NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
633929 | 6bvu | 30380 | cing | 2-parsed | STAR | entry | full | 132 |
data_6bvu_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_6bvu _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_6bvu 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_6bvu _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 6bvu "Master copy" parsed_6bvu stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_6bvu _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 6bvu.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6bvu 1 1 6bvu.mr . . XPLOR/CNS 2 distance NOE simple 121 parsed_6bvu 1 1 6bvu.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 7 parsed_6bvu 1 1 6bvu.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 4 parsed_6bvu 1 1 6bvu.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6bvu 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_6bvu _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 BIOSYNTHETIC PROTEIN 13-DEC-17 6BVU *TITLE SFTI-HFRW-1 *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: TRYPSIN INHIBITOR 1 HFRW-1; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: HELIANTHUS ANNUUS; *SOURCE 4 ORGANISM_COMMON: COMMON SUNFLOWER; *SOURCE 5 ORGANISM_TAXID: 4232 *KEYWDS BIOSYNTHETIC PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR C.I.SCHROEDER *REVDAT 1 19-DEC-18 6BVU 0 ; save_ save_CNS/XPLOR_distance_constraints_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_6bvu _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 2 _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_6bvu 1 2 1 . . . parsed_6bvu 1 3 1 . . . parsed_6bvu 1 4 1 . . . parsed_6bvu 1 5 1 . . . parsed_6bvu 1 6 1 . . . parsed_6bvu 1 7 1 . . . parsed_6bvu 1 8 1 . . . parsed_6bvu 1 9 1 . . . parsed_6bvu 1 10 1 . . . parsed_6bvu 1 11 1 . . . parsed_6bvu 1 12 1 . . . parsed_6bvu 1 13 1 . . . parsed_6bvu 1 14 1 . . . parsed_6bvu 1 15 1 . . . parsed_6bvu 1 16 1 . . . parsed_6bvu 1 17 1 . . . parsed_6bvu 1 18 1 . . . parsed_6bvu 1 19 1 . . . parsed_6bvu 1 20 1 . . . parsed_6bvu 1 21 1 . . . parsed_6bvu 1 22 1 . . . parsed_6bvu 1 23 1 . . . parsed_6bvu 1 24 1 . . . parsed_6bvu 1 25 1 . . . parsed_6bvu 1 26 1 . . . parsed_6bvu 1 27 1 . . . parsed_6bvu 1 28 1 . . . parsed_6bvu 1 29 1 . . . parsed_6bvu 1 30 1 . . . parsed_6bvu 1 31 1 . . . parsed_6bvu 1 32 1 . . . parsed_6bvu 1 33 1 . . . parsed_6bvu 1 34 1 . . . parsed_6bvu 1 35 1 . . . parsed_6bvu 1 36 1 . . . parsed_6bvu 1 37 1 . . . parsed_6bvu 1 38 1 . . . parsed_6bvu 1 39 1 . . . parsed_6bvu 1 40 1 . . . parsed_6bvu 1 41 1 . . . parsed_6bvu 1 42 1 . . . parsed_6bvu 1 43 1 . . . parsed_6bvu 1 44 1 . . . parsed_6bvu 1 45 1 . . . parsed_6bvu 1 46 1 . . . parsed_6bvu 1 47 1 . . . parsed_6bvu 1 48 1 . . . parsed_6bvu 1 49 1 . . . parsed_6bvu 1 50 1 . . . parsed_6bvu 1 51 1 . . . parsed_6bvu 1 52 1 . . . parsed_6bvu 1 53 1 . . . parsed_6bvu 1 54 1 . . . parsed_6bvu 1 55 1 . . . parsed_6bvu 1 56 1 . . . parsed_6bvu 1 57 1 . . . parsed_6bvu 1 58 1 . . . parsed_6bvu 1 59 1 . . . parsed_6bvu 