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
490032 2kqf cing 2-parsed STAR distance NOE simple 77


data_2kqf_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2kqf 
    _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_2kqf   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2kqf 
    _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   2kqf   "Master copy"    parsed_2kqf   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2kqf 
    _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   2kqf.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"      0   parsed_2kqf   1   
        1   2kqf.mr   .   .    XPLOR/CNS     2   "dihedral angle"          "Not applicable"    "Not applicable"    118   parsed_2kqf   1   
        1   2kqf.mr   .   .    XPLOR/CNS     3   "coupling constant"       "Not applicable"    "Not applicable"      0   parsed_2kqf   1   
        1   2kqf.mr   .   .    XPLOR/CNS     4    distance                  NOE                 simple              77   parsed_2kqf   1   
        1   2kqf.mr   .   .    XPLOR/CNS     5    distance                  NOE                 ambi                 0   parsed_2kqf   1   
        1   2kqf.mr   .   .   "MR format"    6   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_2kqf   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_4
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_2kqf 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type     NOE 
    _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_2kqf   1   
         2   1   .   .   .   parsed_2kqf   1   
         3   1   .   .   .   parsed_2kqf   1   
         4   1   .   .   .   parsed_2kqf   1   
         5   1   .   .   .   parsed_2kqf   1   
         6   1   .   .   .   parsed_2kqf   1   
         7   1   .   .   .   parsed_2kqf   1   
         8   1   .   .   .   parsed_2kqf   1   
         9   1   .   .   .   parsed_2kqf   1   
        10   1   .   .   .   parsed_2kqf   1   
        11   1   .   .   .   parsed_2kqf   1   
        12   1   .   .   .   parsed_2kqf   1   
        13   1   .   .   .   parsed_2kqf   1   
        14   1   .   .   .   parsed_2kqf   1   
        15   1   .   .   .   parsed_2kqf   1   
        16   1   .   .   .   parsed_2kqf   1   
        17   1   .   .   .   parsed_2kqf   1   
        18   1   .   .   .   parsed_2kqf   1   
        19   1   .   .   .   parsed_2kqf   1   
        20   1   .   .   .   parsed_2kqf   1   
        21   1   .   .   .   parsed_2kqf   1   
        22   1   .   .   .   parsed_2kqf   1   
        23   1   .   .   .   parsed_2kqf   1   
        24   1   .   .   .   parsed_2kqf   1   
        25   1   .   .   .   parsed_2kqf   1   
        26   1   .   .   .   parsed_2kqf   1   
        27   1   .   .   .   parsed_2kqf   1   
        28   1   .   .   .   parsed_2kqf   1   
        29   1   .   .   .   parsed_2kqf   1   
        30   1   .   .   .   parsed_2kqf   1   
        31   1   .   .   .   parsed_2kqf   1   
        32   1   .   .   .   parsed_2kqf   1   
        33   1   .   .   .   parsed_2kqf   1   
        34   1   .   .   .   parsed_2kqf   1   
        35   1   .   .   .   parsed_2kqf   1   
        36   1   .   .   .   parsed_2kqf   1   
        37   1   .   .   .   parsed_2kqf   1   
        38   1   .   .   .   parsed_2kqf   1   
        39   1   .   .   .   parsed_2kqf   1   
        40   1   .   .   .   parsed_2kqf   1   
        41   1   .   .   .   parsed_2kqf   1   
        42   1   .   .   .   parsed_2kqf   1   
        43   1   .   .   .   parsed_2kqf   1   
        44   1   .   .   .   parsed_2kqf   1   
        45   1   .   .   .   parsed_2kqf   1   
