NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage program type subtype subsubtype item_count
28969 1acz cing 2-parsed STAR distance NOE ambi 35


data_1acz_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1acz 
    _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_1acz   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1acz 
    _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   1acz   "Master copy"    parsed_1acz   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1acz 
    _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   1acz.mr   .   .   "MR format"     1    comment                  "Not applicable"    "Not applicable"      0   parsed_1acz   1   
        1   1acz.mr   .   .    n/a            2    comment                  "Not applicable"    "Not applicable"      0   parsed_1acz   1   
        1   1acz.mr   .   .    XPLOR/CNS      3    distance                  NOE                 simple             718   parsed_1acz   1   
        1   1acz.mr   .   .    n/a            4    comment                  "Not applicable"    "Not applicable"      0   parsed_1acz   1   
        1   1acz.mr   .   .    XPLOR/CNS      5    distance                  NOE                 simple              73   parsed_1acz   1   
        1   1acz.mr   .   .    XPLOR/CNS      6    distance                 "hydrogen bond"      simple              92   parsed_1acz   1   
        1   1acz.mr   .   .    XPLOR/CNS      7    distance                  NOE                 ambi                35   parsed_1acz   1   
        1   1acz.mr   .   .    XPLOR/CNS      8   "dihedral angle"          "Not applicable"    "Not applicable"      0   parsed_1acz   1   
        1   1acz.mr   .   .    n/a            9    comment                  "Not applicable"    "Not applicable"      0   parsed_1acz   1   
        1   1acz.mr   .   .   "MR format"    10   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_1acz   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_7
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_1acz 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type     NOE 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            7 
    _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_1acz   1   
         2   1   .   .   .   parsed_1acz   1   
         3   1   .   .   .   parsed_1acz   1   
         4   1   .   .   .   parsed_1acz   1   
         5   1   .   .   .   parsed_1acz   1   
         6   1   .   .   .   parsed_1acz   1   
         7   1   .   .   .   parsed_1acz   1   
         8   1   .   .   .   parsed_1acz   1   
         9   1   .   .   .   parsed_1acz   1   
        10   1   .   .   .   parsed_1acz   1   
        11   1   .   .   .   parsed_1acz   1   
        12   1   .   .   .   parsed_1acz   1   
        13   1   .   .   .   parsed_1acz   1   
        14   1   .   .   .   parsed_1acz   1   
        15   1   .   .   .   parsed_1acz   1   
        16   1   .   .   .   parsed_1acz   1   
        17   1   .   .   .   parsed_1acz   1   
        18   1   .   .   .   parsed_1acz   1   
        19   1   .   .   .   parsed_1acz   1   
        20   1   .   .   .   parsed_1acz   1   
        21   1   .   .   .   parsed_1acz   1   
        22   1   .   .   .   parsed_1acz   1   
        23   1   .   .   .   parsed_1acz   1   
        24   1   .   .   .   parsed_1acz   1   
        25   1   .   .   .   parsed_1acz   1   
        26   1   .   .   .   parsed_1acz   1   
        27   1   .   .   .   parsed_1acz   1   
        28   1   .   .   .   parsed_1acz   1   
        29   1   .   .   .   parsed_1acz   1   
        30   1   .   .   .   parsed_1acz   1   
        31   1   .   .   .   parsed_1acz   1   
        32   1   .   .   .   parsed_1acz   1   
        33   1   .   .   .   parsed_1acz   1   
        34   1   .   .   .   parsed_1acz   1   
        35   1   .   .   .   parsed_1acz   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   .   .   .   .   .   .   .   .   .      519   .   hd#   parsed_1acz   1   
         1   1   2   .   .   .   .   .   .   .   .   .      537   .   hd#   parsed_1acz   1   
         1   1   2   .   .   .   .   .   .   .   .   .      540   .   hd#   parsed_1acz   1   
         2   1   1   .   .   .   .   .   .   .   .   .      519   .   he#   parsed_1acz   1   
         2   1   2   .   .   .   .   .   .   .   .   .      537   .   hd#   parsed_1acz   1   
         2   1   2   .   .   .   .   .   .   .   .   .      540   .   hd#   parsed_1acz   1   
         3   1   1   .   .   .   .   .   .   .   .   .      519   .   hz    parsed_1acz   1   
         3   1   2   .   .   .   .   .   .   .   .   .      537   .   hd#   parsed_1acz   1   
         3   1   2   .   .   .   .   .   .   .   .   .      540   .   hd#   parsed_1acz   1   
         4   1   1   .   .   .   .   .   .   .   .   .      531   .   hd#   parsed_1acz   1   
         4   1   2   .   .   .   .   .   .   .   .   .      524   .   ha    parsed_1acz   1   
         4   1   2   .   .   .   .   .   .   .   .   .      531   .   ha    parsed_1acz   1   
         5   1   1   .   .   .   .   .   .   .   .   .      531   .   hd#   parsed_1acz   1   
         5   1   2   .   .   .   .   .   .   .   .   .      581   .   ha    parsed_1acz   1   
         5   1   2   .   .   .   .   .   .   .   .   .      582   .   ha    parsed_1acz   1   
         6   1   1   .   .   .   .   .   .   .   .   .      532   .   hd#   parsed_1acz   1   
         6   1   2   .   .   .   .   .   .   .   .   .      580   .   hd#   parsed_1acz   1   
         6   1   2   .   .   .   .   .   .   .   .   .      582   .   hd#   parsed_1acz   1   
         7   1   1   .   .   .   .   .   .   .   .   .      536   .   hn    parsed_1acz   1   
         7   1   2   .   .   .   .   .   .   .   .   .      537   .   hd#   parsed_1acz   1   
         7   1   2   .   .   .   .   .   .   .   .   .      540   .   hd#   parsed_1acz   1   
         8   1   1   .   .   .   .   .   .   .   .   .      564   .   hd#   parsed_1acz   1   
         8   1   2   .   .   .   .   .   .   .   .   .      551   .   ha    parsed_1acz   1   
         8   1   2   .   .   .   .   .   .   .   .   .      555   .   ha    parsed_1acz   1   
         9   1   1   .   .   .   .   .   .   .   .   .      564   .   he#   parsed_1acz   1   