1 60 1 . . . parsed_6bvu 1 61 1 . . . parsed_6bvu 1 62 1 . . . parsed_6bvu 1 63 1 . . . parsed_6bvu 1 64 1 . . . parsed_6bvu 1 65 1 . . . parsed_6bvu 1 66 1 . . . parsed_6bvu 1 67 1 . . . parsed_6bvu 1 68 1 . . . parsed_6bvu 1 69 1 . . . parsed_6bvu 1 70 1 . . . parsed_6bvu 1 71 1 . . . parsed_6bvu 1 72 1 . . . parsed_6bvu 1 73 1 . . . parsed_6bvu 1 74 1 . . . parsed_6bvu 1 75 1 . . . parsed_6bvu 1 76 1 . . . parsed_6bvu 1 77 1 . . . parsed_6bvu 1 78 1 . . . parsed_6bvu 1 79 1 . . . parsed_6bvu 1 80 1 . . . parsed_6bvu 1 81 1 . . . parsed_6bvu 1 82 1 . . . parsed_6bvu 1 83 1 . . . parsed_6bvu 1 84 1 . . . parsed_6bvu 1 85 1 . . . parsed_6bvu 1 86 1 . . . parsed_6bvu 1 87 1 . . . parsed_6bvu 1 88 1 . . . parsed_6bvu 1 89 1 . . . parsed_6bvu 1 90 1 . . . parsed_6bvu 1 91 1 . . . parsed_6bvu 1 92 1 . . . parsed_6bvu 1 93 1 . . . parsed_6bvu 1 94 1 . . . parsed_6bvu 1 95 1 . . . parsed_6bvu 1 96 1 . . . parsed_6bvu 1 97 1 . . . parsed_6bvu 1 98 1 . . . parsed_6bvu 1 99 1 . . . parsed_6bvu 1 100 1 . . . parsed_6bvu 1 101 1 . . . parsed_6bvu 1 102 1 . . . parsed_6bvu 1 103 1 . . . parsed_6bvu 1 104 1 . . . parsed_6bvu 1 105 1 . . . parsed_6bvu 1 106 1 . . . parsed_6bvu 1 107 1 . . . parsed_6bvu 1 108 1 . . . parsed_6bvu 1 109 1 . . . parsed_6bvu 1 110 1 . . . parsed_6bvu 1 111 1 . . . parsed_6bvu 1 112 1 . . . parsed_6bvu 1 113 1 . . . parsed_6bvu 1 114 1 . . . parsed_6bvu 1 115 1 . . . parsed_6bvu 1 116 1 . . . parsed_6bvu 1 117 1 . . . parsed_6bvu 1 118 1 . . . parsed_6bvu 1 119 1 . . . parsed_6bvu 1 120 1 . . . parsed_6bvu 1 121 1 . . . parsed_6bvu 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 . . . . . . . . . 4 . HA parsed_6bvu 1 1 1 2 . . . . . . . . . 5 . HN parsed_6bvu 1 2 1 1 . . . . . . . . . 13 . HA parsed_6bvu 1 2 1 2 . . . . . . . . . 13 . HD1 parsed_6bvu 1 3 1 1 . . . . . . . . . 13 . HA parsed_6bvu 1 3 1 2 . . . . . . . . . 13 . HE3 parsed_6bvu 1 4 1 1 . . . . . . . . . 13 . HB2 parsed_6bvu 1 4 1 2 . . . . . . . . . 14 . HN parsed_6bvu 1 5 1 1 . . . . . . . . . 13 . HB1 parsed_6bvu 1 5 1 2 . . . . . . . . . 14 . HN parsed_6bvu 1 6 1 1 . . . . . . . . . 14 . HN parsed_6bvu 1 6 1 2 . . . . . . . . . 14 . HB2 parsed_6bvu 1 7 1 1 . . . . . . . . . 14 . HN parsed_6bvu 1 7 1 2 . . . . . . . . . 14 . HB1 parsed_6bvu 1 8 1 1 . . . . . . . . . 14 . HN parsed_6bvu 1 8 1 2 . . . . . . . . . 14 . QG parsed_6bvu 1 9 1 1 . . . . . . . . . 14 . HA parsed_6bvu 1 9 1 2 . . . . . . . . . 14 . QG parsed_6bvu 1 10 1 1 . . . . . . . . . 14 . HB2 parsed_6bvu 1 10 1 2 . . . . . . . . . 14 . QG parsed_6bvu 1 11 1 1 . . . . . . . . . 14 . HB1 parsed_6bvu 1 11 1 2 . . . . . . . . . 14 . QG parsed_6bvu 1 12 1 1 . . . . . . . . . 5 . HA parsed_6bvu 1 12 1 2 . . . . . . . . . 5 . QD1 parsed_6bvu 1 13 1 1 . . . . . . . . . 12 . HN parsed_6bvu 1 13 1 2 . . . . . . . . . 12 . HG2 parsed_6bvu 1 14 1 1 . . . . . . . . . 12 . HN parsed_6bvu 1 14 1 2 . . . . . . . . . 12 . HG1 parsed_6bvu 1 15 1 1 . . . . . . . . . 12 . HA parsed_6bvu 1 15 1 2 . . . . . . . . . 12 . QD parsed_6bvu 1 16 1 1 . . . . . . . . . 