        46   1   .   .   .   parsed_2kqf   1   
        47   1   .   .   .   parsed_2kqf   1   
        48   1   .   .   .   parsed_2kqf   1   
        49   1   .   .   .   parsed_2kqf   1   
        50   1   .   .   .   parsed_2kqf   1   
        51   1   .   .   .   parsed_2kqf   1   
        52   1   .   .   .   parsed_2kqf   1   
        53   1   .   .   .   parsed_2kqf   1   
        54   1   .   .   .   parsed_2kqf   1   
        55   1   .   .   .   parsed_2kqf   1   
        56   1   .   .   .   parsed_2kqf   1   
        57   1   .   .   .   parsed_2kqf   1   
        58   1   .   .   .   parsed_2kqf   1   
        59   1   .   .   .   parsed_2kqf   1   
        60   1   .   .   .   parsed_2kqf   1   
        61   1   .   .   .   parsed_2kqf   1   
        62   1   .   .   .   parsed_2kqf   1   
        63   1   .   .   .   parsed_2kqf   1   
        64   1   .   .   .   parsed_2kqf   1   
        65   1   .   .   .   parsed_2kqf   1   
        66   1   .   .   .   parsed_2kqf   1   
        67   1   .   .   .   parsed_2kqf   1   
        68   1   .   .   .   parsed_2kqf   1   
        69   1   .   .   .   parsed_2kqf   1   
        70   1   .   .   .   parsed_2kqf   1   
        71   1   .   .   .   parsed_2kqf   1   
        72   1   .   .   .   parsed_2kqf   1   
        73   1   .   .   .   parsed_2kqf   1   
        74   1   .   .   .   parsed_2kqf   1   
        75   1   .   .   .   parsed_2kqf   1   
        76   1   .   .   .   parsed_2kqf   1   
        77   1   .   .   .   parsed_2kqf   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   .   .   .   .   .   .   .   .   .    80   .   HD1#   parsed_2kqf   1   
         1   1   2   .   .   .   .   .   .   .   .   .   113   .   HG     parsed_2kqf   1   
         2   1   1   .   .   .   .   .   .   .   .   .    80   .   HD1#   parsed_2kqf   1   
         2   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
         3   1   1   .   .   .   .   .   .   .   .   .    80   .   HD1#   parsed_2kqf   1   
         3   1   2   .   .   .   .   .   .   .   .   .   113   .   HD2#   parsed_2kqf   1   
         4   1   1   .   .   .   .   .   .   .   .   .    80   .   HB     parsed_2kqf   1   
         4   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
         5   1   1   .   .   .   .   .   .   .   .   .    80   .   HG2#   parsed_2kqf   1   
         5   1   2   .   .   .   .   .   .   .   .   .   113   .   HG     parsed_2kqf   1   
         6   1   1   .   .   .   .   .   .   .   .   .    80   .   HG2#   parsed_2kqf   1   
         6   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
         7   1   1   .   .   .   .   .   .   .   .   .    80   .   HG2#   parsed_2kqf   1   
         7   1   2   .   .   .   .   .   .   .   .   .   113   .   HD2#   parsed_2kqf   1   
         8   1   1   .   .   .   .   .   .   .   .   .    21   .   HG     parsed_2kqf   1   
         8   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
         9   1   1   .   .   .   .   .   .   .   .   .    21   .   HB2    parsed_2kqf   1   
         9   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        10   1   1   .   .   .   .   .   .   .   .   .    21   .   HB1    parsed_2kqf   1   
        10   1   2   .   .   .   .   .   .   .   .   .   113   .   HD2#   parsed_2kqf   1   
        11   1   1   .   .   .   .   .   .   .   .   .    21   .   HB1    parsed_2kqf   1   
        11   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        12   1   1   .   .   .   .   .   .   .   .   .    21   .   HB2    parsed_2kqf   1   
        12   1   2   .   .   .   .   .   .   .   .   .   113   .   HD2#   parsed_2kqf   1   
