NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage program type subtype subsubtype item_count
622397 5xv8 36101 cing 2-parsed STAR distance hydrogen bond simple 96


data_5xv8_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_5xv8 
    _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_5xv8   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_5xv8 
    _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   5xv8   "Master copy"    parsed_5xv8   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_5xv8 
    _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   5xv8.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_5xv8   1   
        1   5xv8.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             2695   parsed_5xv8   1   
        1   5xv8.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple               96   parsed_5xv8   1   
        1   5xv8.mr   .   .    XPLOR/CNS     4    distance                  NOE                 simple                0   parsed_5xv8   1   
        1   5xv8.mr   .   .    XPLOR/CNS     5    distance                 "hydrogen bond"      simple                0   parsed_5xv8   1   
        1   5xv8.mr   .   .    XPLOR/CNS     6   "dihedral angle"          "Not applicable"    "Not applicable"       0   parsed_5xv8   1   
        1   5xv8.mr   .   .   "MR format"    7   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_5xv8   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_3
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_5xv8 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type    "hydrogen bond" 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            3 
    _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_5xv8   1   
         2   1   .   .   .   parsed_5xv8   1   
         3   1   .   .   .   parsed_5xv8   1   
         4   1   .   .   .   parsed_5xv8   1   
         5   1   .   .   .   parsed_5xv8   1   
         6   1   .   .   .   parsed_5xv8   1   
         7   1   .   .   .   parsed_5xv8   1   
         8   1   .   .   .   parsed_5xv8   1   
         9   1   .   .   .   parsed_5xv8   1   
        10   1   .   .   .   parsed_5xv8   1   
        11   1   .   .   .   parsed_5xv8   1   
        12   1   .   .   .   parsed_5xv8   1   
        13   1   .   .   .   parsed_5xv8   1   
        14   1   .   .   .   parsed_5xv8   1   
        15   1   .   .   .   parsed_5xv8   1   
        16   1   .   .   .   parsed_5xv8   1   
        17   1   .   .   .   parsed_5xv8   1   
        18   1   .   .   .   parsed_5xv8   1   
        19   1   .   .   .   parsed_5xv8   1   
        20   1   .   .   .   parsed_5xv8   1   
        21   1   .   .   .   parsed_5xv8   1   
        22   1   .   .   .   parsed_5xv8   1   
        23   1   .   .   .   parsed_5xv8   1   
        24   1   .   .   .   parsed_5xv8   1   
        25   1   .   .   .   parsed_5xv8   1   
        26   1   .   .   .   parsed_5xv8   1   
        27   1   .   .   .   parsed_5xv8   1   
        28   1   .   .   .   parsed_5xv8   1   
        29   1   .   .   .   parsed_5xv8   1   
        30   1   .   .   .   parsed_5xv8   1   
        31   1   .   .   .   parsed_5xv8   1   
        32   1   .   .   .   parsed_5xv8   1   
        33   1   .   .   .   parsed_5xv8   1   
        34   1   .   .   .   parsed_5xv8   1   
        35   1   .   .   .   parsed_5xv8   1   
        36   1   .   .   .   parsed_5xv8   1   
        37   1   .   .   .   parsed_5xv8   1   
        38   1   .   .   .   parsed_5xv8   1   