5 . HN parsed_6bvu 1 16 1 2 . . . . . . . . . 5 . QD1 parsed_6bvu 1 17 1 1 . . . . . . . . . 5 . HN parsed_6bvu 1 17 1 2 . . . . . . . . . 5 . HG11 parsed_6bvu 1 18 1 1 . . . . . . . . . 5 . HN parsed_6bvu 1 18 1 2 . . . . . . . . . 5 . HG12 parsed_6bvu 1 19 1 1 . . . . . . . . . 5 . HN parsed_6bvu 1 19 1 2 . . . . . . . . . 5 . HB parsed_6bvu 1 20 1 1 . . . . . . . . . 1 . HN parsed_6bvu 1 20 1 2 . . . . . . . . . 14 . HA parsed_6bvu 1 21 1 1 . . . . . . . . . 1 . HA parsed_6bvu 1 21 1 2 . . . . . . . . . 14 . HA parsed_6bvu 1 22 1 1 . . . . . . . . . 1 . HN parsed_6bvu 1 22 1 2 . . . . . . . . . 14 . HB2 parsed_6bvu 1 23 1 1 . . . . . . . . . 1 . HN parsed_6bvu 1 23 1 2 . . . . . . . . . 14 . HB1 parsed_6bvu 1 24 1 1 . . . . . . . . . 1 . HN parsed_6bvu 1 24 1 2 . . . . . . . . . 14 . QG parsed_6bvu 1 25 1 1 . . . . . . . . . 2 . HN parsed_6bvu 1 25 1 2 . . . . . . . . . 2 . HB parsed_6bvu 1 26 1 1 . . . . . . . . . 2 . HN parsed_6bvu 1 26 1 2 . . . . . . . . . 2 . QG2 parsed_6bvu 1 27 1 1 . . . . . . . . . 1 . HA parsed_6bvu 1 27 1 2 . . . . . . . . . 2 . HN parsed_6bvu 1 28 1 1 . . . . . . . . . 2 . HB parsed_6bvu 1 28 1 2 . . . . . . . . . 3 . HN parsed_6bvu 1 29 1 1 . . . . . . . . . 2 . HA parsed_6bvu 1 29 1 2 . . . . . . . . . 3 . HN parsed_6bvu 1 30 1 1 . . . . . . . . . 3 . HN parsed_6bvu 1 30 1 2 . . . . . . . . . 3 . QB parsed_6bvu 1 31 1 1 . . . . . . . . . 2 . HA parsed_6bvu 1 31 1 2 . . . . . . . . . 2 . QG2 parsed_6bvu 1 32 1 1 . . . . . . . . . 3 . HA parsed_6bvu 1 32 1 2 . . . . . . . . . 4 . HN parsed_6bvu 1 33 1 1 . . . . . . . . . 2 . QG2 parsed_6bvu 1 33 1 2 . . . . . . . . . 4 . HN parsed_6bvu 1 34 1 1 . . . . . . . . . 3 . QB parsed_6bvu 1 34 1 2 . . . . . . . . . 4 . HN parsed_6bvu 1 35 1 1 . . . . . . . . . 6 . HA parsed_6bvu 1 35 1 2 . . . . . . . . . 7 . HD2 parsed_6bvu 1 36 1 1 . . . . . . . . . 6 . HA parsed_6bvu 1 36 1 2 . . . . . . . . . 7 . HD1 parsed_6bvu 1 37 1 1 . . . . . . . . . 8 . HN parsed_6bvu 1 37 1 2 . . . . . . . . . 8 . HB parsed_6bvu 1 38 1 1 . . . . . . . . . 8 . HN parsed_6bvu 1 38 1 2 . . . . . . . . . 8 . HG12 parsed_6bvu 1 39 1 1 . . . . . . . . . 8 . HN parsed_6bvu 1 39 1 2 . . . . . . . . . 8 . HG11 parsed_6bvu 1 40 1 1 . . . . . . . . . 8 . HN parsed_6bvu 1 40 1 2 . . . . . . . . . 8 . QD1 parsed_6bvu 1 41 1 1 . . . . . . . . . 8 . HA parsed_6bvu 1 41 1 2 . . . . . . . . . 8 . HG11 parsed_6bvu 1 42 1 1 . . . . . . . . . 8 . HA parsed_6bvu 1 42 1 2 . . . . . . . . . 8 . QD1 parsed_6bvu 1 43 1 1 . . . . . . . . . 8 . HA parsed_6bvu 1 43 1 2 . . . . . . . . . 8 . HG12 parsed_6bvu 1 44 1 1 . . . . . . . . . 7 . HA parsed_6bvu 1 44 1 2 . . . . . . . . . 8 . HN parsed_6bvu 1 45 1 1 . . . . . . . . . 7 . HB1 parsed_6bvu 1 45 1 2 . . . . . . . . . 8 . HN parsed_6bvu 1 46 1 1 . . . . . . . . . 7 . HB2 parsed_6bvu 1 46 1 2 . . . . . . . . . 8 . HN parsed_6bvu 1 47 1 1 . . . . . . . . . 8 . QD1 parsed_6bvu 1 47 1 2 . . . . . . . . . 9 . HN parsed_6bvu 1 48 1 1 . . . . . . . . . 8 . HG11 parsed_6bvu 1 48 1 2 . . . . . . . . . 9 . HN parsed_6bvu 1 49 1 1 . . . . . . . . . 