        13   1   1   .   .   .   .   .   .   .   .   .    20   .   HG2#   parsed_2kqf   1   
        13   1   2   .   .   .   .   .   .   .   .   .   112   .   HA     parsed_2kqf   1   
        14   1   1   .   .   .   .   .   .   .   .   .    20   .   HG2#   parsed_2kqf   1   
        14   1   2   .   .   .   .   .   .   .   .   .   112   .   HB#    parsed_2kqf   1   
        15   1   1   .   .   .   .   .   .   .   .   .    20   .   HG2#   parsed_2kqf   1   
        15   1   2   .   .   .   .   .   .   .   .   .   112   .   HD#    parsed_2kqf   1   
        16   1   1   .   .   .   .   .   .   .   .   .    20   .   HG2#   parsed_2kqf   1   
        16   1   2   .   .   .   .   .   .   .   .   .   113   .   HN     parsed_2kqf   1   
        17   1   1   .   .   .   .   .   .   .   .   .    20   .   HG2#   parsed_2kqf   1   
        17   1   2   .   .   .   .   .   .   .   .   .   110   .   HG#    parsed_2kqf   1   
        18   1   1   .   .   .   .   .   .   .   .   .    20   .   HG2#   parsed_2kqf   1   
        18   1   2   .   .   .   .   .   .   .   .   .   110   .   HB1    parsed_2kqf   1   
        19   1   1   .   .   .   .   .   .   .   .   .    20   .   HG2#   parsed_2kqf   1   
        19   1   2   .   .   .   .   .   .   .   .   .   110   .   HB2    parsed_2kqf   1   
        20   1   1   .   .   .   .   .   .   .   .   .    77   .   HA     parsed_2kqf   1   
        20   1   2   .   .   .   .   .   .   .   .   .   111   .   HG2#   parsed_2kqf   1   
        21   1   1   .   .   .   .   .   .   .   .   .    77   .   HA     parsed_2kqf   1   
        21   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        22   1   1   .   .   .   .   .   .   .   .   .    77   .   HG1#   parsed_2kqf   1   
        22   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        23   1   1   .   .   .   .   .   .   .   .   .    77   .   HG1#   parsed_2kqf   1   
        23   1   2   .   .   .   .   .   .   .   .   .   113   .   HG     parsed_2kqf   1   
        24   1   1   .   .   .   .   .   .   .   .   .    77   .   HG1#   parsed_2kqf   1   
        24   1   2   .   .   .   .   .   .   .   .   .   111   .   HG2#   parsed_2kqf   1   
        25   1   1   .   .   .   .   .   .   .   .   .    77   .   HG2#   parsed_2kqf   1   
        25   1   2   .   .   .   .   .   .   .   .   .   113   .   HD2#   parsed_2kqf   1   
        26   1   1   .   .   .   .   .   .   .   .   .    77   .   HG2#   parsed_2kqf   1   
        26   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        27   1   1   .   .   .   .   .   .   .   .   .    77   .   HG2#   parsed_2kqf   1   
        27   1   2   .   .   .   .   .   .   .   .   .   111   .   HG2#   parsed_2kqf   1   
        28   1   1   .   .   .   .   .   .   .   .   .    77   .   HG2#   parsed_2kqf   1   
        28   1   2   .   .   .   .   .   .   .   .   .   111   .   HA     parsed_2kqf   1   
        29   1   1   .   .   .   .   .   .   .   .   .    77   .   HG2#   parsed_2kqf   1   
        29   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        30   1   1   .   .   .   .   .   .   .   .   .    77   .   HG2#   parsed_2kqf   1   
        30   1   2   .   .   .   .   .   .   .   .   .   111   .   HB     parsed_2kqf   1   
        31   1   1   .   .   .   .   .   .   .   .   .    17   .   HB2    parsed_2kqf   1   
        31   1   2   .   .   .   .   .   .   .   .   .   113   .   HB#    parsed_2kqf   1   
        32   1   1   .   .   .   .   .   .   .   .   .    17   .   HB1    parsed_2kqf   1   
        32   1   2   .   .   .   .   .   .   .   .   .   113   .   HB#    parsed_2kqf   1   
