110.039 177.423 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.485 HG21 ' HH2' ' A' ' 10' ' ' TRP . 51.2 mt . . . . . 0 N--CA 1.464 0.269 0 N-CA-C 113.083 0.772 . . . . 15.0 113.083 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.722 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 3.6 pt20 . . . . . 0 CA--C 1.509 -0.6 0 N-CA-C 108.816 -0.809 . . . . 15.0 108.816 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.794 ' CE3' ' HB3' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -89.72 77.33 7.12 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 117.516 -1.673 . . . . 15.0 108.919 179.259 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.708 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 5.0 tt0 -160.54 152.16 19.66 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 113.218 0.822 . . . . 15.0 113.218 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.731 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -65.05 137.99 97.28 Favored Pre-proline 0 C--N 1.329 -0.319 0 N-CA-C 105.295 -2.113 . . . . 15.0 105.295 173.06 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 1.013 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 3.2 Cg_endo . . . . . 0 N--CA 1.454 -0.809 0 C-N-CA 123.189 2.593 . . . . 15.0 113.385 -175.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 1.092 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.51 -0.585 0 CA-C-O 121.611 0.719 . . . . 15.0 111.5 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.959 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 14.2 Cg_exo -73.16 -60.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.32 -0.931 0 C-N-CA 123.299 2.666 . . . . 15.0 112.881 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.959 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.3 Cg_endo -80.7 53.59 4.84 Favored 'Trans proline' 0 C--N 1.322 -0.838 0 C-N-CA 124.667 3.578 . . . . 15.0 112.745 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 49.59 63.73 3.91 Favored Glycine 0 C--O 1.23 -0.095 0 N-CA-C 109.217 -1.553 . . . . 15.0 109.217 -177.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.999 ' HB3' ' HZ2' ' A' ' 12' ' ' LYS . 10.5 m95 -112.58 151.43 30.06 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.688 0.996 . . . . 15.0 113.688 -175.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.848 ' HB3' HG12 ' A' ' 23' ' ' VAL . 32.1 tt0 -96.63 88.92 4.79 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.474 -0.936 . . . . 15.0 108.474 176.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 1.092 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -114.23 151.35 32.93 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.598 -0.728 . . . . 15.0 110.677 -178.941 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.737 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 10.2 ptm180 -147.63 149.18 32.02 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.46 -0.791 . . . . 15.0 110.996 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.744 HG22 HG12 ' A' ' 20' ' ' VAL . 74.7 p -119.0 89.57 3.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.848 -0.615 . . . . 15.0 111.088 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.854 ' O ' ' N ' ' A' ' 18' ' ' GLY . 16.9 t70 -92.3 150.57 20.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.609 -0.723 . . . . 15.0 109.432 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 1.12 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.1 t -50.48 -19.25 0.82 Allowed 'General case' 0 CA--C 1.489 -1.376 0 CA-C-O 119.018 -0.515 . . . . 15.0 111.48 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.713 ' C ' ' O ' ' A' ' 16' ' ' SER . 2.7 t-20 -40.91 -17.06 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.205 1 N-CA-C 96.331 -5.433 . . . . 15.0 96.331 169.575 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 1.12 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 52.67 59.29 9.39 Favored Glycine 0 N--CA 1.431 -1.661 1 CA-C-N 107.458 -4.428 . . . . 15.0 112.553 176.181 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.434 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 8.3 tpt180 -141.86 151.21 42.5 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 112.418 -1.891 . . . . 15.0 109.859 179.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.744 HG12 HG22 ' A' ' 14' ' ' THR . 35.6 m -101.25 94.74 3.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.028 -0.533 . . . . 15.0 110.266 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.843 ' HE1' HG23 ' A' ' 23' ' ' VAL . 0.1 OUTLIER -100.69 151.08 22.07 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.203 0.445 . . . . 15.0 112.203 -178.319 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.921 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 4.6 m-85 -118.5 121.63 40.74 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 113.03 0.752 . . . . 15.0 113.03 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.848 HG12 ' HB3' ' A' ' 11' ' ' GLU . 1.0 OUTLIER -107.86 89.74 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 115.483 -0.781 . . . . 15.0 108.981 177.583 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.852 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 3.2 t-20 -110.79 122.53 48.05 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.495 -0.928 . . . . 15.0 108.495 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.558 ' CD2' HG13 ' A' ' 23' ' ' VAL . 29.4 m-70 -120.88 83.4 2.06 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 118.047 -1.461 . . . . 15.0 113.58 -178.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.728 HD21 HG13 ' A' ' 29' ' ' ILE . 2.4 p30 -94.7 -80.96 0.4 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.585 -2.376 . . . . 15.0 104.585 172.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.714 ' H ' ' CG ' ' A' ' 26' ' ' ASN . 93.6 m -93.38 -77.7 0.44 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.078 -1.419 . . . . 15.0 107.246 173.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 28' ' ' ARG . 8.8 tpt180 -152.1 90.06 1.49 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.643 -1.162 . . . . 15.0 110.105 177.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.728 HG13 HD21 ' A' ' 26' ' ' ASN . 38.5 mm . . . . . 0 N--CA 1.466 0.365 0 N-CA-C 112.93 0.715 . . . . 15.0 112.93 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.773 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.514 -0.42 0 N-CA-C 109.351 -0.611 . . . . 15.0 109.351 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.762 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -92.7 78.26 4.85 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 117.752 -1.579 . . . . 15.0 109.238 179.069 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.792 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 3.7 tt0 -160.14 151.8 19.92 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 113.032 0.753 . . . . 15.0 113.032 177.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.921 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 3.8 p30 -65.88 133.42 94.92 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 105.545 -2.02 . . . . 15.0 105.545 173.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.977 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 Cg_endo . . . . . 0 N--CA 1.459 -0.55 0 C-N-CA 122.79 2.327 . . . . 15.0 113.062 -175.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 1.031 HD23 ' O ' ' A' ' 10' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.501 -0.908 0 CA-C-O 121.708 0.765 . . . . 15.0 110.604 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.948 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 32.0 Cg_exo -61.28 -53.99 2.07 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 122.532 2.155 . . . . 15.0 108.872 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 1.01 ' HG2' ' NE1' ' A' ' 10' ' ' TRP . 2.8 Cg_endo -90.55 -170.57 0.39 Allowed 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 125.229 3.952 . . . . 15.0 109.611 174.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.414 ' C ' ' CD1' ' A' ' 10' ' ' TRP . . . -68.33 93.2 0.28 Allowed Glycine 0 CA--C 1.519 0.296 0 N-CA-C 109.443 -1.463 . . . . 15.0 109.443 177.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 1.031 ' O ' HD23 ' A' ' 6' ' ' LEU . 