8 . HG12 parsed_6bvu 1 49 1 2 . . . . . . . . . 9 . HN parsed_6bvu 1 50 1 1 . . . . . . . . . 8 . HB parsed_6bvu 1 50 1 2 . . . . . . . . . 9 . HN parsed_6bvu 1 51 1 1 . . . . . . . . . 8 . HA parsed_6bvu 1 51 1 2 . . . . . . . . . 9 . HN parsed_6bvu 1 52 1 1 . . . . . . . . . 9 . HN parsed_6bvu 1 52 1 2 . . . . . . . . . 9 . QB parsed_6bvu 1 53 1 1 . . . . . . . . . 10 . HN parsed_6bvu 1 53 1 2 . . . . . . . . . 10 . HB1 parsed_6bvu 1 54 1 1 . . . . . . . . . 10 . HN parsed_6bvu 1 54 1 2 . . . . . . . . . 10 . HB2 parsed_6bvu 1 55 1 1 . . . . . . . . . 9 . HA parsed_6bvu 1 55 1 2 . . . . . . . . . 10 . HN parsed_6bvu 1 56 1 1 . . . . . . . . . 9 . QB parsed_6bvu 1 56 1 2 . . . . . . . . . 10 . HN parsed_6bvu 1 57 1 1 . . . . . . . . . 1 . HA parsed_6bvu 1 57 1 2 . . . . . . . . . 9 . HA parsed_6bvu 1 58 1 1 . . . . . . . . . 11 . HN parsed_6bvu 1 58 1 2 . . . . . . . . . 11 . HB2 parsed_6bvu 1 59 1 1 . . . . . . . . . 11 . HN parsed_6bvu 1 59 1 2 . . . . . . . . . 11 . HB1 parsed_6bvu 1 60 1 1 . . . . . . . . . 10 . HA parsed_6bvu 1 60 1 2 . . . . . . . . . 11 . HN parsed_6bvu 1 61 1 1 . . . . . . . . . 11 . HA parsed_6bvu 1 61 1 2 . . . . . . . . . 11 . QE parsed_6bvu 1 62 1 1 . . . . . . . . . 11 . HA parsed_6bvu 1 62 1 2 . . . . . . . . . 11 . QD parsed_6bvu 1 63 1 1 . . . . . . . . . 11 . HA parsed_6bvu 1 63 1 2 . . . . . . . . . 12 . HN parsed_6bvu 1 64 1 1 . . . . . . . . . 11 . HB1 parsed_6bvu 1 64 1 2 . . . . . . . . . 12 . HN parsed_6bvu 1 65 1 1 . . . . . . . . . 11 . HB2 parsed_6bvu 1 65 1 2 . . . . . . . . . 12 . HN parsed_6bvu 1 66 1 1 . . . . . . . . . 4 . HN parsed_6bvu 1 66 1 2 . . . . . . . . . 7 . HA parsed_6bvu 1 67 1 1 . . . . . . . . . 10 . HD2 parsed_6bvu 1 67 1 2 . . . . . . . . . 14 . HB1 parsed_6bvu 1 68 1 1 . . . . . . . . . 10 . HD2 parsed_6bvu 1 68 1 2 . . . . . . . . . 14 . HB2 parsed_6bvu 1 69 1 1 . . . . . . . . . 13 . HN parsed_6bvu 1 69 1 2 . . . . . . . . . 13 . HB1 parsed_6bvu 1 70 1 1 . . . . . . . . . 13 . HN parsed_6bvu 1 70 1 2 . . . . . . . . . 13 . HB2 parsed_6bvu 1 71 1 1 . . . . . . . . . 2 . HN parsed_6bvu 1 71 1 2 . . . . . . . . . 8 . HN parsed_6bvu 1 72 1 1 . . . . . . . . . 3 . HN parsed_6bvu 1 72 1 2 . . . . . . . . . 4 . HN parsed_6bvu 1 73 1 1 . . . . . . . . . 8 . HN parsed_6bvu 1 73 1 2 . . . . . . . . . 9 . HN parsed_6bvu 1 74 1 1 . . . . . . . . . 1 . HN parsed_6bvu 1 74 1 2 . . . . . . . . . 14 . HN parsed_6bvu 1 75 1 1 . . . . . . . . . 11 . HN parsed_6bvu 1 75 1 2 . . . . . . . . . 12 . HN parsed_6bvu 1 76 1 1 . . . . . . . . . 10 . HN parsed_6bvu 1 76 1 2 . . . . . . . . . 13 . HB1 parsed_6bvu 1 77 1 1 . . . . . . . . . 10 . HN parsed_6bvu 1 77 1 2 . . . . . . . . . 13 . HB2 parsed_6bvu 1 78 1 1 . . . . . . . . . 11 . HA parsed_6bvu 1 78 1 2 . . . . . . . . . 13 . HN parsed_6bvu 1 79 1 1 . . . . . . . . . 2 . HN parsed_6bvu 1 79 1 2 . . . . . . . . . 9 . HA parsed_6bvu 1 80 1 1 . . . . . . . . . 1 . HN parsed_6bvu 1 80 1 2 . . . . . . . . . 9 . HA parsed_6bvu 1 81 1 1 . . . . . . . . . 1 . HA parsed_6bvu 1 81 1 2 . . . . . . . . . 