        33   1   1   .   .   .   .   .   .   .   .   .    17   .   HE#    parsed_2kqf   1   
        33   1   2   .   .   .   .   .   .   .   .   .   113   .   HG     parsed_2kqf   1   
        34   1   1   .   .   .   .   .   .   .   .   .    17   .   HD2    parsed_2kqf   1   
        34   1   2   .   .   .   .   .   .   .   .   .   113   .   HG     parsed_2kqf   1   
        35   1   1   .   .   .   .   .   .   .   .   .    17   .   HD2    parsed_2kqf   1   
        35   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        36   1   1   .   .   .   .   .   .   .   .   .    17   .   HB1    parsed_2kqf   1   
        36   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        37   1   1   .   .   .   .   .   .   .   .   .    17   .   HE#    parsed_2kqf   1   
        37   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        38   1   1   .   .   .   .   .   .   .   .   .    19   .   HE#    parsed_2kqf   1   
        38   1   2   .   .   .   .   .   .   .   .   .   113   .   HG     parsed_2kqf   1   
        39   1   1   .   .   .   .   .   .   .   .   .    19   .   HE#    parsed_2kqf   1   
        39   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        40   1   1   .   .   .   .   .   .   .   .   .    19   .   HD#    parsed_2kqf   1   
        40   1   2   .   .   .   .   .   .   .   .   .   113   .   HG     parsed_2kqf   1   
        41   1   1   .   .   .   .   .   .   .   .   .    19   .   HD#    parsed_2kqf   1   
        41   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        42   1   1   .   .   .   .   .   .   .   .   .    19   .   HN     parsed_2kqf   1   
        42   1   2   .   .   .   .   .   .   .   .   .   113   .   HG     parsed_2kqf   1   
        43   1   1   .   .   .   .   .   .   .   .   .    19   .   HN     parsed_2kqf   1   
        43   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        44   1   1   .   .   .   .   .   .   .   .   .    22   .   HA     parsed_2kqf   1   
        44   1   2   .   .   .   .   .   .   .   .   .   110   .   HA     parsed_2kqf   1   
        45   1   1   .   .   .   .   .   .   .   .   .    22   .   HA     parsed_2kqf   1   
        45   1   2   .   .   .   .   .   .   .   .   .   110   .   HG#    parsed_2kqf   1   
        46   1   1   .   .   .   .   .   .   .   .   .    22   .   HA     parsed_2kqf   1   
        46   1   2   .   .   .   .   .   .   .   .   .   110   .   HB#    parsed_2kqf   1   
        47   1   1   .   .   .   .   .   .   .   .   .    22   .   HA     parsed_2kqf   1   
        47   1   2   .   .   .   .   .   .   .   .   .   112   .   HB#    parsed_2kqf   1   
        48   1   1   .   .   .   .   .   .   .   .   .    77   .   HN     parsed_2kqf   1   
        48   1   2   .   .   .   .   .   .   .   .   .   113   .   HG     parsed_2kqf   1   
        49   1   1   .   .   .   .   .   .   .   .   .    77   .   HN     parsed_2kqf   1   
        49   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        50   1   1   .   .   .   .   .   .   .   .   .    77   .   HN     parsed_2kqf   1   
        50   1   2   .   .   .   .   .   .   .   .   .   113   .   HD2#   parsed_2kqf   1   
        51   1   1   .   .   .   .   .   .   .   .   .    21   .   HN     parsed_2kqf   1   
        51   1   2   .   .   .   .   .   .   .   .   .   113   .   HG     parsed_2kqf   1   
        52   1   1   .   .   .   .   .   .   .   .   .    21   .   HN     parsed_2kqf   1   
        52   1   2   .   .   .   .   .   .   .   .   .   111   .   HG2#   parsed_2kqf   1   
        53   1   1   .   .   .   .   .   .   .   .   .    21   .   HN     parsed_2kqf   1   
