NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
607213 | 2n6n | 25774 | cing | 2-parsed | STAR | entry | full | 80 |
data_2n6n_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_2n6n _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project" NMR . parsed_2n6n 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_2n6n _Entry.Title "Original constraint list(s)" _Entry.Version_type original _Entry.Submission_date . _Entry.Accession_date . _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination . _Entry.NMR_STAR_version 3.1 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2n6n "Master copy" parsed_2n6n stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_2n6n _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 2n6n.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2n6n 1 1 2n6n.mr . . XEASY 2 peak "Not applicable" "Not applicable" 0 parsed_2n6n 1 1 2n6n.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 56 parsed_2n6n 1 1 2n6n.mr . . DYANA/DIANA 4 distance "general distance" simple 24 parsed_2n6n 1 1 2n6n.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2n6n 1 stop_ save_ save_MR_file_comment_1 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_2n6n _Org_constr_file_comment.ID 1 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 1 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment ; *HEADER TOXIN 27-AUG-15 2N6N *TITLE STRUCTURE DETERMINATION FOR SPIDER TOXIN, U4-AGATOXIN-AO1A *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: U4-AGATOXIN-AO1A; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: UNP RESIDUES 37-68; *COMPND 5 SYNONYM: U4-AGTX-AO1A, MU-2AAGA_15; *COMPND 6 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: AGELENA ORIENTALIS; *SOURCE 3 ORGANISM_COMMON: SPIDER; *SOURCE 4 ORGANISM_TAXID: 293813; *SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; *SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562 *KEYWDS SPIDER TOXIN, AGATOXIN, INHIBITOR CYSTINE KNOT, TOXIN *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR S.S.PINEDA, Y.K.-Y.CHIN, M.S.MOBLI, G.F.KING *REVDAT 1 31-AUG-16 2N6N 0 ; save_ save_DYANA/DIANA_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_2n6n _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 3 _Torsion_angle_constraint_list.Details "Generated by Wattos" loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -171.0 -55.0 . . 2 TYR . . . . . . . . . . . . . parsed_2n6n 1 2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 204.0 . . 2 TYR . . . . . . . . . . . . . parsed_2n6n 1 3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -177.0 -89.0 . . 3 CYSS . . . . . . . . . . . . . parsed_2n6n 1 4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134.0 178.0 . . 3 CYSS . . . . . . . . . . . . . parsed_2n6n 1 5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.0 -85.0 . . 4 ALA . . . . . . . . . . . . . parsed_2n6n 1 6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.0 168.0 . . 4 ALA . . . . . . . . . . . . . parsed_2n6n 1 7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.0 -67.0 . . 5 GLU . . . . . . . . . . . . . parsed_2n6n 1 8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.0 214.0 . . 5 GLU . . . . . . . . . . . . . parsed_2n6n 1 9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -39.0 . . 6 LYS . . . . . . . . . . . . . parsed_2n6n 1 10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.0 161.0 . . 6 LYS . . . . . . . . . . . . . parsed_2n6n 1 11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 112.0 . . 7 GLY . . . . . . . . . . . . . parsed_2n6n 1 12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -24.0 12.0 . . 7 GLY . . . . . . . . . . . . . parsed_2n6n 1 13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -104.0 -76.0 . . 8 ILE . . . . . . . . . . . . . parsed_2n6n 1 14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 59.0 143.0 . . 8 ILE . . . . . . . . . . . . . parsed_2n6n 1 15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -197.0 -53.0 . . 10 CYSS . . . . . . . . . . . . . parsed_2n6n 1 16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 138.0 186.0 . . 10 CYSS . . . . . . . . . . . . . parsed_2n6n 1 17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.0 -40.0 . . 11 HIS . . . . . . . . . . . . . parsed_2n6n 1 18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.0 5.0 . . 11 HIS . . . . . . . . . . . . . parsed_2n6n 1 19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.0 -63.0 . . 