10 . HN parsed_6bvu 1 82 1 1 . . . . . . . . . 2 . HN parsed_6bvu 1 82 1 2 . . . . . . . . . 8 . HB parsed_6bvu 1 83 1 1 . . . . . . . . . 2 . HN parsed_6bvu 1 83 1 2 . . . . . . . . . 8 . QD1 parsed_6bvu 1 84 1 1 . . . . . . . . . 10 . HN parsed_6bvu 1 84 1 2 . . . . . . . . . 14 . HB1 parsed_6bvu 1 85 1 1 . . . . . . . . . 10 . HN parsed_6bvu 1 85 1 2 . . . . . . . . . 14 . HB2 parsed_6bvu 1 86 1 1 . . . . . . . . . 12 . HB2 parsed_6bvu 1 86 1 2 . . . . . . . . . 13 . HN parsed_6bvu 1 87 1 1 . . . . . . . . . 12 . HB1 parsed_6bvu 1 87 1 2 . . . . . . . . . 13 . HN parsed_6bvu 1 88 1 1 . . . . . . . . . 12 . HG2 parsed_6bvu 1 88 1 2 . . . . . . . . . 13 . HN parsed_6bvu 1 89 1 1 . . . . . . . . . 12 . HG1 parsed_6bvu 1 89 1 2 . . . . . . . . . 13 . HN parsed_6bvu 1 90 1 1 . . . . . . . . . 6 . HA parsed_6bvu 1 90 1 2 . . . . . . . . . 7 . QG parsed_6bvu 1 91 1 1 . . . . . . . . . 5 . HA parsed_6bvu 1 91 1 2 . . . . . . . . . 6 . HA parsed_6bvu 1 92 1 1 . . . . . . . . . 10 . HN parsed_6bvu 1 92 1 2 . . . . . . . . . 13 . HN parsed_6bvu 1 93 1 1 . . . . . . . . . 1 . HN parsed_6bvu 1 93 1 2 . . . . . . . . . 1 . QB parsed_6bvu 1 94 1 1 . . . . . . . . . 1 . HN parsed_6bvu 1 94 1 2 . . . . . . . . . 14 . QB parsed_6bvu 1 95 1 1 . . . . . . . . . 1 . QB parsed_6bvu 1 95 1 2 . . . . . . . . . 2 . HN parsed_6bvu 1 96 1 1 . . . . . . . . . 2 . HN parsed_6bvu 1 96 1 2 . . . . . . . . . 7 . QB parsed_6bvu 1 97 1 1 . . . . . . . . . 4 . HN parsed_6bvu 1 97 1 2 . . . . . . . . . 4 . QB parsed_6bvu 1 98 1 1 . . . . . . . . . 4 . HN parsed_6bvu 1 98 1 2 . . . . . . . . . 7 . QB parsed_6bvu 1 99 1 1 . . . . . . . . . 4 . QB parsed_6bvu 1 99 1 2 . . . . . . . . . 5 . HN parsed_6bvu 1 100 1 1 . . . . . . . . . 5 . HN parsed_6bvu 1 100 1 2 . . . . . . . . . 5 . QG1 parsed_6bvu 1 101 1 1 . . . . . . . . . 5 . HA parsed_6bvu 1 101 1 2 . . . . . . . . . 6 . QB parsed_6bvu 1 102 1 1 . . . . . . . . . 6 . HA parsed_6bvu 1 102 1 2 . . . . . . . . . 7 . QD parsed_6bvu 1 103 1 1 . . . . . . . . . 6 . QB parsed_6bvu 1 103 1 2 . . . . . . . . . 7 . QD parsed_6bvu 1 104 1 1 . . . . . . . . . 7 . QB parsed_6bvu 1 104 1 2 . . . . . . . . . 8 . HN parsed_6bvu 1 105 1 1 . . . . . . . . . 8 . HN parsed_6bvu 1 105 1 2 . . . . . . . . . 8 . QG1 parsed_6bvu 1 106 1 1 . . . . . . . . . 10 . HN parsed_6bvu 1 106 1 2 . . . . . . . . . 10 . QB parsed_6bvu 1 107 1 1 . . . . . . . . . 10 . HN parsed_6bvu 1 107 1 2 . . . . . . . . . 13 . QB parsed_6bvu 1 108 1 1 . . . . . . . . . 10 . QB parsed_6bvu 1 108 1 2 . . . . . . . . . 13 . HN parsed_6bvu 1 109 1 1 . . . . . . . . . 10 . QB parsed_6bvu 1 109 1 2 . . . . . . . . . 13 . QB parsed_6bvu 1 110 1 1 . . . . . . . . . 10 . HD2 parsed_6bvu 1 110 1 2 . . . . . . . . . 14 . QB parsed_6bvu 1 111 1 1 . . . . . . . . . 11 . HN parsed_6bvu 1 111 1 2 . . . . . . . . . 11 . QB parsed_6bvu 1 112 1 1 . . . . . . . . . 11 . QB parsed_6bvu 1 112 1 2 . . . . . . . . . 12 . HN parsed_6bvu 1 113 1 1 . . . . . . . . . 11 . QB parsed_6bvu 1 113 1 2 . . . . . . . . . 