36.5 m95 -129.74 148.24 51.6 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 115.079 1.511 . . . . 15.0 115.079 -175.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.67 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -101.56 89.74 3.82 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 106.025 -1.842 . . . . 15.0 106.025 175.53 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 1.131 ' HD2' ' CE2' ' A' ' 22' ' ' PHE . 10.1 mtpp -110.04 155.3 22.03 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 114.735 1.383 . . . . 15.0 114.735 -174.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.787 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 9.7 ttp180 -150.38 147.05 27.11 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 112.729 -2.032 . . . . 15.0 112.05 -178.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.553 HG23 ' O ' ' A' ' 14' ' ' THR . 4.9 t -132.61 95.16 3.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.343 -0.844 . . . . 15.0 110.792 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.856 ' O ' ' N ' ' A' ' 18' ' ' GLY . 19.4 t70 -111.28 150.95 28.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.886 -0.597 . . . . 15.0 110.483 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 1.093 ' C ' ' N ' ' A' ' 18' ' ' GLY . 70.4 p -45.28 -18.76 0.03 OUTLIER 'General case' 0 CA--C 1.49 -1.332 0 CA-C-O 118.744 -0.646 . . . . 15.0 111.413 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.747 ' C ' ' O ' ' A' ' 16' ' ' SER . 12.3 m120 -39.89 -17.13 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.234 1 N-CA-C 96.497 -5.371 . . . . 15.0 96.497 169.451 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 1.093 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.36 55.56 15.93 Favored Glycine 0 N--CA 1.43 -1.752 1 CA-C-N 107.665 -4.334 . . . . 15.0 111.992 176.541 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -137.65 150.67 47.56 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 112.301 -1.949 . . . . 15.0 109.648 179.34 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.689 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 4.2 t -99.1 95.95 4.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.557 -0.534 . . . . 15.0 109.557 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.811 ' HA ' ' HA ' ' A' ' 32' ' ' TRP . 0.1 OUTLIER -101.13 150.76 22.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.198 0.523 . . . . 15.0 112.329 -177.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 1.131 ' CE2' ' HD2' ' A' ' 12' ' ' LYS . 5.0 m-85 -124.92 134.32 52.71 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.479 -0.782 . . . . 15.0 112.287 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.737 HG23 ' CE1' ' A' ' 21' ' ' TYR . 13.5 t -122.5 89.27 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 115.546 -0.752 . . . . 15.0 109.681 178.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.765 ' O ' ' O ' ' A' ' 29' ' ' ILE . 9.3 t-20 -133.8 134.79 43.29 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 108.631 -0.877 . . . . 15.0 108.631 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.787 ' HB2' ' HA ' ' A' ' 28' ' ' ARG . 10.6 p80 -151.87 88.82 1.42 Allowed 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 118.161 -1.416 . . . . 15.0 114.275 -178.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.442 ' C ' ' O ' ' A' ' 25' ' ' HIS . 2.5 t-20 -50.62 -60.41 3.06 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 102.767 -3.049 . . . . 15.0 102.767 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.857 HG22 ' NE ' ' A' ' 28' ' ' ARG . 15.5 m -92.84 -81.94 0.34 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.882 -1.508 . . . . 15.0 106.999 173.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.857 ' NE ' HG22 ' A' ' 27' ' ' THR . 0.0 OUTLIER -154.71 100.41 2.23 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.815 -0.63 . . . . 15.0 111.672 177.135 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.765 ' O ' ' O ' ' A' ' 24' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.499 0 CA-C-N 119.538 1.063 . . . . 15.0 112.627 178.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.876 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 2.6 pt20 . . . . . 0 CA--C 1.511 -0.542 0 N-CA-C 109.256 -0.646 . . . . 15.0 109.256 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.811 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -91.67 78.23 5.54 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 117.67 -1.612 . . . . 15.0 109.366 178.808 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.771 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 8.0 tt0 -159.66 151.77 20.75 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 113.162 0.801 . . . . 15.0 113.162 176.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.808 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 5.0 p-10 -65.39 132.95 95.28 Favored Pre-proline 0 C--N 1.331 -0.224 0 N-CA-C 104.517 -2.401 . . . . 15.0 104.517 172.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.98 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 3.2 Cg_exo . . . . . 0 N--CA 1.457 -0.644 0 C-N-CA 122.048 1.832 . . . . 15.0 113.244 -174.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.525 ' HA2' ' O ' ' A' ' 5' ' ' PRO . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 112.446 -0.262 . . . . 15.0 112.446 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.642 ' C ' ' H ' ' A' ' 4' ' ' GLY . . . 60.79 -164.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.801 0.334 . . . . 15.0 111.026 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.757 ' HE2' ' N ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -63.0 15.81 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.305 -0.407 . . . . 15.0 110.776 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.642 ' H ' ' C ' ' A' ' 2' ' ' ALA . . . -127.94 -167.2 12.21 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.77 -0.728 . . . . 15.0 112.543 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.675 ' C ' HD12 ' A' ' 6' ' ' LEU . 63.2 Cg_exo -32.5 162.14 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.284 2.656 . . . . 15.0 112.993 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 1.1 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER 38.7 68.81 1.76 Allowed Pre-proline 0 CA--C 1.51 -0.589 0 CA-C-N 115.395 -0.82 . . . . 15.0 110.915 -179.527 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.941 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 14.8 Cg_exo -72.92 -60.42 0.05 OUTLIER 'Trans proline' 0 C--N 1.319 -0.977 0 C-N-CA 123.564 2.843 . . . . 15.0 113.066 -179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.952 ' HB2' ' HE1' ' A' ' 10' ' ' TRP . 1.4 Cg_endo -81.48 53.44 4.69 Favored 'Trans proline' 0 C--N 1.321 -0.877 0 C-N-CA 124.391 3.394 . . . . 15.0 112.767 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 51.32 65.39 3.16 Favored Glycine 0 C--O 1.23 -0.107 0 N-CA-C 109.164 -1.574 . . . . 15.0 109.164 -177.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.962 ' HB3' ' CD ' ' A' ' 12' ' ' LYS . 12.7 m95 -116.49 151.91 35.14 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.011 1.115 . . . . 15.0 114.011 -175.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.995 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -98.46 94.12 6.54 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.203 -1.036 . . . . 15.0 108.203 176.415 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 1.1 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -118.07 150.91 38.53 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.364 -0.835 . . . . 15.0 110.26 -178.713 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.669 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 1.5 ptm85 -149.41 147.82 28.73 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.496 -0.775 . . . . 15.0 111.019 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.5 m -118.21 94.4 4.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.033 -0.53 . . . . 15.0 112.047 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.869 ' O ' ' N ' ' A' ' 18' ' ' GLY . 8.7 t70 -89.51 147.66 23.85 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.638 -0.875 . . . . 15.0 108.638 178.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 1.087 ' C ' ' N ' ' A' ' 18' ' ' GLY . 