        39   1   .   .   .   parsed_5xv8   1   
        40   1   .   .   .   parsed_5xv8   1   
        41   1   .   .   .   parsed_5xv8   1   
        42   1   .   .   .   parsed_5xv8   1   
        43   1   .   .   .   parsed_5xv8   1   
        44   1   .   .   .   parsed_5xv8   1   
        45   1   .   .   .   parsed_5xv8   1   
        46   1   .   .   .   parsed_5xv8   1   
        47   1   .   .   .   parsed_5xv8   1   
        48   1   .   .   .   parsed_5xv8   1   
        49   1   .   .   .   parsed_5xv8   1   
        50   1   .   .   .   parsed_5xv8   1   
        51   1   .   .   .   parsed_5xv8   1   
        52   1   .   .   .   parsed_5xv8   1   
        53   1   .   .   .   parsed_5xv8   1   
        54   1   .   .   .   parsed_5xv8   1   
        55   1   .   .   .   parsed_5xv8   1   
        56   1   .   .   .   parsed_5xv8   1   
        57   1   .   .   .   parsed_5xv8   1   
        58   1   .   .   .   parsed_5xv8   1   
        59   1   .   .   .   parsed_5xv8   1   
        60   1   .   .   .   parsed_5xv8   1   
        61   1   .   .   .   parsed_5xv8   1   
        62   1   .   .   .   parsed_5xv8   1   
        63   1   .   .   .   parsed_5xv8   1   
        64   1   .   .   .   parsed_5xv8   1   
        65   1   .   .   .   parsed_5xv8   1   
        66   1   .   .   .   parsed_5xv8   1   
        67   1   .   .   .   parsed_5xv8   1   
        68   1   .   .   .   parsed_5xv8   1   
        69   1   .   .   .   parsed_5xv8   1   
        70   1   .   .   .   parsed_5xv8   1   
        71   1   .   .   .   parsed_5xv8   1   
        72   1   .   .   .   parsed_5xv8   1   
        73   1   .   .   .   parsed_5xv8   1   
        74   1   .   .   .   parsed_5xv8   1   
        75   1   .   .   .   parsed_5xv8   1   
        76   1   .   .   .   parsed_5xv8   1   
        77   1   .   .   .   parsed_5xv8   1   
        78   1   .   .   .   parsed_5xv8   1   
        79   1   .   .   .   parsed_5xv8   1   
        80   1   .   .   .   parsed_5xv8   1   
        81   1   .   .   .   parsed_5xv8   1   
        82   1   .   .   .   parsed_5xv8   1   
        83   1   .   .   .   parsed_5xv8   1   
        84   1   .   .   .   parsed_5xv8   1   
        85   1   .   .   .   parsed_5xv8   1   
        86   1   .   .   .   parsed_5xv8   1   
        87   1   .   .   .   parsed_5xv8   1   
        88   1   .   .   .   parsed_5xv8   1   
        89   1   .   .   .   parsed_5xv8   1   
        90   1   .   .   .   parsed_5xv8   1   
        91   1   .   .   .   parsed_5xv8   1   
        92   1   .   .   .   parsed_5xv8   1   
        93   1   .   .   .   parsed_5xv8   1   
        94   1   .   .   .   parsed_5xv8   1   
        95   1   .   .   .   parsed_5xv8   1   
        96   1   .   .   .   parsed_5xv8   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   .   .   .   .   .   .   .   .   B    26   .   O    parsed_5xv8   1   
         1   1   2   .   .   .   .   .   .   .   .   B     9   .   HN   parsed_5xv8   1   
         2   1   1   .   .   .   .   .   .   .   .   B    26   .   O    parsed_5xv8   1   
         2   1   2   .   .   .   .   .   .   .   .   B     9   .   N    parsed_5xv8   1   
         3   1   1   .   .   .   .   .   .   .   .   B    26   .   O    parsed_5xv8   1   
         3   1   2   .   .   .   .   .   .   .   .   B    10   .   HN   parsed_5xv8   1   
         4   1   1   .   .   .   .   .   .   .   .   B    26   .   O    parsed_5xv8   1   
         4   1   2   .   .   .   .   .   .   .   .   B    10   .   N    parsed_5xv8   1   