         9   1   2   .   .   .   .   .   .   .   .   .      551   .   ha    parsed_1acz   1   
         9   1   2   .   .   .   .   .   .   .   .   .      555   .   ha    parsed_1acz   1   
        10   1   1   .   .   .   .   .   .   .   .   .      544   .   hn    parsed_1acz   1   
        10   1   2   .   .   .   .   .   .   .   .   .      534   .   ha    parsed_1acz   1   
        10   1   2   .   .   .   .   .   .   .   .   .      547   .   ha    parsed_1acz   1   
        11   1   1   .   .   .   .   .   .   .   .   .      590   .   hd1   parsed_1acz   1   
        11   1   2   .   .   .   .   .   .   .   .   .      543   .   hb#   parsed_1acz   1   
        11   1   2   .   .   .   .   .   .   .   .   .      592   .   hb#   parsed_1acz   1   
        12   1   1   .   .   .   .   .   .   .   .   .      615   .   hd1   parsed_1acz   1   
        12   1   2   .   .   .   .   .   .   .   .   .      531   .   ha    parsed_1acz   1   
        12   1   2   .   .   .   .   .   .   .   .   .      614   .   ha    parsed_1acz   1   
        13   1   1   .   .   .   .   .   .   .   .   .      598   .   he#   parsed_1acz   1   
        13   1   2   .   .   .   .   .   .   .   .   .      515   .   ha    parsed_1acz   1   
        13   1   2   .   .   .   .   .   .   .   .   .      612   .   hb    parsed_1acz   1   
        14   1   1   .   .   .   .   .   .   .   .   .      543   .   hd1   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     1   .   H5    parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     1   .   H61   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     1   .   H62   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     2   .   H5    parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     2   .   H61   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     2   .   H62   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     3   .   H5    parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     3   .   H61   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     3   .   H62   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     4   .   H5    parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     4   .   H61   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     4   .   H62   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     5   .   H5    parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     5   .   H61   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     5   .   H62   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     6   .   H5    parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     6   .   H61   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     6   .   H62   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     7   .   H5    parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     7   .   H61   parsed_1acz   1   
        14   1   2   .   .   .   .   .   .   .   .   BCD1     7   .   H62   parsed_1acz   1   
        15   1   1   .   .   .   .   .   .   .   .   .      543   .   hd1   parsed_1acz   1   
        15   1   2   .   .   .   .   .   .   .   .   BCD1     1   .   H3    parsed_1acz   1   
        15   1   2   .   .   .   .   .   .   .   .   BCD1     2   .   H3    parsed_1acz   1   
        15   1   2   .   .   .   .   .   .   .   .   BCD1     3   .   H3    parsed_1acz   1   
        15   1   2   .   .   .   .   .   .   .   .   BCD1     4   .   H3    parsed_1acz   1   
        15   1   2   .   .   .   .   .   .   .   .   BCD1     5   .   H3    parsed_1acz   1   
        15   1   2   .   .   .   .   .   .   .   .   BCD1     6   .   H3    parsed_1acz   1   
        15   1   2   .   .   .   .   .   .   .   .   BCD1     7   .   H3    parsed_1acz   1   
        16   1   1   .   .   .   .   .   .   .   .   .      543   .   he1   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     1   .   H5    parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     1   .   H61   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     1   .   H62   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     2   .   H5    parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     2   .   H61   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     2   .   H62   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     3   .   H5    parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     3   .   H61   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     3   .   H62   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     4   .   H5    parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     4   .   H61   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     4   .   H62   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     5   .   H5    parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     5   .   H61   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     5   .   H62   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     6   .   H5    parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     6   .   H61   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     6   .   H62   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     7   .   H5    parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     7   .   H61   parsed_1acz   1   
        16   1   2   .   .   .   .   .   .   .   .   BCD1     7   .   H62   parsed_1acz   1   
        17   1   1   .   .   .   .   .   .   .   .   .      543   .   he1   parsed_1acz   1   
        17   1   2   .   .   .   .   .   .   .   .   BCD1     1   .   H3    parsed_1acz   1   
        17   1   2   .   .   .   .   .   .   .   .   BCD1     2   .   H3    parsed_1acz   1   
        17   1   2   .   .   .   .   .   .   .   .   BCD1     3   .   H3    parsed_1acz   1   
        17   1   2   .   .   .   .   .   .   .   .   BCD1     4   .   H3    parsed_1acz   1   
        17   1   2   .   .   .   .   .   .   .   .   BCD1     5   .   H3    parsed_1acz   1   
        17   1   2   .   .   .   .   .   .   .   .   BCD1     6   .   H3    parsed_1acz   1   
        17   1   2   .   .   .   .   .   .   .   .   BCD1     7   .   H3    parsed_1acz   1   