68.9 p -47.93 -19.19 0.22 Allowed 'General case' 0 CA--C 1.493 -1.244 0 CA-C-O 118.667 -0.682 . . . . 15.0 112.083 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.723 ' C ' ' O ' ' A' ' 16' ' ' SER . 47.2 t30 -41.12 -16.98 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.235 1 N-CA-C 96.475 -5.38 . . . . 15.0 96.475 169.439 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 1.087 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 52.01 58.5 10.45 Favored Glycine 0 N--CA 1.431 -1.65 1 CA-C-N 107.554 -4.384 . . . . 15.0 112.331 176.428 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 8.7 tpp180 -138.25 151.57 47.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 112.357 -1.922 . . . . 15.0 109.958 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.804 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 38.1 t -97.06 115.13 35.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.155 -0.475 . . . . 15.0 110.62 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.857 ' HE1' ' HB ' ' A' ' 23' ' ' VAL . 0.1 OUTLIER -115.82 152.06 34.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.32 -0.4 . . . . 15.0 111.937 -178.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.906 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 5.2 m-85 -126.51 121.26 31.81 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.769 -0.651 . . . . 15.0 112.411 -177.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.995 HG12 ' O ' ' A' ' 11' ' ' GLU . 11.0 p -112.74 97.76 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 109.281 -0.636 . . . . 15.0 109.281 177.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.519 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 2.9 t-20 -103.27 122.24 44.37 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 107.708 -1.219 . . . . 15.0 107.708 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.59 ' H ' ' CD2' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -117.0 83.75 2.03 Favored 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 118.32 -1.352 . . . . 15.0 113.66 -177.4 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.472 ' OD1' HG12 ' A' ' 29' ' ' ILE . 1.2 p30 -94.19 -81.82 0.37 Allowed 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 104.507 -2.405 . . . . 15.0 104.507 172.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.982 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -93.57 -78.02 0.44 Allowed 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 106.826 -1.546 . . . . 15.0 106.826 173.099 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.982 ' H ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -152.42 89.6 1.43 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 114.803 -1.09 . . . . 15.0 110.084 177.073 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.809 HD11 ' NH2' ' A' ' 28' ' ' ARG . 47.0 mm -125.46 127.54 71.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.834 0.679 . . . . 15.0 112.834 -178.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.762 ' C ' HE21 ' A' ' 31' ' ' GLN . 0.0 OUTLIER -150.32 148.6 29.02 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.891 -0.595 . . . . 15.0 109.86 179.4 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.804 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 1.7 m95 -96.56 78.58 2.98 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 118.345 -1.342 . . . . 15.0 110.179 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.844 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 3.5 tt0 -159.57 151.65 20.75 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 113.572 0.953 . . . . 15.0 113.572 176.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.906 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 7.0 t0 -66.55 131.52 94.14 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 105.228 -2.138 . . . . 15.0 105.228 173.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.928 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 Cg_endo -90.43 7.12 3.83 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.307 2.005 . . . . 15.0 112.825 -175.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 1.008 ' HG2' ' H ' ' A' ' 37' ' ' SER . 0.0 OUTLIER 17.14 -99.51 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.881 -0.6 . . . . 15.0 111.427 -179.527 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 1.008 ' H ' ' HG2' ' A' ' 36' ' ' ARG . 50.3 m . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.27 -0.871 . . . . 15.0 110.797 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.586 ' O ' ' HB3' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.491 2.307 0 N-CA-C 112.573 -0.211 . . . . 15.0 112.573 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.586 ' HB3' ' O ' ' A' ' 1' ' ' GLY . . . 76.73 100.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.952 0.406 . . . . 15.0 111.291 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 1.01 ' HE2' ' H ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -154.37 108.8 3.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.946 -0.57 . . . . 15.0 110.411 179.761 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.445 ' O ' ' C ' ' A' ' 5' ' ' PRO . . . 132.35 -155.28 21.44 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.634 -0.793 . . . . 15.0 111.906 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.769 ' O ' HD12 ' A' ' 6' ' ' LEU . 56.8 Cg_exo -28.01 131.4 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.399 2.733 . . . . 15.0 112.082 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 1.081 HD23 ' CD ' ' A' ' 12' ' ' LYS . 1.6 pp 56.06 111.27 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 115.174 1.546 . . . . 15.0 115.174 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 1.002 ' CD ' ' HD3' ' A' ' 8' ' ' PRO . 33.6 Cg_exo -71.96 -51.31 0.23 Allowed 'Trans proline' 0 C--N 1.326 -0.628 0 C-N-CA 123.391 2.727 . . . . 15.0 112.356 174.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 1.002 ' HD3' ' CD ' ' A' ' 7' ' ' PRO . 1.9 Cg_endo -82.09 -174.83 2.26 Favored 'Trans proline' 0 C--N 1.326 -0.618 0 C-N-CA 125.109 3.873 . . . . 15.0 113.071 -179.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.96 90.39 0.25 Allowed Glycine 0 C--N 1.337 0.63 0 N-CA-C 109.688 -1.365 . . . . 15.0 109.688 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 1.012 ' CE2' ' HG2' ' A' ' 35' ' ' PRO . 32.4 m95 -133.74 152.93 52.01 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 113.571 0.952 . . . . 15.0 113.571 -176.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.725 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -99.94 89.6 4.12 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.85 -1.167 . . . . 15.0 107.85 175.032 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 1.081 ' CD ' HD23 ' A' ' 6' ' ' LEU . 0.1 OUTLIER -110.36 150.52 28.67 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.003 -0.544 . . . . 15.0 110.177 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.673 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 28.9 ttm180 -146.84 150.55 35.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.803 -0.635 . . . . 15.0 112.165 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.7 p -124.54 89.61 3.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.333 -0.849 . . . . 15.0 110.802 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.848 ' O ' ' N ' ' A' ' 18' ' ' GLY . 11.4 t70 -103.4 150.74 23.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.877 -0.601 . . . . 15.0 109.882 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 1.044 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.2 t -48.69 -19.3 0.34 Allowed 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 118.853 -0.594 . . . . 15.0 111.395 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.753 ' C ' ' O ' ' A' ' 16' ' ' SER . 42.3 m-80 -40.31 -17.07 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.249 1 N-CA-C 96.437 -5.394 . . . . 15.0 96.437 169.625 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 1.044 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.68 57.32 10.91 Favored Glycine 0 N--CA 1.429 -1.783 1 CA-C-N 107.575 -4.375 . . . . 15.0 112.117 176.321 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.467 ' HB3' ' CZ3' ' A' ' 32' ' ' TRP . 0.0 OUTLIER -140.03 148.03 41.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 112.478 -1.861 . . . . 