         5   1   1   .   .   .   .   .   .   .   .   B    24   .   O    parsed_5xv8   1   
         5   1   2   .   .   .   .   .   .   .   .   B    12   .   HN   parsed_5xv8   1   
         6   1   1   .   .   .   .   .   .   .   .   B    24   .   O    parsed_5xv8   1   
         6   1   2   .   .   .   .   .   .   .   .   B    12   .   N    parsed_5xv8   1   
         7   1   1   .   .   .   .   .   .   .   .   B    22   .   O    parsed_5xv8   1   
         7   1   2   .   .   .   .   .   .   .   .   B    15   .   HN   parsed_5xv8   1   
         8   1   1   .   .   .   .   .   .   .   .   B    22   .   O    parsed_5xv8   1   
         8   1   2   .   .   .   .   .   .   .   .   B    15   .   N    parsed_5xv8   1   
         9   1   1   .   .   .   .   .   .   .   .   B    78   .   O    parsed_5xv8   1   
         9   1   2   .   .   .   .   .   .   .   .   B    16   .   HN   parsed_5xv8   1   
        10   1   1   .   .   .   .   .   .   .   .   B    78   .   O    parsed_5xv8   1   
        10   1   2   .   .   .   .   .   .   .   .   B    16   .   N    parsed_5xv8   1   
        11   1   1   .   .   .   .   .   .   .   .   B    20   .   O    parsed_5xv8   1   
        11   1   2   .   .   .   .   .   .   .   .   B    17   .   HN   parsed_5xv8   1   
        12   1   1   .   .   .   .   .   .   .   .   B    20   .   O    parsed_5xv8   1   
        12   1   2   .   .   .   .   .   .   .   .   B    17   .   N    parsed_5xv8   1   
        13   1   1   .   .   .   .   .   .   .   .   B    15   .   O    parsed_5xv8   1   
        13   1   2   .   .   .   .   .   .   .   .   B    22   .   HN   parsed_5xv8   1   
        14   1   1   .   .   .   .   .   .   .   .   B    15   .   O    parsed_5xv8   1   
        14   1   2   .   .   .   .   .   .   .   .   B    22   .   N    parsed_5xv8   1   
        15   1   1   .   .   .   .   .   .   .   .   B    34   .   O    parsed_5xv8   1   
        15   1   2   .   .   .   .   .   .   .   .   B    23   .   HN   parsed_5xv8   1   
        16   1   1   .   .   .   .   .   .   .   .   B    34   .   O    parsed_5xv8   1   
        16   1   2   .   .   .   .   .   .   .   .   B    23   .   N    parsed_5xv8   1   
        17   1   1   .   .   .   .   .   .   .   .   B    12   .   O    parsed_5xv8   1   
        17   1   2   .   .   .   .   .   .   .   .   B    24   .   HN   parsed_5xv8   1   
        18   1   1   .   .   .   .   .   .   .   .   B    12   .   O    parsed_5xv8   1   
        18   1   2   .   .   .   .   .   .   .   .   B    24   .   N    parsed_5xv8   1   
        19   1   1   .   .   .   .   .   .   .   .   B    32   .   O    parsed_5xv8   1   
        19   1   2   .   .   .   .   .   .   .   .   B    25   .   HN   parsed_5xv8   1   
        20   1   1   .   .   .   .   .   .   .   .   B    32   .   O    parsed_5xv8   1   
        20   1   2   .   .   .   .   .   .   .   .   B    25   .   N    parsed_5xv8   1   
        21   1   1   .   .   .   .   .   .   .   .   B    10   .   O    parsed_5xv8   1   
        21   1   2   .   .   .   .   .   .   .   .   B    26   .   HN   parsed_5xv8   1   
        22   1   1   .   .   .   .   .   .   .   .   B    10   .   O    parsed_5xv8   1   
        22   1   2   .   .   .   .   .   .   .   .   B    26   .   N    parsed_5xv8   1   
        23   1   1   .   .   .   .   .   .   .   .   B    30   .   O    parsed_5xv8   1   
        23   1   2   .   .   .   .   .   .   .   .   B    27   .   HN   parsed_5xv8   1   