12 ASN . . . . . . . . . . . . . parsed_2n6n 1 20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.0 31.0 . . 12 ASN . . . . . . . . . . . . . parsed_2n6n 1 21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -188.0 -72.0 . . 13 ILE . . . . . . . . . . . . . parsed_2n6n 1 22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.0 179.0 . . 13 ILE . . . . . . . . . . . . . parsed_2n6n 1 23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -177.0 -41.0 . . 14 HIS . . . . . . . . . . . . . parsed_2n6n 1 24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124.0 156.0 . . 14 HIS . . . . . . . . . . . . . parsed_2n6n 1 25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.0 -24.0 . . 15 CYSS . . . . . . . . . . . . . parsed_2n6n 1 26 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.0 149.0 . . 15 CYSS . . . . . . . . . . . . . parsed_2n6n 1 27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -97.0 -37.0 . . 17 SER . . . . . . . . . . . . . parsed_2n6n 1 28 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.0 157.0 . . 17 SER . . . . . . . . . . . . . parsed_2n6n 1 29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 63.0 115.0 . . 18 GLY . . . . . . . . . . . . . parsed_2n6n 1 30 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.0 10.0 . . 18 GLY . . . . . . . . . . . . . parsed_2n6n 1 31 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.0 -65.0 . . 19 LEU . . . . . . . . . . . . . parsed_2n6n 1 32 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.0 173.0 . . 19 LEU . . . . . . . . . . . . . parsed_2n6n 1 33 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.0 -93.0 . . 20 THR . . . . . . . . . . . . . parsed_2n6n 1 34 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.0 153.0 . . 20 THR . . . . . . . . . . . . . parsed_2n6n 1 35 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.0 -45.0 . . 21 CYSS . . . . . . . . . . . . . parsed_2n6n 1 36 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 87.0 147.0 . . 21 CYSS . . . . . . . . . . . . . parsed_2n6n 1 37 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.0 -82.0 . . 22 LYS . . . . . . . . . . . . . parsed_2n6n 1 38 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.0 149.0 . . 22 LYS . . . . . . . . . . . . . parsed_2n6n 1 39 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.0 -82.0 . . 23 CYSS . . . . . . . . . . . . . parsed_2n6n 1 40 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 154.0 . . 23 CYSS . . . . . . . . . . . . . parsed_2n6n 1 41 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.0 -78.0 . . 24 LYS . . . . . . . . . . . . . parsed_2n6n 1 42 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 76.0 148.0 . . 24 LYS . . . . . . . . . . . . . parsed_2n6n 1 43 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 49.0 89.0 . . 25 GLY . . . . . . . . . . . . . parsed_2n6n 1 44 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.0 -113.0 . . 25 GLY . . . . . . . . . . . . . parsed_2n6n 1 45 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.0 -85.0 . . 26 SER . . . . . . . . . . . . . parsed_2n6n 1 46 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.0 30.0 . . 26 SER . . . . . . . . . . . . . parsed_2n6n 1 47 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125.0 -81.0 . . 27 SER . . . . . . . . . . . . . parsed_2n6n 1 48 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.0 152.0 . . 27 SER . . . . . . . . . . . . . parsed_2n6n 1 49 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 -80.0 . . 28 CYSS . . . . . . . . . . . . . parsed_2n6n 1 50 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.0 169.0 . . 28 CYSS . . . . . . . . . . . . . parsed_2n6n 1 51 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.0 -94.0 . . 29 VAL . . . . . . . . . . . . . parsed_2n6n 1 52 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.0 184.0 . . 29 VAL . . . . . . . . . . . . . parsed_2n6n 1 53 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -123.0 -75.0 . . 30 CYSS . . . . . . . . . . . . . parsed_2n6n 1 54 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.0 151.0 . . 30 CYSS . . . . . . . . . . . . . parsed_2n6n 1 55 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.0 -82.0 . . 31 ARG . . . . . . . . . . . . . parsed_2n6n 1 56 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.0 166.0 . . 