data_1jo4_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 1jo4 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 143.24 -79.27 0.26 Allowed Glycine 0 CA--C 1.534 1.249 0 C-N-CA 124.478 1.037 . . . . 0.0 113.715 174.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.95 160.33 43.02 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.222 1.009 . . . . 0.0 113.336 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -135.8 140.9 44.6 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.126 1.37 . . . . 0.0 111.514 173.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.1 t -109.99 104.19 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 125.809 1.643 . . . . 0.0 109.214 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 82.0 t90 -98.93 122.46 42.22 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.162 0.985 . . . . 0.0 113.198 -169.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -127.7 159.7 33.95 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.569 1.548 . . . . 0.0 112.518 -176.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -142.89 149.61 38.72 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.746 1.618 . . . . 0.0 111.584 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 23.9 m-90 -142.52 -173.23 3.81 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.085 1.754 . . . . 0.0 111.101 175.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' GLY . . . . . . . . . . . . . . . 143.26 -79.22 0.26 Allowed Glycine 0 CA--C 1.534 1.277 0 C-N-CA 124.478 1.037 . . . . 0.0 113.703 174.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.92 160.33 43.04 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.161 0.984 . . . . 0.0 113.294 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -135.82 140.91 44.59 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.103 1.361 . . . . 0.0 111.477 173.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 42.2 t -109.93 104.15 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 125.863 1.665 . . . . 0.0 109.204 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' TRP . . . . . . . . . . . . . 82.0 t90 -98.98 122.47 42.28 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.167 0.987 . . . . 0.0 113.159 -168.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -127.71 159.66 34.06 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.616 1.566 . . . . 0.0 112.549 -176.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' TRP . . . . . . . . . . . . . 17.9 m-90 -142.84 149.68 38.89 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.736 1.614 . . . . 0.0 111.569 -178.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' TRP . . . . . . . . . . . . . 23.8 m-90 -142.53 -173.26 3.81 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.141 1.776 . . . . 0.0 111.162 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 143.24 -79.27 0.26 Allowed Glycine 0 CA--C 1.534 1.249 0 C-N-CA 124.478 1.037 . . . . 0.0 113.715 174.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.95 160.33 43.02 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.222 1.009 . . . . 0.0 113.336 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -135.8 140.9 44.6 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.126 1.37 . . . . 0.0 111.514 173.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.1 t -109.99 104.19 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 125.809 1.643 . . . . 0.0 109.214 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 82.0 t90 -98.93 122.46 42.22 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.162 0.985 . . . . 0.0 113.198 -169.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -127.7 159.7 33.95 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.569 1.548 . . . . 0.0 112.518 -176.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -142.89 149.61 38.72 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.746 1.618 . . . . 0.0 111.584 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 23.9 m-90 -142.52 -173.23 3.81 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.085 1.754 . . . . 0.0 111.101 175.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' GLY . . . . . . . . . . . . . . . 143.26 -79.22 0.26 Allowed Glycine 0 CA--C 1.534 1.277 0 C-N-CA 124.478 1.037 . . . . 0.0 113.703 174.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.92 160.33 43.04 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.161 0.984 . . . . 0.0 113.294 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -135.82 140.91 44.59 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.103 1.361 . . . . 0.0 111.477 173.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 42.2 t -109.93 104.15 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 125.863 1.665 . . . . 0.0 109.204 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 9' ' ' TRP . . . . . . . . . . . . . 82.0 t90 -98.98 122.47 42.28 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.167 0.987 . . . . 0.0 113.159 -168.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -127.71 159.66 34.06 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.616 1.566 . . . . 0.0 112.549 -176.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 13' ' ' TRP . . . . . . . . . . . . . 17.9 m-90 -142.84 149.68 38.89 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.736 1.614 . . . . 0.0 111.569 -178.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 15' ' ' TRP . . . . . . . . . . . . . 23.8 m-90 -142.53 -173.26 3.81 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.141 1.776 . . . . 0.0 111.162 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 143.24 -79.27 0.26 Allowed Glycine 0 CA--C 1.534 1.249 0 C-N-CA 124.478 1.037 . . . . 0.0 113.715 174.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.95 160.33 43.02 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.222 1.009 . . . . 0.0 113.336 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -135.8 140.9 44.6 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.126 1.37 . . . . 0.0 111.514 173.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.1 t -109.99 104.19 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 125.809 1.643 . . . . 0.0 109.214 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 82.0 t90 -98.93 122.46 42.22 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.162 0.985 . . . . 0.0 113.198 -169.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -127.7 159.7 33.95 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.569 1.548 . . . . 0.0 112.518 -176.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -142.89 149.61 38.72 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.746 1.618 . . . . 0.0 111.584 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 23.9 m-90 -142.52 -173.23 3.81 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.085 1.754 . . . . 0.0 111.101 175.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' GLY . . . . . . . . . . . . . . . 143.26 -79.22 0.26 Allowed Glycine 0 CA--C 1.534 1.277 0 C-N-CA 124.478 1.037 . . . . 0.0 113.703 174.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.92 160.33 43.04 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.161 0.984 . . . . 0.0 113.294 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -135.82 140.91 44.59 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.103 1.361 . . . . 0.0 111.477 173.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 42.2 t -109.93 104.15 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 125.863 1.665 . . . . 0.0 109.204 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' TRP . . . . . . . . . . . . . 82.0 t90 -98.98 122.47 42.28 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.167 0.987 . . . . 0.0 113.159 -168.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -127.71 159.66 34.06 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.616 1.566 . . . . 0.0 112.549 -176.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' TRP . . . . . . . . . . . . . 17.9 m-90 -142.84 149.68 38.89 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.736 1.614 . . . . 0.0 111.569 -178.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' TRP . . . . . . . . . . . . . 23.8 m-90 -142.53 -173.26 3.81 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.141 1.776 . . . . 0.0 111.162 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_