15.0 110.28 179.553 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.802 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 25.4 m -96.1 96.51 5.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.551 -0.537 . . . . 15.0 109.551 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.799 ' HB3' ' CE3' ' A' ' 32' ' ' TRP . 0.9 OUTLIER -107.81 151.08 26.21 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.719 0.637 . . . . 15.0 112.719 -177.518 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.911 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 6.6 m-85 -122.2 129.37 52.21 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.452 -0.795 . . . . 15.0 111.466 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.749 HG12 HG22 ' A' ' 30' ' ' TPO . 0.2 OUTLIER -125.43 94.58 2.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.476 0.655 . . . . 15.0 110.756 178.11 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.632 ' ND2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 m-20 -109.51 135.29 50.75 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 115.037 -0.983 . . . . 15.0 108.394 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.8 m-70 -118.76 84.08 2.13 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 118.51 -1.276 . . . . 15.0 112.98 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -93.32 -81.16 0.37 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 104.056 -2.572 . . . . 15.0 104.056 172.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 1.067 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.8 OUTLIER -93.18 -79.96 0.39 Allowed 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.409 -1.7 . . . . 15.0 106.409 172.762 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 1.067 ' H ' HG23 ' A' ' 27' ' ' THR . 16.3 ptm180 -152.86 89.82 1.42 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.757 -1.111 . . . . 15.0 109.527 176.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.554 HD13 ' O ' ' A' ' 28' ' ' ARG . 51.2 mm -129.54 126.18 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 N-CA-C 113.362 0.875 . . . . 15.0 113.362 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TPO . . . . . 0.749 HG22 HG12 ' A' ' 23' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.794 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -131.29 148.9 52.73 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.593 -0.521 . . . . 15.0 109.593 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.802 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -91.96 78.91 5.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 118.246 -1.382 . . . . 15.0 109.586 179.279 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.787 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 7.3 tt0 -159.36 151.95 21.5 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 113.457 0.91 . . . . 15.0 113.457 177.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.787 ' N ' ' HG2' ' A' ' 33' ' ' GLU . 5.4 p-10 -69.93 138.08 87.61 Favored Pre-proline 0 C--N 1.331 -0.217 0 N-CA-C 104.996 -2.224 . . . . 15.0 104.996 172.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 1.012 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.7 Cg_endo -91.94 41.5 0.33 Allowed 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.603 2.202 . . . . 15.0 112.701 -175.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.756 ' HD2' ' N ' ' A' ' 37' ' ' SER . 1.3 ppt_? -35.7 -22.2 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.1 -0.5 . . . . 15.0 111.112 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.756 ' N ' ' HD2' ' A' ' 36' ' ' ARG . 81.0 p . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.285 -0.864 . . . . 15.0 110.873 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.467 ' HA3' ' SD ' ' A' ' 3' ' ' MET . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 112.487 -0.245 . . . . 15.0 112.487 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.29 5.52 2.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.826 0.345 . . . . 15.0 111.143 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.689 ' HE2' ' N ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -97.55 31.75 2.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.211 -0.449 . . . . 15.0 110.962 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.556 ' O ' ' O ' ' A' ' 5' ' ' PRO . . . 172.21 -158.67 29.32 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.784 -0.722 . . . . 15.0 112.4 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.716 ' C ' HD12 ' A' ' 6' ' ' LEU . 88.0 Cg_exo -30.15 161.32 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.473 2.782 . . . . 15.0 112.707 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 1.1 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER 44.62 74.26 0.83 Allowed Pre-proline 0 CA--C 1.511 -0.551 0 CA-C-N 115.247 -0.888 . . . . 15.0 111.449 -179.503 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.996 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 36.1 Cg_exo -65.67 -57.78 0.23 Allowed 'Trans proline' 0 C--N 1.322 -0.837 0 C-N-CA 122.839 2.359 . . . . 15.0 110.032 178.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.996 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.3 Cg_endo -85.95 -176.17 2.08 Favored 'Trans proline' 0 C--N 1.32 -0.947 0 C-N-CA 124.998 3.798 . . . . 15.0 109.423 176.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.42 ' O ' ' ND2' ' A' ' 24' ' ' ASN . . . -59.75 83.27 0.01 OUTLIER Glycine 0 CA--C 1.517 0.165 0 N-CA-C 109.373 -1.491 . . . . 15.0 109.373 176.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.994 ' HB3' ' HZ2' ' A' ' 12' ' ' LYS . 26.3 m95 -128.35 150.47 50.07 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 114.054 1.131 . . . . 15.0 114.054 -176.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.843 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.4 OUTLIER -110.77 88.7 2.84 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 107.966 -1.124 . . . . 15.0 107.966 176.454 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 1.1 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -105.21 150.46 25.08 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.686 -0.688 . . . . 15.0 109.875 -178.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -150.47 150.42 31.29 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.716 -0.674 . . . . 15.0 111.967 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.663 HG23 ' O ' ' A' ' 14' ' ' THR . 10.2 t -118.28 89.48 3.13 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.686 -0.688 . . . . 15.0 111.068 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.912 ' O ' ' N ' ' A' ' 18' ' ' GLY . 14.4 t70 -94.22 150.58 20.17 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 109.086 -0.709 . . . . 15.0 109.086 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 1.093 ' C ' ' N ' ' A' ' 18' ' ' GLY . 67.2 p -44.39 -18.99 0.02 OUTLIER 'General case' 0 CA--C 1.492 -1.27 0 CA-C-O 118.612 -0.708 . . . . 15.0 111.676 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.722 ' C ' ' O ' ' A' ' 16' ' ' SER . 13.9 m120 -41.33 -16.92 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.252 1 N-CA-C 96.552 -5.351 . . . . 15.0 96.552 169.524 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 1.093 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 51.39 58.72 9.38 Favored Glycine 0 N--CA 1.429 -1.806 1 CA-C-N 107.492 -4.413 . . . . 15.0 112.366 176.498 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 19' ' ' ARG . 1.3 tpp180 -150.18 151.81 33.67 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 112.429 -1.886 . . . . 15.0 110.252 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.773 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 34.0 m -97.97 100.66 11.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.704 -0.68 . . . . 15.0 110.295 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.878 ' HE1' ' HB ' ' A' ' 23' ' ' VAL . 0.1 OUTLIER -107.03 151.7 24.99 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.321 0.489 . . . . 15.0 112.321 -178.35 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.858 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 4.9 m-85 -114.42 120.65 41.03 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 112.658 0.614 . . . . 15.0 112.658 -178.