31 ARG . . . . . . . . . . . . . parsed_2n6n 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 "9 LYS PHI -109.0 -57.0 1.00 #" 15 2 15 40 parsed_2n6n 1 2 "9 LYS PSI -68.0 12.0 1.00 #" 16 2 16 40 parsed_2n6n 1 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_2n6n _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "general distance" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 4 _Distance_constraint_list.Details "Generated by Wattos" loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . parsed_2n6n 1 2 1 . . . parsed_2n6n 1 3 1 . . . parsed_2n6n 1 4 1 . . . parsed_2n6n 1 5 1 . . . parsed_2n6n 1 6 1 . . . parsed_2n6n 1 7 1 . . . parsed_2n6n 1 8 1 . . . parsed_2n6n 1 9 1 . . . parsed_2n6n 1 10 1 . . . parsed_2n6n 1 11 1 . . . parsed_2n6n 1 12 1 . . . parsed_2n6n 1 13 1 . . . parsed_2n6n 1 14 1 . . . parsed_2n6n 1 15 1 . . . parsed_2n6n 1 16 1 . . . parsed_2n6n 1 17 1 . . . parsed_2n6n 1 18 1 . . . parsed_2n6n 1 19 1 . . . parsed_2n6n 1 20 1 . . . parsed_2n6n 1 21 1 . . . parsed_2n6n 1 22 1 . . . parsed_2n6n 1 23 1 . . . parsed_2n6n 1 24 1 . . . parsed_2n6n 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Assembly_atom_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Seq_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Resonance_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 . . . . . . . . . 3 CYSS SG parsed_2n6n 1 1 1 2 . . . . . . . . . 16 CYSS SG parsed_2n6n 1 2 1 1 . . . . . . . . . 3 CYSS SG parsed_2n6n 1 2 1 2 . . . . . . . . . 16 CYSS CB parsed_2n6n 1 3 1 1 . . . . . . . . . 3 CYSS CB parsed_2n6n 1 3 1 2 . . . . . . . . . 16 CYSS SG parsed_2n6n 1 4 1 1 . . . . . . . . . 10 CYSS SG parsed_2n6n 1 4 1 2 . . . . . . . . . 21 CYSS SG parsed_2n6n 1 5 1 1 . . . . . . . . . 10 CYSS SG parsed_2n6n 1 5 1 2 . . . . . . . . . 21 CYSS CB parsed_2n6n 1 6 1 1 . . . . . . . . . 10 CYSS CB parsed_2n6n 1 6 1 2 . . . . . . . . . 21 CYSS SG parsed_2n6n 1 7 1 1 . . . . . . . . . 15 CYSS SG parsed_2n6n 1 7 1 2 . . . . . . . . . 30 CYSS SG parsed_2n6n 1 8 1 1 . . . . . . . . . 15 CYSS SG parsed_2n6n 1 8 1 2 . . . . . . . . . 30 CYSS CB parsed_2n6n 1 9 1 1 . . . . . . . . . 15 CYSS CB parsed_2n6n 1 9 1 2 . . . . . . . . . 30 CYSS SG parsed_2n6n 1 10 1 1 . . . . . . . . . 23 CYSS SG parsed_2n6n 1 10 1 2 . . . . . . . . . 28 CYSS SG parsed_2n6n 1 11 1 1 . . . . . . . . . 23 CYSS SG parsed_2n6n 1 11 1 2 . . . . . . . . . 28 CYSS CB parsed_2n6n 1 12 1 1 . . . . . . . . . 23 CYSS CB parsed_2n6n 1 12 1 2 . . . . . . . . . 28 CYSS SG parsed_2n6n 1 13 1 1 . . . . . . . . . 3 CYSS SG parsed_2n6n 1 13 1 2 . . . . . . . . . 16 CYSS SG parsed_2n6n 1 14 1 1 . . . . . . . . . 3 CYSS SG parsed_2n6n 1 14 1 2 . . . . . . . . . 16 CYSS CB parsed_2n6n 1 15 1 1 . . . . . . . . . 3 CYSS CB parsed_2n6n 1 15 1 2 . . . . . . . . . 16 CYSS SG parsed_2n6n 1 16 1 1 . . . . . . . . . 10 CYSS SG parsed_2n6n 1 16 1 2 . . . . . . . . . 21 CYSS SG parsed_2n6n 1 17 1 1 . . . . . . . . . 10 CYSS SG parsed_2n6n 1 17 1 2 . . . . . . . . . 21 CYSS CB parsed_2n6n 1 18 1 1 . . . . . . . . . 10 CYSS CB parsed_2n6n 1 18 1 2 . . . . . . . . . 21 CYSS SG parsed_2n6n 1 19 1 1 . . . . . . . . . 15 CYSS SG parsed_2n6n 1 19 1 2 . . . . . . . . . 30 CYSS SG parsed_2n6n 1 20 1 1 . . . . . . . . . 15 CYSS SG parsed_2n6n 1 20 1 2 . . . . . . . . . 30 CYSS CB parsed_2n6n 1 21 1 1 . . . . . . . . . 15 CYSS CB parsed_2n6n 1 21 1 2 . . . . . . . . . 30 CYSS SG parsed_2n6n 1 22 1 1 . . . . . . . . . 23 CYSS SG parsed_2n6n 1 22 1 2 . . . . . . . . . 28 CYSS SG parsed_2n6n 1 23 1 1 . . . . . . . . . 23 CYSS SG parsed_2n6n 1 23 1 2 . . . . . . . . . 28 CYSS CB parsed_2n6n 1 24 1 1 . . . . . . . . . 23 CYSS CB parsed_2n6n 1 24 1 2 . . . . . . . . . 28 CYSS SG parsed_2n6n 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 1.96 parsed_2n6n 1 2 1 . . . . . . . 2.90 parsed_2n6n 1 3 1 . . . . . . . 2.90 parsed_2n6n 1 4 1 . . . . . . . 1.96 parsed_2n6n 1 5 1 . . . . . . . 2.90 parsed_2n6n 1 6 1 . . . . . . . 2.90 parsed_2n6n 1 7 1 . . . . . . . 1.96 parsed_2n6n 1 8 1 . . . . . . . 2.90 parsed_2n6n 1 9 1 . . . . . . . 2.90 parsed_2n6n 1 10 1 . . . . . . . 1.96 parsed_2n6n 1 11 1 . . . . . . . 2.90 parsed_2n6n 1 12 1 . . . . . . . 2.90 parsed_2n6n 1 13 1 . . . . . . . 2.10 parsed_2n6n 1 14 1 . . . . . . . 3.50 parsed_2n6n 1 15 1 . . . . . . . 3.50 parsed_2n6n 1 16 1 . . . . . . . 2.10 parsed_2n6n 1 17 1 . . . . . . . 3.50 parsed_2n6n 1 18 1 . . . . . . . 3.50 parsed_2n6n 1 19 1 . . . . . . . 2.10 parsed_2n6n 1 20 1 . . . . . . . 3.50 parsed_2n6n 1 21 1 . . . . . . . 3.50 parsed_2n6n 1 22 1 . . . . . . . 2.10 parsed_2n6n 1 23 1 . . . . . . . 3.50 parsed_2n6n 1 24 1 . . . . . . . 3.50 parsed_2n6n 1 stop_ save_
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