        18   1   1   .   .   .   .   .   .   .   .   .      590   .   he1   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     1   .   H5    parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     1   .   H61   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     1   .   H62   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     2   .   H5    parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     2   .   H61   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     2   .   H62   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     3   .   H5    parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     3   .   H61   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     3   .   H62   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     4   .   H5    parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     4   .   H61   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     4   .   H62   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     5   .   H5    parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     5   .   H61   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     5   .   H62   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     6   .   H5    parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     6   .   H61   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     6   .   H62   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     7   .   H5    parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     7   .   H61   parsed_1acz   1   
        18   1   2   .   .   .   .   .   .   .   .   BCD1     7   .   H62   parsed_1acz   1   
        19   1   1   .   .   .   .   .   .   .   .   .      590   .   he1   parsed_1acz   1   
        19   1   2   .   .   .   .   .   .   .   .   BCD1     1   .   H3    parsed_1acz   1   
        20   1   1   .   .   .   .   .   .   .   .   .      523   .   hn    parsed_1acz   1   
        20   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H2    parsed_1acz   1   
        20   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H2    parsed_1acz   1   
        20   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H2    parsed_1acz   1   
        20   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H2    parsed_1acz   1   
        20   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H2    parsed_1acz   1   
        20   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H2    parsed_1acz   1   
        20   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H2    parsed_1acz   1   
        21   1   1   .   .   .   .   .   .   .   .   .      523   .   hn    parsed_1acz   1   
        21   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H3    parsed_1acz   1   
        21   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H3    parsed_1acz   1   
        21   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H3    parsed_1acz   1   
        21   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H3    parsed_1acz   1   
        21   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H3    parsed_1acz   1   
        21   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H3    parsed_1acz   1   
        21   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H3    parsed_1acz   1   
        22   1   1   .   .   .   .   .   .   .   .   .      526   .   hn    parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H5    parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H61   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H62   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H5    parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H61   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H62   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H5    parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H61   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H62   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H5    parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H61   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H62   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H5    parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H61   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H62   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H5    parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H61   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H62   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H5    parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H61   parsed_1acz   1   
        22   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H62   parsed_1acz   1   
        23   1   1   .   .   .   .   .   .   .   .   .      527   .   hn    parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H5    parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H61   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H62   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H5    parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H61   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H62   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H5    parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H61   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H62   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H5    parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H61   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H62   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H5    parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H61   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H62   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H5    parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H61   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H62   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H5    parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H61   parsed_1acz   1   
        23   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H62   parsed_1acz   1   