13 . HN parsed_6bvu 1 114 1 1 . . . . . . . . . 12 . HN parsed_6bvu 1 114 1 2 . . . . . . . . . 12 . QB parsed_6bvu 1 115 1 1 . . . . . . . . . 12 . HN parsed_6bvu 1 115 1 2 . . . . . . . . . 12 . QG parsed_6bvu 1 116 1 1 . . . . . . . . . 12 . QB parsed_6bvu 1 116 1 2 . . . . . . . . . 12 . QG parsed_6bvu 1 117 1 1 . . . . . . . . . 13 . HN parsed_6bvu 1 117 1 2 . . . . . . . . . 13 . QB parsed_6bvu 1 118 1 1 . . . . . . . . . 13 . QB parsed_6bvu 1 118 1 2 . . . . . . . . . 13 . HE3 parsed_6bvu 1 119 1 1 . . . . . . . . . 13 . QB parsed_6bvu 1 119 1 2 . . . . . . . . . 14 . HN parsed_6bvu 1 120 1 1 . . . . . . . . . 14 . HN parsed_6bvu 1 120 1 2 . . . . . . . . . 14 . QB parsed_6bvu 1 121 1 1 . . . . . . . . . 14 . QB parsed_6bvu 1 121 1 2 . . . . . . . . . 14 . QG parsed_6bvu 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 . . . . . 3.11 0.00 3.11 parsed_6bvu 1 2 1 . . . . . 4.39 0.00 4.39 parsed_6bvu 1 3 1 . . . . . 4.30 0.00 4.30 parsed_6bvu 1 4 1 . . . . . 4.19 0.00 4.19 parsed_6bvu 1 5 1 . . . . . 4.19 0.00 4.19 parsed_6bvu 1 6 1 . . . . . 3.93 0.00 3.93 parsed_6bvu 1 7 1 . . . . . 3.93 0.00 3.93 parsed_6bvu 1 8 1 . . . . . 4.03 0.00 4.03 parsed_6bvu 1 9 1 . . . . . 3.83 0.00 3.83 parsed_6bvu 1 10 1 . . . . . 2.61 0.00 2.61 parsed_6bvu 1 11 1 . . . . . 2.61 0.00 2.61 parsed_6bvu 1 12 1 . . . . . 3.96 0.00 3.96 parsed_6bvu 1 13 1 . . . . . 4.73 0.00 4.73 parsed_6bvu 1 14 1 . . . . . 4.73 0.00 4.73 parsed_6bvu 1 15 1 . . . . . 5.22 0.00 5.22 parsed_6bvu 1 16 1 . . . . . 4.84 0.00 4.84 parsed_6bvu 1 17 1 . . . . . 4.82 0.00 4.82 parsed_6bvu 1 18 1 . . . . . 4.82 0.00 4.82 parsed_6bvu 1 19 1 . . . . . 3.42 0.00 3.42 parsed_6bvu 1 20 1 . . . . . 2.81 0.00 2.81 parsed_6bvu 1 21 1 . . . . . 4.76 0.00 4.76 parsed_6bvu 1 22 1 . . . . . 4.68 0.00 4.68 parsed_6bvu 1 23 1 . . . . . 4.68 0.00 4.68 parsed_6bvu 1 24 1 . . . . . 4.66 0.00 4.66 parsed_6bvu 1 25 1 . . . . . 3.99 0.00 3.99 parsed_6bvu 1 26 1 . . . . . 3.34 0.00 3.34 parsed_6bvu 1 27 1 . . . . . 2.79 0.00 2.79 parsed_6bvu 1 28 1 . . . . . 3.18 0.00 3.18 parsed_6bvu 1 29 1 . . . . . 2.86 0.00 2.86 parsed_6bvu 1 30 1 . . . . . 3.10 0.00 3.10 parsed_6bvu 1 31 1 . . . . . 3.33 0.00 3.33 parsed_6bvu 1 32 1 . . . . . 3.45 0.00 3.45 parsed_6bvu 1 33 1 . . . . . 4.96 0.00 4.96 parsed_6bvu 1 34 1 . . . . . 5.12 0.00 5.12 parsed_6bvu 1 35 1 . . . . . 3.24 0.00 3.24 parsed_6bvu 1 36 1 . . . . . 3.24 0.00 3.24 parsed_6bvu 1 37 1 . . . . . 3.46 0.00 3.46 parsed_6bvu 1 38 1 . . . . . 4.57 0.00 4.57 parsed_6bvu 1 39 1 . . . . . 4.57 0.00 4.57 parsed_6bvu 1 40 1 . . . . . 4.50 0.00 4.50 parsed_6bvu 1 41 1 . . . . . 4.15 0.00 4.15 parsed_6bvu 1 42 1 . . . . . 3.46 0.00 3.46 parsed_6bvu 1 43 1 . . . . . 4.15 0.00 4.15 parsed_6bvu 1 44 1 . . . . . 2.96 0.00 2.96 parsed_6bvu 1 45 1 . . . . . 4.64 0.00 4.64 parsed_6bvu 1 46 1 . . . . . 4.64 0.00 4.64 parsed_6bvu 1 47 1 . . . . . 4.81 0.00 4.81 parsed_6bvu 1 48 1 . . . . . 5.50 0.00 5.50 parsed_6bvu 1 49 1 . . . . . 5.50 0.00 5.50 parsed_6bvu 1 50 1 . . . . . 5.06 0.00 5.06 parsed_6bvu 1 51 1 . . . . . 