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.878 ' HB ' ' HE1' ' A' ' 21' ' ' TYR . 7.1 p -114.56 96.65 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 115.68 -0.691 . . . . 15.0 109.413 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.621 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 26.6 t-20 -122.2 136.59 54.93 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.338 -0.846 . . . . 15.0 108.805 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.438 ' NE2' ' CG2' ' A' ' 23' ' ' VAL . 53.3 m-70 -126.41 84.46 2.27 Favored 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 118.49 -1.284 . . . . 15.0 113.242 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -93.33 -80.43 0.38 Allowed 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 103.836 -2.653 . . . . 15.0 103.836 172.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 52.3 p -92.98 -80.6 0.37 Allowed 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 106.235 -1.765 . . . . 15.0 106.235 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -153.59 90.1 1.38 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 114.885 -1.052 . . . . 15.0 110.343 176.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.577 HG23 ' O ' ' A' ' 24' ' ' ASN . 7.0 tp -127.65 125.85 66.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 118.911 0.778 . . . . 15.0 112.775 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.809 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 15.8 pt20 -150.52 150.38 31.19 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.946 -0.57 . . . . 15.0 109.702 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.773 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -91.71 77.47 5.59 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 117.619 -1.632 . . . . 15.0 108.791 178.481 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.74 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 7.5 tt0 -160.19 152.27 20.41 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 113.047 0.758 . . . . 15.0 113.047 177.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.782 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 5.0 p-10 -63.79 134.37 95.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 105.36 -2.089 . . . . 15.0 105.36 173.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.952 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 2.2 Cg_endo -89.38 33.18 0.36 Allowed 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.719 2.279 . . . . 15.0 113.346 -175.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.438 ' C ' ' O ' ' A' ' 35' ' ' PRO . 29.1 tpt180 -35.83 -70.94 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.777 0.322 . . . . 15.0 110.926 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 80.1 p . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.22 -0.895 . . . . 15.0 110.857 179.937 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.477 ' O ' ' HB3' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 112.481 -0.247 . . . . 15.0 112.481 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.593 ' O ' ' SD ' ' A' ' 3' ' ' MET . . . 70.68 -66.45 0.29 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.636 0.255 . . . . 15.0 111.299 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.612 ' O ' ' SD ' ' A' ' 3' ' ' MET . 0.0 OUTLIER 50.7 140.51 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.286 0.565 . . . . 15.0 111.567 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.687 ' O ' ' N ' ' A' ' 6' ' ' LEU . . . -61.76 -179.94 3.68 Favored Glycine 0 C--N 1.33 0.249 0 CA-C-N 115.72 -0.673 . . . . 15.0 113.078 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 1.245 ' C ' HD12 ' A' ' 6' ' ' LEU . 85.1 Cg_exo -46.23 65.69 0.01 OUTLIER 'Trans proline' 0 CA--C 1.511 -0.637 0 C-N-CA 123.713 2.942 . . . . 15.0 113.618 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 1.245 HD12 ' C ' ' A' ' 5' ' ' PRO . 0.2 OUTLIER -150.53 76.41 8.32 Favored Pre-proline 0 C--N 1.308 -1.213 0 CA-C-N 115.625 -0.716 . . . . 15.0 109.978 179.117 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.963 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 38.4 Cg_exo -63.59 -57.73 0.35 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.97 2.447 . . . . 15.0 110.923 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.963 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.9 Cg_endo -87.93 -177.25 1.88 Allowed 'Trans proline' 0 C--N 1.315 -1.225 0 C-N-CA 124.91 3.74 . . . . 15.0 109.481 176.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.415 ' C ' ' CD1' ' A' ' 10' ' ' TRP . . . -60.78 88.82 0.04 OUTLIER Glycine 0 CA--C 1.517 0.192 0 N-CA-C 108.968 -1.653 . . . . 15.0 108.968 176.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 1.043 ' O ' HD23 ' A' ' 6' ' ' LEU . 27.4 m95 -130.73 150.76 51.76 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 114.349 1.24 . . . . 15.0 114.349 -175.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.675 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -111.17 89.35 3.02 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 107.678 -1.23 . . . . 15.0 107.678 176.097 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.965 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -108.38 150.24 27.63 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.856 -0.611 . . . . 15.0 111.121 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.565 ' HD3' ' HE2' ' A' ' 21' ' ' TYR . 12.3 ptm180 -147.49 147.88 30.64 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.319 -0.855 . . . . 15.0 110.9 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.703 HG22 HG12 ' A' ' 20' ' ' VAL . 67.9 p -123.63 89.44 3.09 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.727 -0.67 . . . . 15.0 110.616 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.825 ' O ' ' N ' ' A' ' 18' ' ' GLY . 12.8 t70 -91.53 150.61 21.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.534 -0.757 . . . . 15.0 109.852 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 1.115 ' C ' ' N ' ' A' ' 18' ' ' GLY . 7.8 t -50.37 -19.2 0.77 Allowed 'General case' 0 CA--C 1.489 -1.393 0 CA-C-O 118.838 -0.601 . . . . 15.0 111.265 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.73 ' C ' ' O ' ' A' ' 16' ' ' SER . 46.7 m-80 -40.39 -17.28 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.232 1 N-CA-C 96.507 -5.368 . . . . 15.0 96.507 169.529 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 1.115 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 53.12 57.98 13.21 Favored Glycine 0 N--CA 1.43 -1.734 1 CA-C-N 107.335 -4.484 . . . . 15.0 112.612 176.222 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.38 148.91 43.49 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 112.474 -1.863 . . . . 15.0 109.841 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.748 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 34.3 m -100.83 106.33 19.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.497 -0.319 . . . . 15.0 110.171 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.77 ' HE1' HG13 ' A' ' 23' ' ' VAL . 0.4 OUTLIER -119.16 150.77 39.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.12 0.486 . . . . 15.0 112.084 -178.558 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.916 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 3.8 m-85 -119.16 133.73 55.61 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.55 -0.75 . . . . 15.0 111.781 -177.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.77 HG13 ' HE1' ' A' ' 21' ' ' TYR . 1.3 m -122.58 102.13 11.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.243 0.544 . . . . 15.0 110.255 177.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.629 ' OD1' ' HB ' ' A' ' 29' ' ' ILE . 5.4 p30 -111.36 121.55 45.53 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.208 -0.906 . . . . 15.0 108.848 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -117.05 84.51 2.16 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 119.132 -1.027 . . . . 15.0 112.855 -178.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.661 ' CG ' ' H ' ' A' ' 27' ' ' THR . 1.8 p30 -92.55 -80.31 0.37 Allowed 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 103.622 -2.732 . . . . 15.0 103.622 172.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.748 HG22 ' HD2' ' A' ' 28' ' ' ARG . 