        24   1   1   .   .   .   .   .   .   .   .   .      527   .   hb#   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H5    parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H61   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H62   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H5    parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H61   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H62   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H5    parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H61   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H62   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H5    parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H61   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H62   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H5    parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H61   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H62   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H5    parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H61   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H62   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H5    parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H61   parsed_1acz   1   
        24   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H62   parsed_1acz   1   
        25   1   1   .   .   .   .   .   .   .   .   .      527   .   hd#   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H5    parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H61   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H62   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H5    parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H61   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H62   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H5    parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H61   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H62   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H5    parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H61   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H62   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H5    parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H61   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H62   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H5    parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H61   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H62   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H5    parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H61   parsed_1acz   1   
        25   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H62   parsed_1acz   1   
        26   1   1   .   .   .   .   .   .   .   .   .      527   .   hd#   parsed_1acz   1   
        26   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H3    parsed_1acz   1   
        26   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H3    parsed_1acz   1   
        26   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H3    parsed_1acz   1   
        26   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H3    parsed_1acz   1   
        26   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H3    parsed_1acz   1   
        26   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H3    parsed_1acz   1   
        26   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H3    parsed_1acz   1   
        27   1   1   .   .   .   .   .   .   .   .   .      527   .   he#   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H5    parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H61   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H62   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H5    parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H61   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H62   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H5    parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H61   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H62   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H5    parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H61   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H62   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H5    parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H61   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H62   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H5    parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H61   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H62   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H5    parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H61   parsed_1acz   1   
        27   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H62   parsed_1acz   1   
        28   1   1   .   .   .   .   .   .   .   .   .      527   .   he#   parsed_1acz   1   
        28   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H3    parsed_1acz   1   
        28   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H3    parsed_1acz   1   
        28   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H3    parsed_1acz   1   
        28   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H3    parsed_1acz   1   
        28   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H3    parsed_1acz   1   
        28   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H3    parsed_1acz   1   
        28   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H3    parsed_1acz   1   
        29   1   1   .   .   .   .   .   .   .   .   .      553   .   hb#   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H5    parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H61   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H62   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H5    parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H61   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H62   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H5    parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H61   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H62   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H5    parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H61   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H62   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H5    parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H61   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H62   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H5    parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H61   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H62   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H5    parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H61   parsed_1acz   1   