        53   1   2   .   .   .   .   .   .   .   .   .   112   .   HA     parsed_2kqf   1   
        54   1   1   .   .   .   .   .   .   .   .   .    21   .   HN     parsed_2kqf   1   
        54   1   2   .   .   .   .   .   .   .   .   .   113   .   HD1#   parsed_2kqf   1   
        55   1   1   .   .   .   .   .   .   .   .   .    21   .   HN     parsed_2kqf   1   
        55   1   2   .   .   .   .   .   .   .   .   .   113   .   HD2#   parsed_2kqf   1   
        56   1   1   .   .   .   .   .   .   .   .   .    17   .   HN     parsed_2kqf   1   
        56   1   2   .   .   .   .   .   .   .   .   .   113   .   HG     parsed_2kqf   1   
        57   1   1   .   .   .   .   .   .   .   .   .    73   .   HD2    parsed_2kqf   1   
        57   1   2   .   .   .   .   .   .   .   .   .   109   .   HA#    parsed_2kqf   1   
        58   1   1   .   .   .   .   .   .   .   .   .    24   .   HG2#   parsed_2kqf   1   
        58   1   2   .   .   .   .   .   .   .   .   .   104   .   HA     parsed_2kqf   1   
        59   1   1   .   .   .   .   .   .   .   .   .    24   .   HG2#   parsed_2kqf   1   
        59   1   2   .   .   .   .   .   .   .   .   .   104   .   HB#    parsed_2kqf   1   
        60   1   1   .   .   .   .   .   .   .   .   .    24   .   HG2#   parsed_2kqf   1   
        60   1   2   .   .   .   .   .   .   .   .   .   102   .   HE3    parsed_2kqf   1   
        61   1   1   .   .   .   .   .   .   .   .   .    24   .   HG2#   parsed_2kqf   1   
        61   1   2   .   .   .   .   .   .   .   .   .   102   .   HZ3    parsed_2kqf   1   
        62   1   1   .   .   .   .   .   .   .   .   .    24   .   HG2#   parsed_2kqf   1   
        62   1   2   .   .   .   .   .   .   .   .   .   102   .   HZ2    parsed_2kqf   1   
        63   1   1   .   .   .   .   .   .   .   .   .    24   .   HG2#   parsed_2kqf   1   
        63   1   2   .   .   .   .   .   .   .   .   .   102   .   HD1    parsed_2kqf   1   
        64   1   1   .   .   .   .   .   .   .   .   .    24   .   HD1#   parsed_2kqf   1   
        64   1   2   .   .   .   .   .   .   .   .   .   102   .   HB#    parsed_2kqf   1   
        65   1   1   .   .   .   .   .   .   .   .   .    24   .   HD1#   parsed_2kqf   1   
        65   1   2   .   .   .   .   .   .   .   .   .   102   .   HD1    parsed_2kqf   1   
        66   1   1   .   .   .   .   .   .   .   .   .    24   .   HD1#   parsed_2kqf   1   
        66   1   2   .   .   .   .   .   .   .   .   .   102   .   HE3    parsed_2kqf   1   
        67   1   1   .   .   .   .   .   .   .   .   .    24   .   HD1#   parsed_2kqf   1   
        67   1   2   .   .   .   .   .   .   .   .   .   102   .   HZ2    parsed_2kqf   1   
        68   1   1   .   .   .   .   .   .   .   .   .    24   .   HD1#   parsed_2kqf   1   
        68   1   2   .   .   .   .   .   .   .   .   .   102   .   HZ3    parsed_2kqf   1   
        69   1   1   .   .   .   .   .   .   .   .   .    24   .   HG2#   parsed_2kqf   1   
        69   1   2   .   .   .   .   .   .   .   .   .   105   .   HB#    parsed_2kqf   1   
        70   1   1   .   .   .   .   .   .   .   .   .    26   .   HG1#   parsed_2kqf   1   
        70   1   2   .   .   .   .   .   .   .   .   .   102   .   HB#    parsed_2kqf   1   
        71   1   1   .   .   .   .   .   .   .   .   .    26   .   HG1#   parsed_2kqf   1   
        71   1   2   .   .   .   .   .   .   .   .   .   102   .   HZ3    parsed_2kqf   1   
        72   1   1   .   .   .   .   .   .   .   .   .    26   .   HG2#   parsed_2kqf   1   
        72   1   2   .   .   .   .   .   .   .   .   .   102   .   HB#    parsed_2kqf   1   