96.9 m -92.84 -81.0 0.36 Allowed 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 106.336 -1.728 . . . . 15.0 106.336 172.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.748 ' HD2' HG22 ' A' ' 27' ' ' THR . 1.1 ptm180 -154.0 90.02 1.34 Allowed 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 114.927 -1.033 . . . . 15.0 110.441 176.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.654 HD13 ' O ' ' A' ' 28' ' ' ARG . 47.3 mm -146.22 135.46 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 N-CA-C 113.635 0.976 . . . . 15.0 113.635 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TPO . . . . . 0.534 HG22 ' HA ' ' A' ' 23' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.812 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -150.17 150.44 31.63 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.946 -0.57 . . . . 15.0 109.67 179.74 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.748 ' HB3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -93.83 77.54 4.21 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 117.822 -1.551 . . . . 15.0 109.661 178.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.798 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 5.3 tt0 -160.68 151.81 18.98 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.436 0.902 . . . . 15.0 113.436 176.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.916 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 1.6 p-10 -66.71 133.2 94.1 Favored Pre-proline 0 C--N 1.33 -0.251 0 N-CA-C 105.068 -2.197 . . . . 15.0 105.068 172.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.928 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 2.4 Cg_endo -94.58 10.49 1.81 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.793 2.329 . . . . 15.0 113.325 -175.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 1.033 ' NE ' ' H ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -28.07 -53.57 0.09 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.755 0.312 . . . . 15.0 111.22 -179.145 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 1.033 ' H ' ' NE ' ' A' ' 36' ' ' ARG . 78.6 p . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.242 -0.885 . . . . 15.0 110.799 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 3' ' ' MET . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 112.487 -0.245 . . . . 15.0 112.487 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.3 -76.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.927 0.394 . . . . 15.0 111.083 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.579 ' O ' ' HG3' ' A' ' 3' ' ' MET . 23.6 ptm -161.12 93.56 0.97 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.109 -0.496 . . . . 15.0 110.735 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.503 ' O ' ' O ' ' A' ' 5' ' ' PRO . . . 154.37 -163.66 31.19 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.808 -0.71 . . . . 15.0 112.409 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.933 ' C ' HD13 ' A' ' 6' ' ' LEU . 57.6 Cg_exo -29.55 156.0 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 123.345 2.696 . . . . 15.0 112.793 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 1.052 ' N ' HD13 ' A' ' 6' ' ' LEU . 0.0 OUTLIER 36.86 74.18 0.63 Allowed Pre-proline 0 CA--C 1.512 -0.506 0 CA-C-N 115.211 -0.904 . . . . 15.0 111.179 -179.371 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.941 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 21.9 Cg_exo -69.56 -59.42 0.09 OUTLIER 'Trans proline' 0 C--N 1.322 -0.842 0 C-N-CA 123.708 2.939 . . . . 15.0 111.872 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.941 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -81.92 176.49 8.26 Favored 'Trans proline' 0 C--N 1.32 -0.964 0 C-N-CA 124.317 3.345 . . . . 15.0 110.334 178.124 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.62 80.12 0.01 OUTLIER Glycine 0 C--N 1.33 0.235 0 C-N-CA 119.396 -1.383 . . . . 15.0 109.834 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 1.03 ' HB3' ' HZ2' ' A' ' 12' ' ' LYS . 23.3 m95 -118.77 149.02 42.18 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.796 1.036 . . . . 15.0 113.796 -176.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.406 ' N ' ' HZ2' ' A' ' 12' ' ' LYS . 43.0 tt0 -104.29 88.1 2.9 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.333 -0.988 . . . . 15.0 108.333 177.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 1.049 ' HG2' HD12 ' A' ' 6' ' ' LEU . 0.1 OUTLIER -106.48 151.27 25.18 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.35 -0.841 . . . . 15.0 110.117 -179.469 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.816 ' HD3' ' H ' ' A' ' 14' ' ' THR . 12.1 tpp180 -143.12 143.55 31.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.563 -0.744 . . . . 15.0 111.753 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.816 ' H ' ' HD3' ' A' ' 13' ' ' ARG . 72.3 p -118.12 89.39 3.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.401 -0.818 . . . . 15.0 110.686 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.892 ' O ' ' N ' ' A' ' 18' ' ' GLY . 18.6 t70 -106.77 150.66 26.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.686 -0.688 . . . . 15.0 109.432 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 1.141 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.2 t -44.1 -19.06 0.02 OUTLIER 'General case' 0 CA--C 1.489 -1.367 0 CA-C-O 118.976 -0.535 . . . . 15.0 111.355 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.721 ' C ' ' O ' ' A' ' 16' ' ' SER . 2.6 t-20 -40.86 -16.89 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.254 1 N-CA-C 96.388 -5.412 . . . . 15.0 96.388 169.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 1.141 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.0 58.5 8.55 Favored Glycine 0 N--CA 1.429 -1.778 1 CA-C-N 107.522 -4.399 . . . . 15.0 112.38 176.321 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.42 ' HB3' ' CZ3' ' A' ' 32' ' ' TRP . 5.1 tpp85 -146.62 151.32 37.09 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 112.395 -1.903 . . . . 15.0 110.408 179.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.708 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 13.3 m -99.08 90.39 2.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.682 -0.69 . . . . 15.0 109.78 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.799 ' CE2' ' HB3' ' A' ' 13' ' ' ARG . 1.3 p90 -95.91 151.11 19.72 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.745 0.646 . . . . 15.0 112.745 -177.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.848 ' CB ' ' HE2' ' A' ' 12' ' ' LYS . 10.7 m-85 -120.63 125.55 48.01 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.687 -0.688 . . . . 15.0 111.839 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.818 ' H ' ' HE3' ' A' ' 12' ' ' LYS . 3.5 t -118.55 89.84 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 115.651 -0.704 . . . . 15.0 110.288 178.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.846 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 3.4 t-20 -111.45 125.57 54.03 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 108.191 -1.04 . . . . 15.0 108.191 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.755 ' NE2' HG13 ' A' ' 23' ' ' VAL . 55.2 m-70 -116.62 83.46 1.97 Allowed 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 118.36 -1.336 . . . . 15.0 113.289 -178.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.584 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.8 OUTLIER -94.3 -81.09 0.39 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 104.331 -2.47 . . . . 15.0 104.331 172.315 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.955 HG23 ' H ' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -93.05 -79.74 0.39 Allowed 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.065 -1.457 . . . . 15.0 107.065 173.375 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.955 ' H ' HG23 ' A' ' 27' ' ' THR . 0.4 OUTLIER -152.47 89.82 1.45 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.836 -1.075 . . . . 15.0 110.039 177.423 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.485 HG21 ' HH2' ' A' ' 10' ' ' TRP . 51.2 mt -126.18 120.0 55.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 N-CA-C 113.083 0.772 . . . . 15.0 113.083 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.722 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 3.6 pt20 -147.27 150.31 34.57 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 108.816 -0.809 . . . . 