        29   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H62   parsed_1acz   1   
        30   1   1   .   .   .   .   .   .   .   .   .      553   .   hb#   parsed_1acz   1   
        30   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H3    parsed_1acz   1   
        31   1   1   .   .   .   .   .   .   .   .   .      556   .   hd#   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H5    parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H61   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H62   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H5    parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H61   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H62   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H5    parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H61   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H62   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H5    parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H61   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H62   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H5    parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H61   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H62   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H5    parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H61   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H62   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H5    parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H61   parsed_1acz   1   
        31   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H62   parsed_1acz   1   
        32   1   1   .   .   .   .   .   .   .   .   .      556   .   hd#   parsed_1acz   1   
        32   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H3    parsed_1acz   1   
        32   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H3    parsed_1acz   1   
        32   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H3    parsed_1acz   1   
        32   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H3    parsed_1acz   1   
        32   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H3    parsed_1acz   1   
        32   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H3    parsed_1acz   1   
        32   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H3    parsed_1acz   1   
        33   1   1   .   .   .   .   .   .   .   .   .      556   .   he#   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H5    parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H61   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H62   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H5    parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H61   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H62   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H5    parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H61   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H62   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H5    parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H61   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H62   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H5    parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H61   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H62   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H5    parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H61   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H62   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H5    parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H61   parsed_1acz   1   
        33   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H62   parsed_1acz   1   
        34   1   1   .   .   .   .   .   .   .   .   .      556   .   he#   parsed_1acz   1   
        34   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H3    parsed_1acz   1   
        34   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H3    parsed_1acz   1   
        34   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H3    parsed_1acz   1   
        34   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H3    parsed_1acz   1   
        34   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H3    parsed_1acz   1   
        34   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H3    parsed_1acz   1   
        34   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H3    parsed_1acz   1   
        35   1   1   .   .   .   .   .   .   .   .   .      562   .   hg    parsed_1acz   1   
        35   1   2   .   .   .   .   .   .   .   .   BCD2     1   .   H1    parsed_1acz   1   
        35   1   2   .   .   .   .   .   .   .   .   BCD2     2   .   H1    parsed_1acz   1   
        35   1   2   .   .   .   .   .   .   .   .   BCD2     3   .   H1    parsed_1acz   1   
        35   1   2   .   .   .   .   .   .   .   .   BCD2     4   .   H1    parsed_1acz   1   
        35   1   2   .   .   .   .   .   .   .   .   BCD2     5   .   H1    parsed_1acz   1   
        35   1   2   .   .   .   .   .   .   .   .   BCD2     6   .   H1    parsed_1acz   1   
        35   1   2   .   .   .   .   .   .   .   .   BCD2     7   .   H1    parsed_1acz   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   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
         2   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
         3   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
         4   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
         5   1   .   .   .   .   .   3.00   1.90   3.50   parsed_1acz   1   
         6   1   .   .   .   .   .   2.60   1.90   3.00   parsed_1acz   1   
         7   1   .   .   .   .   .   3.60   1.90   4.40   parsed_1acz   1   
         8   1   .   .   .   .   .   3.00   1.90   3.50   parsed_1acz   1   
         9   1   .   .   .   .   .   3.00   1.90   3.50   parsed_1acz   1   