        73   1   1   .   .   .   .   .   .   .   .   .    23   .   HB1    parsed_2kqf   1   
        73   1   2   .   .   .   .   .   .   .   .   .   105   .   HB#    parsed_2kqf   1   
        74   1   1   .   .   .   .   .   .   .   .   .    23   .   HB1    parsed_2kqf   1   
        74   1   2   .   .   .   .   .   .   .   .   .   108   .   HA#    parsed_2kqf   1   
        75   1   1   .   .   .   .   .   .   .   .   .    41   .   HH2    parsed_2kqf   1   
        75   1   2   .   .   .   .   .   .   .   .   .   102   .   HH2    parsed_2kqf   1   
        76   1   1   .   .   .   .   .   .   .   .   .    41   .   HH2    parsed_2kqf   1   
        76   1   2   .   .   .   .   .   .   .   .   .   102   .   HZ3    parsed_2kqf   1   
        77   1   1   .   .   .   .   .   .   .   .   .    41   .   HZ2    parsed_2kqf   1   
        77   1   2   .   .   .   .   .   .   .   .   .   102   .   HZ3    parsed_2kqf   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   .   .   .   .   .   4.820   1.800   6.000   parsed_2kqf   1   
         2   1   .   .   .   .   .   3.650   1.800   6.000   parsed_2kqf   1   
         3   1   .   .   .   .   .   4.650   1.800   6.000   parsed_2kqf   1   
         4   1   .   .   .   .   .   4.480   1.800   6.000   parsed_2kqf   1   
         5   1   .   .   .   .   .   4.456   1.800   6.000   parsed_2kqf   1   
         6   1   .   .   .   .   .   3.038   1.800   6.000   parsed_2kqf   1   
         7   1   .   .   .   .   .   4.741   1.800   6.000   parsed_2kqf   1   
         8   1   .   .   .   .   .   4.396   1.800   6.000   parsed_2kqf   1   
         9   1   .   .   .   .   .   4.465   1.800   6.000   parsed_2kqf   1   
        10   1   .   .   .   .   .   4.994   1.800   6.000   parsed_2kqf   1   
        11   1   .   .   .   .   .   4.454   1.800   6.000   parsed_2kqf   1   
        12   1   .   .   .   .   .   4.844   1.800   6.000   parsed_2kqf   1   
        13   1   .   .   .   .   .   3.813   1.800   6.000   parsed_2kqf   1   
        14   1   .   .   .   .   .   3.38    1.80    6.00    parsed_2kqf   1   
        15   1   .   .   .   .   .   2.907   1.800   6.000   parsed_2kqf   1   
        16   1   .   .   .   .   .   4.994   1.800   6.000   parsed_2kqf   1   
        17   1   .   .   .   .   .   3.20    1.80    6.00    parsed_2kqf   1   
        18   1   .   .   .   .   .   3.38    1.80    6.00    parsed_2kqf   1   
        19   1   .   .   .   .   .   3.38    1.80    6.00    parsed_2kqf   1   
        20   1   .   .   .   .   .   4.972   1.800   6.000   parsed_2kqf   1   
        21   1   .   .   .   .   .   4.064   1.800   6.000   parsed_2kqf   1   
        22   1   .   .   .   .   .   3.554   1.800   6.000   parsed_2kqf   1   
        23   1   .   .   .   .   .   4.989   1.800   6.000   parsed_2kqf   1   
        24   1   .   .   .   .   .   1.800   1.800   2.500   parsed_2kqf   1   
        25   1   .   .   .   .   .   4.791   1.800   6.000   parsed_2kqf   1   
        26   1   .   .   .   .   .   3.532   1.800   6.000   parsed_2kqf   1   
        27   1   .   .   .   .   .   3.055   1.800   6.000   parsed_2kqf   1   
        28   1   .   .   .   .   .   4.346   1.800   6.000   parsed_2kqf   1   
        29   1   .   .   .   .   .   4.831   1.800   6.000   parsed_2kqf   1   
        30   1   .   .   .   .   .   4.714   1.800   6.000   parsed_2kqf   1   
        31   1   .   .   .   .   .   4.978   1.800   6.000   parsed_2kqf   1   
        32   1   .   .   .   .   .   4.885   1.800   6.000   parsed_2kqf   1   
        33   1   .   .   .   .   .   4.504   1.800   6.000   parsed_2kqf   1   
        34   1   .   .   .   .   .   3.730   1.800   6.000   parsed_2kqf   1   