15.0 108.816 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.794 ' CE3' ' HB3' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -89.72 77.33 7.12 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 117.516 -1.673 . . . . 15.0 108.919 179.259 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.708 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 5.0 tt0 -160.54 152.16 19.66 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 113.218 0.822 . . . . 15.0 113.218 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.731 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -65.05 137.99 97.28 Favored Pre-proline 0 C--N 1.329 -0.319 0 N-CA-C 105.295 -2.113 . . . . 15.0 105.295 173.06 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 1.013 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 3.2 Cg_endo -94.56 77.76 0.18 Allowed 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.189 2.593 . . . . 15.0 113.385 -175.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.613 ' HD3' ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -60.45 8.02 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.282 -0.417 . . . . 15.0 110.711 179.564 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.605 ' H ' ' C ' ' A' ' 35' ' ' PRO . 60.7 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.224 -0.893 . . . . 15.0 110.999 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.423 ' O ' ' HB3' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.488 2.117 0 N-CA-C 112.422 -0.271 . . . . 15.0 112.422 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.517 ' O ' ' O ' ' A' ' 3' ' ' MET . . . 67.71 110.53 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.688 0.28 . . . . 15.0 111.018 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.517 ' O ' ' O ' ' A' ' 2' ' ' ALA . 25.7 ptt? 46.16 178.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 15.0 110.656 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 101.8 -170.11 20.69 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.448 -0.882 . . . . 15.0 112.67 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.908 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 61.6 Cg_endo -70.85 162.66 41.84 Favored 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 122.945 2.43 . . . . 15.0 113.181 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 1.092 ' CD1' ' HB2' ' A' ' 12' ' ' LYS . 0.0 OUTLIER 41.04 69.65 1.9 Allowed Pre-proline 0 CA--C 1.51 -0.585 0 CA-C-N 115.254 -0.885 . . . . 15.0 111.5 -179.16 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.959 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 14.2 Cg_exo -73.16 -60.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.32 -0.931 0 C-N-CA 123.299 2.666 . . . . 15.0 112.881 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.959 ' HD3' ' CB ' ' A' ' 7' ' ' PRO . 1.3 Cg_endo -80.7 53.59 4.84 Favored 'Trans proline' 0 C--N 1.322 -0.838 0 C-N-CA 124.667 3.578 . . . . 15.0 112.745 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 49.59 63.73 3.91 Favored Glycine 0 C--O 1.23 -0.095 0 N-CA-C 109.217 -1.553 . . . . 15.0 109.217 -177.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.999 ' HB3' ' HZ2' ' A' ' 12' ' ' LYS . 10.5 m95 -112.58 151.43 30.06 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.688 0.996 . . . . 15.0 113.688 -175.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.848 ' HB3' HG12 ' A' ' 23' ' ' VAL . 32.1 tt0 -96.63 88.92 4.79 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.474 -0.936 . . . . 15.0 108.474 176.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 1.092 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -114.23 151.35 32.93 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.598 -0.728 . . . . 15.0 110.677 -178.941 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.737 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 10.2 ptm180 -147.63 149.18 32.02 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.46 -0.791 . . . . 15.0 110.996 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.744 HG22 HG12 ' A' ' 20' ' ' VAL . 74.7 p -119.0 89.57 3.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.848 -0.615 . . . . 15.0 111.088 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.854 ' O ' ' N ' ' A' ' 18' ' ' GLY . 16.9 t70 -92.3 150.57 20.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.609 -0.723 . . . . 15.0 109.432 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 1.12 ' C ' ' N ' ' A' ' 18' ' ' GLY . 8.1 t -50.48 -19.25 0.82 Allowed 'General case' 0 CA--C 1.489 -1.376 0 CA-C-O 119.018 -0.515 . . . . 15.0 111.48 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.713 ' C ' ' O ' ' A' ' 16' ' ' SER . 2.7 t-20 -40.91 -17.06 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.205 1 N-CA-C 96.331 -5.433 . . . . 15.0 96.331 169.575 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 1.12 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 52.67 59.29 9.39 Favored Glycine 0 N--CA 1.431 -1.661 1 CA-C-N 107.458 -4.428 . . . . 15.0 112.553 176.181 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.434 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 8.3 tpt180 -141.86 151.21 42.5 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 112.418 -1.891 . . . . 15.0 109.859 179.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.744 HG12 HG22 ' A' ' 14' ' ' THR . 35.6 m -101.25 94.74 3.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.028 -0.533 . . . . 15.0 110.266 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.843 ' HE1' HG23 ' A' ' 23' ' ' VAL . 0.1 OUTLIER -100.69 151.08 22.07 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.203 0.445 . . . . 15.0 112.203 -178.319 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.921 ' CE2' ' HA ' ' A' ' 34' ' ' ASP . 4.6 m-85 -118.5 121.63 40.74 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 113.03 0.752 . . . . 15.0 113.03 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.848 HG12 ' HB3' ' A' ' 11' ' ' GLU . 1.0 OUTLIER -107.86 89.74 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 115.483 -0.781 . . . . 15.0 108.981 177.583 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.852 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 3.2 t-20 -110.79 122.53 48.05 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.495 -0.928 . . . . 15.0 108.495 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.558 ' CD2' HG13 ' A' ' 23' ' ' VAL . 29.4 m-70 -120.88 83.4 2.06 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 118.047 -1.461 . . . . 15.0 113.58 -178.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.728 HD21 HG13 ' A' ' 29' ' ' ILE . 2.4 p30 -94.7 -80.96 0.4 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.585 -2.376 . . . . 15.0 104.585 172.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.714 ' H ' ' CG ' ' A' ' 26' ' ' ASN . 93.6 m -93.38 -77.7 0.44 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.078 -1.419 . . . . 15.0 107.246 173.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 28' ' ' ARG . 8.8 tpt180 -152.1 90.06 1.49 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.643 -1.162 . . . . 15.0 110.105 177.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.728 HG13 HD21 ' A' ' 26' ' ' ASN . 38.5 mm -125.98 121.36 59.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 112.93 0.715 . . . . 15.0 112.93 -179.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TPO . . . . . 0.43 ' O ' HG22 ' A' ' 30' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.773 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -150.28 150.09 31.03 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.79 -0.641 . . . . 15.0 109.351 179.781 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.762 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -92.7 78.26 4.85 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 117.752 -1.579 . . . . 15.0 109.238 179.069 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.792 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 3.7 tt0 -160.14 151.8 19.92 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 113.032 0.753 . . . . 15.0 113.032 177.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.921 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 3.8 p30 -65.88 133.42 94.92 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 105.545 -2.02 . . . . 