        10   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
        11   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
        12   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
        13   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
        14   1   .   .   .   .   .   2.40   1.90   2.70   parsed_1acz   1   
        15   1   .   .   .   .   .   2.40   1.90   2.70   parsed_1acz   1   
        16   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
        17   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
        18   1   .   .   .   .   .   3.00   1.90   3.50   parsed_1acz   1   
        19   1   .   .   .   .   .   3.60   1.90   4.40   parsed_1acz   1   
        20   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
        21   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
        22   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
        23   1   .   .   .   .   .   3.00   1.90   3.50   parsed_1acz   1   
        24   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
        25   1   .   .   .   .   .   2.40   1.90   2.70   parsed_1acz   1   
        26   1   .   .   .   .   .   2.40   1.90   2.70   parsed_1acz   1   
        27   1   .   .   .   .   .   2.40   1.90   2.70   parsed_1acz   1   
        28   1   .   .   .   .   .   2.40   1.90   2.70   parsed_1acz   1   
        29   1   .   .   .   .   .   2.60   1.90   3.00   parsed_1acz   1   
        30   1   .   .   .   .   .   2.60   1.90   3.00   parsed_1acz   1   
        31   1   .   .   .   .   .   3.00   1.90   3.50   parsed_1acz   1   
        32   1   .   .   .   .   .   5.00   1.90   5.80   parsed_1acz   1   
        33   1   .   .   .   .   .   2.60   1.90   3.00   parsed_1acz   1   
        34   1   .   .   .   .   .   2.60   1.90   3.00   parsed_1acz   1   
        35   1   .   .   .   .   .   3.00   1.90   3.50   parsed_1acz   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   
;
multi.tbl
for SBD/bCD complex
for ambiguous NOEs
;
                                 1    1     4    2   parsed_1acz   1   
         2   "540_d 1"                                                     6   80     6   88   parsed_1acz   1   
         3   "540_d,ol 1"                                                  8   80     8   91   parsed_1acz   1   
         4   "540_d,ol 1"                                                 10   80    10   91   parsed_1acz   1   
         5                               1    12   80    12   83   parsed_1acz   1   
         6                               3    14   80    14   83   parsed_1acz   1   
         7   "ol 4"                                                       16   80    16   85   parsed_1acz   1   
         8   "540_d,ol 2"                                                 18   80    18   91   parsed_1acz   1   
         9                               3    20   80    20   83   parsed_1acz   1   
        10                               3    22   80    22   83   parsed_1acz   1   
        11                               1    24   80    24   83   parsed_1acz   1   
        12   "ol 1"                                                       26   80    26   85   parsed_1acz   1   
        13   "ol 1"                                                       28   80    28   85   parsed_1acz   1   
        14   
;
ol 1
inter1.tbl
intermolecular NOEs between SBD and bCD
BCD1 for site 1, BCD2 for site 2

SITE 1-------------------------------------------
;
                                30   80    36    2   parsed_1acz   1   
        15                               5    58   66    58   69   parsed_1acz   1   
        16                               5    66   66    66   69   parsed_1acz   1   
        17                               1    88   66    88   69   parsed_1acz   1   
        18                               1    96   66    96   69   parsed_1acz   1   
        19                               3   118   66   118   69   parsed_1acz   1   
        20   
;
2
((segid BCD1 and resid 1 and name H3) or
(segid BCD1 and resid 2 and name H3) or
(segid BCD1 and resid 3 and name H3) or
(segid BCD1 and resid 4 and name H3) or
(segid BCD1 and resid 5 and name H3) or
(segid BCD1 and resid 6 and name H3) or
(segid BCD1 and resid 7 and name H3))     3.60 1.70 0.80 ! 2

SITE 2---------------------------------------------------------------
;
                               119   87   129    2   parsed_1acz   1   
        21                               1   137   66   137   69   parsed_1acz   1   
        22                               1   145   66   145   69   parsed_1acz   1   
        23                               1   167   66   167   69   parsed_1acz   1   
        24                               3   189   66   189   69   parsed_1acz   1   
        25   "1 (check SS of beta later)"                                211   66   211   94   parsed_1acz   1   
        26                               5   233   66   233   69   parsed_1acz   1   
        27                               5   241   66   241   69   parsed_1acz   1   
        28                               5   263   66   263   69   parsed_1acz   1   
        29                               5   271   66   271   69   parsed_1acz   1   
        30   "poss_ol_red_by_1 4"                                        293   66   293   85   parsed_1acz   1   
        31   
;
4
((segid BCD2 and resid 1 and name H3) or
(segid BCD2 and resid 2 and name H3) or
(segid BCD2 and resid 3 and name H3) or
(segid BCD2 and resid 4 and name H3) or
(segid BCD2 and resid 5 and name H3) or
(segid BCD2 and resid 6 and name H3) or
(segid BCD2 and resid 7 and name H3))     2.60 0.70 0.40 ! 4
;
                               294   87   301   69   parsed_1acz   1   
        32                               3   323   66   323   69   parsed_1acz   1   
        33                               1   331   66   331   69   parsed_1acz   1   
        34   "ol 4"                                                      353   66   353   71   parsed_1acz   1   
        35   "ol 4"                                                      361   66   361   71   parsed_1acz   1   
        36                               3   369   66   370    2   parsed_1acz   1   
    stop_

save_





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