        35   1   .   .   .   .   .   4.527   1.800   6.000   parsed_2kqf   1   
        36   1   .   .   .   .   .   5.00    1.80    6.00    parsed_2kqf   1   
        37   1   .   .   .   .   .   4.84    1.80    6.00    parsed_2kqf   1   
        38   1   .   .   .   .   .   4.652   1.800   6.000   parsed_2kqf   1   
        39   1   .   .   .   .   .   4.697   1.800   6.000   parsed_2kqf   1   
        40   1   .   .   .   .   .   4.666   1.800   6.000   parsed_2kqf   1   
        41   1   .   .   .   .   .   4.712   1.800   6.000   parsed_2kqf   1   
        42   1   .   .   .   .   .   4.283   1.800   6.000   parsed_2kqf   1   
        43   1   .   .   .   .   .   4.712   1.800   6.000   parsed_2kqf   1   
        44   1   .   .   .   .   .   2.80    0.10    4.30    parsed_2kqf   1   
        45   1   .   .   .   .   .   4.94    1.80    6.00    parsed_2kqf   1   
        46   1   .   .   .   .   .   4.93    1.80    6.00    parsed_2kqf   1   
        47   1   .   .   .   .   .   4.90    1.80    6.00    parsed_2kqf   1   
        48   1   .   .   .   .   .   3.534   1.800   6.000   parsed_2kqf   1   
        49   1   .   .   .   .   .   3.731   1.800   6.000   parsed_2kqf   1   
        50   1   .   .   .   .   .   4.823   1.800   6.000   parsed_2kqf   1   
        51   1   .   .   .   .   .   4.879   1.800   6.000   parsed_2kqf   1   
        52   1   .   .   .   .   .   4.754   1.800   6.000   parsed_2kqf   1   
        53   1   .   .   .   .   .   3.999   1.800   6.000   parsed_2kqf   1   
        54   1   .   .   .   .   .   4.32    1.80    6.00    parsed_2kqf   1   
        55   1   .   .   .   .   .   5.00    1.80    6.00    parsed_2kqf   1   
        56   1   .   .   .   .   .   4.547   1.800   6.000   parsed_2kqf   1   
        57   1   .   .   .   .   .   4.790   1.800   6.000   parsed_2kqf   1   
        58   1   .   .   .   .   .   4.800   1.800   6.000   parsed_2kqf   1   
        59   1   .   .   .   .   .   4.800   1.800   6.000   parsed_2kqf   1   
        60   1   .   .   .   .   .   4.930   1.800   6.000   parsed_2kqf   1   
        61   1   .   .   .   .   .   4.900   1.800   6.000   parsed_2kqf   1   
        62   1   .   .   .   .   .   4.850   1.800   6.000   parsed_2kqf   1   
        63   1   .   .   .   .   .   4.850   1.800   6.000   parsed_2kqf   1   
        64   1   .   .   .   .   .   4.270   1.800   6.000   parsed_2kqf   1   
        65   1   .   .   .   .   .   4.900   1.800   6.000   parsed_2kqf   1   
        66   1   .   .   .   .   .   4.930   1.800   6.000   parsed_2kqf   1   
        67   1   .   .   .   .   .   4.900   1.800   6.000   parsed_2kqf   1   
        68   1   .   .   .   .   .   4.930   1.800   6.000   parsed_2kqf   1   
        69   1   .   .   .   .   .   4.810   1.800   6.000   parsed_2kqf   1   
        70   1   .   .   .   .   .   4.450   1.800   6.000   parsed_2kqf   1   
        71   1   .   .   .   .   .   4.950   1.800   6.000   parsed_2kqf   1   
        72   1   .   .   .   .   .   4.880   1.800   6.000   parsed_2kqf   1   
        73   1   .   .   .   .   .   4.750   1.800   6.000   parsed_2kqf   1   
        74   1   .   .   .   .   .   4.190   1.800   6.000   parsed_2kqf   1   
        75   1   .   .   .   .   .   4.950   1.800   6.000   parsed_2kqf   1   
        76   1   .   .   .   .   .   4.950   1.800   6.000   parsed_2kqf   1   
        77   1   .   .   .   .   .   4.900   1.800   6.000   parsed_2kqf   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   inter   1   1   1   11   parsed_2kqf   1   
    stop_

save_





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