15.0 105.545 173.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.977 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 1.6 Cg_endo -90.54 58.4 1.42 Allowed 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.79 2.327 . . . . 15.0 113.062 -175.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.925 ' HE ' ' N ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -52.14 -20.61 2.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.449 -0.341 . . . . 15.0 111.253 -179.728 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.786 ' H ' ' HE ' ' A' ' 36' ' ' ARG . 81.5 p . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.26 -0.876 . . . . 15.0 110.904 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.543 ' O ' ' HB3' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.546 -0.222 . . . . 15.0 112.546 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 1' ' ' GLY . . . 74.43 -88.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.769 0.319 . . . . 15.0 111.364 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.558 ' N ' ' SD ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -129.53 -170.17 2.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 15.0 110.907 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.442 ' O ' ' C ' ' A' ' 5' ' ' PRO . . . 89.78 -162.36 30.14 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.635 -0.793 . . . . 15.0 112.276 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.787 ' C ' HD12 ' A' ' 6' ' ' LEU . 90.9 Cg_exo -29.59 138.68 0.03 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.099 2.533 . . . . 15.0 112.223 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 1.031 HD23 ' O ' ' A' ' 10' ' ' TRP . 0.0 OUTLIER 54.3 70.14 1.83 Allowed Pre-proline 0 CA--C 1.501 -0.908 0 CA-C-N 114.529 -1.214 . . . . 15.0 110.604 -179.855 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.948 ' CB ' ' HD3' ' A' ' 8' ' ' PRO . 32.0 Cg_exo -61.28 -53.99 2.07 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 122.532 2.155 . . . . 15.0 108.872 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 1.01 ' HG2' ' NE1' ' A' ' 10' ' ' TRP . 2.8 Cg_endo -90.55 -170.57 0.39 Allowed 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 125.229 3.952 . . . . 15.0 109.611 174.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.414 ' C ' ' CD1' ' A' ' 10' ' ' TRP . . . -68.33 93.2 0.28 Allowed Glycine 0 CA--C 1.519 0.296 0 N-CA-C 109.443 -1.463 . . . . 15.0 109.443 177.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 1.031 ' O ' HD23 ' A' ' 6' ' ' LEU . 36.5 m95 -129.74 148.24 51.6 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 115.079 1.511 . . . . 15.0 115.079 -175.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.67 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -101.56 89.74 3.82 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 106.025 -1.842 . . . . 15.0 106.025 175.53 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 1.131 ' HD2' ' CE2' ' A' ' 22' ' ' PHE . 10.1 mtpp -110.04 155.3 22.03 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 114.735 1.383 . . . . 15.0 114.735 -174.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.787 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 9.7 ttp180 -150.38 147.05 27.11 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 112.729 -2.032 . . . . 15.0 112.05 -178.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.553 HG23 ' O ' ' A' ' 14' ' ' THR . 4.9 t -132.61 95.16 3.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.343 -0.844 . . . . 15.0 110.792 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.856 ' O ' ' N ' ' A' ' 18' ' ' GLY . 19.4 t70 -111.28 150.95 28.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.886 -0.597 . . . . 15.0 110.483 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 1.093 ' C ' ' N ' ' A' ' 18' ' ' GLY . 70.4 p -45.28 -18.76 0.03 OUTLIER 'General case' 0 CA--C 1.49 -1.332 0 CA-C-O 118.744 -0.646 . . . . 15.0 111.413 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.747 ' C ' ' O ' ' A' ' 16' ' ' SER . 12.3 m120 -39.89 -17.13 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.234 1 N-CA-C 96.497 -5.371 . . . . 15.0 96.497 169.451 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 1.093 ' N ' ' C ' ' A' ' 16' ' ' SER . . . 50.36 55.56 15.93 Favored Glycine 0 N--CA 1.43 -1.752 1 CA-C-N 107.665 -4.334 . . . . 15.0 111.992 176.541 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -137.65 150.67 47.56 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 112.301 -1.949 . . . . 15.0 109.648 179.34 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.689 ' O ' ' HB3' ' A' ' 32' ' ' TRP . 4.2 t -99.1 95.95 4.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.557 -0.534 . . . . 15.0 109.557 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.811 ' HA ' ' HA ' ' A' ' 32' ' ' TRP . 0.1 OUTLIER -101.13 150.76 22.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.198 0.523 . . . . 15.0 112.329 -177.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 1.131 ' CE2' ' HD2' ' A' ' 12' ' ' LYS . 5.0 m-85 -124.92 134.32 52.71 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.479 -0.782 . . . . 15.0 112.287 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.737 HG23 ' CE1' ' A' ' 21' ' ' TYR . 13.5 t -122.5 89.27 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 115.546 -0.752 . . . . 15.0 109.681 178.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.765 ' O ' ' O ' ' A' ' 29' ' ' ILE . 9.3 t-20 -133.8 134.79 43.29 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 108.631 -0.877 . . . . 15.0 108.631 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.787 ' HB2' ' HA ' ' A' ' 28' ' ' ARG . 10.6 p80 -151.87 88.82 1.42 Allowed 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 118.161 -1.416 . . . . 15.0 114.275 -178.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.442 ' C ' ' O ' ' A' ' 25' ' ' HIS . 2.5 t-20 -50.62 -60.41 3.06 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 102.767 -3.049 . . . . 15.0 102.767 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.857 HG22 ' NE ' ' A' ' 28' ' ' ARG . 15.5 m -92.84 -81.94 0.34 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.882 -1.508 . . . . 15.0 106.999 173.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.857 ' NE ' HG22 ' A' ' 27' ' ' THR . 0.0 OUTLIER -154.71 100.41 2.23 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.815 -0.63 . . . . 15.0 111.672 177.135 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.826 HD13 ' N ' ' A' ' 30' ' ' TPO . 0.0 OUTLIER -146.96 138.45 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-N 119.538 1.063 . . . . 15.0 112.627 178.818 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TPO . . . . . 0.826 ' N ' HD13 ' A' ' 29' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.876 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 2.6 pt20 -150.32 150.05 30.94 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.483 -0.78 . . . . 15.0 109.256 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.811 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -91.67 78.23 5.54 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 117.67 -1.612 . . . . 15.0 109.366 178.808 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.771 ' HG2' ' N ' ' A' ' 34' ' ' ASP . 8.0 tt0 -159.66 151.77 20.75 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 113.162 0.801 . . . . 15.0 113.162 176.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.808 ' HA ' ' CE2' ' A' ' 22' ' ' PHE . 5.0 p-10 -65.39 132.95 95.28 Favored Pre-proline 0 C--N 1.331 -0.224 0 N-CA-C 104.517 -2.401 . . . . 15.0 104.517 172.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.98 ' HG2' ' CE2' ' A' ' 10' ' ' TRP . 3.2 Cg_exo -88.66 29.12 0.45 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.048 1.832 . . . . 15.0 113.244 -174.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.601 ' O ' ' HB2' ' A' ' 37' ' ' SER . 4.3 ptp180 45.63 17.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.059 -0.519 . . . . 15.0 110.864 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.658 ' HA ' ' HG3' ' A' ' 8' ' ' PRO . 50.0 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.177 -0.916 . . . . 15.0 110.815 -179.679 . . . . . . . . 1 1 . 1 stop_ save_