2.75 0.00 2.75 parsed_6bvu 1 52 1 . . . . . 3.29 0.00 3.29 parsed_6bvu 1 53 1 . . . . . 3.86 0.00 3.86 parsed_6bvu 1 54 1 . . . . . 3.86 0.00 3.86 parsed_6bvu 1 55 1 . . . . . 2.86 0.00 2.86 parsed_6bvu 1 56 1 . . . . . 3.65 0.00 3.65 parsed_6bvu 1 57 1 . . . . . 3.20 0.00 3.20 parsed_6bvu 1 58 1 . . . . . 3.50 0.00 3.50 parsed_6bvu 1 59 1 . . . . . 3.50 0.00 3.50 parsed_6bvu 1 60 1 . . . . . 3.14 0.00 3.14 parsed_6bvu 1 61 1 . . . . . 4.73 0.00 4.73 parsed_6bvu 1 62 1 . . . . . 3.38 0.00 3.38 parsed_6bvu 1 63 1 . . . . . 2.94 0.00 2.94 parsed_6bvu 1 64 1 . . . . . 4.83 0.00 4.83 parsed_6bvu 1 65 1 . . . . . 4.83 0.00 4.83 parsed_6bvu 1 66 1 . . . . . 4.03 0.00 4.03 parsed_6bvu 1 67 1 . . . . . 5.29 0.00 5.29 parsed_6bvu 1 68 1 . . . . . 5.29 0.00 5.29 parsed_6bvu 1 69 1 . . . . . 3.94 0.00 3.94 parsed_6bvu 1 70 1 . . . . . 3.94 0.00 3.94 parsed_6bvu 1 71 1 . . . . . 3.77 0.00 3.77 parsed_6bvu 1 72 1 . . . . . 4.03 0.00 4.03 parsed_6bvu 1 73 1 . . . . . 5.16 0.00 5.16 parsed_6bvu 1 74 1 . . . . . 5.26 0.00 5.26 parsed_6bvu 1 75 1 . . . . . 5.34 0.00 5.34 parsed_6bvu 1 76 1 . . . . . 5.50 0.00 5.50 parsed_6bvu 1 77 1 . . . . . 5.50 0.00 5.50 parsed_6bvu 1 78 1 . . . . . 4.73 0.00 4.73 parsed_6bvu 1 79 1 . . . . . 4.24 0.00 4.24 parsed_6bvu 1 80 1 . . . . . 5.38 0.00 5.38 parsed_6bvu 1 81 1 . . . . . 4.65 0.00 4.65 parsed_6bvu 1 82 1 . . . . . 4.63 0.00 4.63 parsed_6bvu 1 83 1 . . . . . 5.50 0.00 5.50 parsed_6bvu 1 84 1 . . . . . 5.50 0.00 5.50 parsed_6bvu 1 85 1 . . . . . 5.50 0.00 5.50 parsed_6bvu 1 86 1 . . . . . 4.73 0.00 4.73 parsed_6bvu 1 87 1 . . . . . 4.73 0.00 4.73 parsed_6bvu 1 88 1 . . . . . 5.50 0.00 5.50 parsed_6bvu 1 89 1 . . . . . 5.50 0.00 5.50 parsed_6bvu 1 90 1 . . . . . 4.94 0.00 4.94 parsed_6bvu 1 91 1 . . . . . 2.92 0.00 2.92 parsed_6bvu 1 92 1 . . . . . 5.50 0.00 5.50 parsed_6bvu 1 93 1 . . . . . 3.10 0.00 3.10 parsed_6bvu 1 94 1 . . . . . 4.05 0.00 4.05 parsed_6bvu 1 95 1 . . . . . 3.84 0.00 3.84 parsed_6bvu 1 96 1 . . . . . 5.34 0.00 5.34 parsed_6bvu 1 97 1 . . . . . 3.65 0.00 3.65 parsed_6bvu 1 98 1 . . . . . 5.03 0.00 5.03 parsed_6bvu 1 99 1 . . . . . 3.26 0.00 3.26 parsed_6bvu 1 100 1 . . . . . 4.18 0.00 4.18 parsed_6bvu 1 101 1 . . . . . 4.76 0.00 4.76 parsed_6bvu 1 102 1 . . . . . 2.79 0.00 2.79 parsed_6bvu 1 103 1 . . . . . 3.39 0.00 3.39 parsed_6bvu 1 104 1 . . . . . 3.98 0.00 3.98 parsed_6bvu 1 105 1 . . . . . 3.91 0.00 3.91 parsed_6bvu 1 106 1 . . . . . 3.23 0.00 3.23 parsed_6bvu 1 107 1 . . . . . 4.68 0.00 4.68 parsed_6bvu 1 108 1 . . . . . 5.34 0.00 5.34 parsed_6bvu 1 109 1 . . . . . 2.99 0.00 2.99 parsed_6bvu 1 110 1 . . . . . 4.48 0.00 4.48 parsed_6bvu 1 111 1 . . . . . 2.90 0.00 2.90 parsed_6bvu 1 112 1 . . . . . 4.10 0.00 4.10 parsed_6bvu 1 113 1 . . . . . 5.18 0.00 5.18 parsed_6bvu 1 114 1 . . . . . 3.42 0.00 3.42 parsed_6bvu 1 115 1 . . . . . 3.97 0.00 3.97 parsed_6bvu 1 116 1 . . . . . 2.33 0.00 2.33 parsed_6bvu 1 117 1 . . . . . 3.20 0.00 3.20 parsed_6bvu 1 118 1 . . . . . 3.70 0.00 3.70 parsed_6bvu 1 119 1 . . . . . 3.42 0.00 3.42 parsed_6bvu 1 120 1 . . . . . 3.35 0.00 3.35 parsed_6bvu 1 121 1 . . . . . 2.22 0.00 2.22 parsed_6bvu 1 stop_ loop_ _Dist_constraint_comment_org.ID _Dist_constraint_comment_org.Comment_text _Dist_constraint_comment_org.Comment_begin_line _Dist_constraint_comment_org.Comment_begin_column _Dist_constraint_comment_org.Comment_end_line _Dist_constraint_comment_org.Comment_end_column _Dist_constraint_comment_org.Entry_ID _Dist_constraint_comment_org.Distance_constraint_list_ID 1 "Distance restraints" 2 1 2 21 parsed_6bvu 1 stop_ loop_ _Dist_constraint_parse_err.ID _Dist_constraint_parse_err.Content _Dist_constraint_parse_err.Begin_line _Dist_constraint_parse_err.Begin_column _Dist_constraint_parse_err.End_line _Dist_constraint_parse_err.End_column _Dist_constraint_parse_err.Entry_ID _Dist_constraint_parse_err.Distance_constraint_list_ID 1 "# Restraints file 1: restraints.tbl" 1 1 1 35 parsed_6bvu 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_6bvu _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 8 . C . 9 . N . 9 . CA . 9 . C parsed_6bvu 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 9 . C . 10 . N . 10 . CA . 10 . C parsed_6bvu 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 1 . C . 2 . N . 2 . CA . 2 . C parsed_6bvu 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_6bvu 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -103.7 -43.7 . . 3 . C . 4 . N . 4 . CA . 4 . C parsed_6bvu 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.0 -65.6 . . 4 . C . 5 . N . 5 . CA . 5 . C parsed_6bvu 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 14 . C . 1 . N . 1 . CA . 1 . C parsed_6bvu 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 "Dihedral restraints" 1 1 1 21 parsed_6bvu 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_6bvu _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _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_6bvu 2 2 1 . . . parsed_6bvu 2 3 1 . . . parsed_6bvu 2 4 1 . . . parsed_6bvu 2 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 . . . . . . . . . 2 . HN parsed_6bvu 2 1 1 2 . . . . . . . . . 8 . O parsed_6bvu 2 2 1 1 . . . . . . . . . 2 . N parsed_6bvu 2 2 1 2 . . . . . . . . . 8 . O parsed_6bvu 2 3 1 1 . . . . . . . . . 10 . HN parsed_6bvu 2 3 1 2 . . . . . . . . . 14 . O parsed_6bvu 2 4 1 1 . . . . . . . . . 10 . N parsed_6bvu 2 4 1 2 . . . . . . . . . 14 . O parsed_6bvu 2 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 . . . . . 2.30 0.00 2.30 parsed_6bvu 2 2 1 . . . . . 3.30 0.00 3.30 parsed_6bvu 2 3 1 . . . . . 2.30 0.00 2.30 parsed_6bvu 2 4 1 . . . . . 3.30 0.00 3.30 parsed_6bvu 2 stop_ loop_ _Dist_constraint_comment_org.ID _Dist_constraint_comment_org.Comment_text _Dist_constraint_comment_org.Comment_begin_line _Dist_constraint_comment_org.Comment_begin_column _Dist_constraint_comment_org.Comment_end_line _Dist_constraint_comment_org.Comment_end_column _Dist_constraint_comment_org.Entry_ID _Dist_constraint_comment_org.Distance_constraint_list_ID 1 Hbonds 1 1 1 8 parsed_6bvu 2 stop_ save_
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