        24   1   1   .   .   .   .   .   .   .   .   B    30   .   O    parsed_5xv8   1   
        24   1   2   .   .   .   .   .   .   .   .   B    27   .   N    parsed_5xv8   1   
        25   1   1   .   .   .   .   .   .   .   .   B    27   .   O    parsed_5xv8   1   
        25   1   2   .   .   .   .   .   .   .   .   B    30   .   HN   parsed_5xv8   1   
        26   1   1   .   .   .   .   .   .   .   .   B    27   .   O    parsed_5xv8   1   
        26   1   2   .   .   .   .   .   .   .   .   B    30   .   N    parsed_5xv8   1   
        27   1   1   .   .   .   .   .   .   .   .   B    45   .   O    parsed_5xv8   1   
        27   1   2   .   .   .   .   .   .   .   .   B    31   .   HN   parsed_5xv8   1   
        28   1   1   .   .   .   .   .   .   .   .   B    45   .   O    parsed_5xv8   1   
        28   1   2   .   .   .   .   .   .   .   .   B    31   .   N    parsed_5xv8   1   
        29   1   1   .   .   .   .   .   .   .   .   B    25   .   O    parsed_5xv8   1   
        29   1   2   .   .   .   .   .   .   .   .   B    32   .   HN   parsed_5xv8   1   
        30   1   1   .   .   .   .   .   .   .   .   B    25   .   O    parsed_5xv8   1   
        30   1   2   .   .   .   .   .   .   .   .   B    32   .   N    parsed_5xv8   1   
        31   1   1   .   .   .   .   .   .   .   .   B    43   .   O    parsed_5xv8   1   
        31   1   2   .   .   .   .   .   .   .   .   B    33   .   HN   parsed_5xv8   1   
        32   1   1   .   .   .   .   .   .   .   .   B    43   .   O    parsed_5xv8   1   
        32   1   2   .   .   .   .   .   .   .   .   B    33   .   N    parsed_5xv8   1   
        33   1   1   .   .   .   .   .   .   .   .   B    23   .   O    parsed_5xv8   1   
        33   1   2   .   .   .   .   .   .   .   .   B    34   .   HN   parsed_5xv8   1   
        34   1   1   .   .   .   .   .   .   .   .   B    23   .   O    parsed_5xv8   1   
        34   1   2   .   .   .   .   .   .   .   .   B    34   .   N    parsed_5xv8   1   
        35   1   1   .   .   .   .   .   .   .   .   B    33   .   O    parsed_5xv8   1   
        35   1   2   .   .   .   .   .   .   .   .   B    43   .   HN   parsed_5xv8   1   
        36   1   1   .   .   .   .   .   .   .   .   B    33   .   O    parsed_5xv8   1   
        36   1   2   .   .   .   .   .   .   .   .   B    43   .   N    parsed_5xv8   1   
        37   1   1   .   .   .   .   .   .   .   .   B    31   .   O    parsed_5xv8   1   
        37   1   2   .   .   .   .   .   .   .   .   B    45   .   HN   parsed_5xv8   1   
        38   1   1   .   .   .   .   .   .   .   .   B    31   .   O    parsed_5xv8   1   
        38   1   2   .   .   .   .   .   .   .   .   B    45   .   N    parsed_5xv8   1   
        39   1   1   .   .   .   .   .   .   .   .   B    29   .   O    parsed_5xv8   1   
        39   1   2   .   .   .   .   .   .   .   .   B    47   .   HN   parsed_5xv8   1   
        40   1   1   .   .   .   .   .   .   .   .   B    29   .   O    parsed_5xv8   1   
        40   1   2   .   .   .   .   .   .   .   .   B    47   .   N    parsed_5xv8   1   
        41   1   1   .   .   .   .   .   .   .   .   B    46   .   O    parsed_5xv8   1   
        41   1   2   .   .   .   .   .   .   .   .   B    49   .   HN   parsed_5xv8   1   
        42   1   1   .   .   .   .   .   .   .   .   B    46   .   O    parsed_5xv8   1   
        42   1   2   .   .   .   .   .   .   .   .   B    49   .   N    parsed_5xv8   1   
        43   1   1   .   .   .   .   .   .   .   .   B    47   .   O    parsed_5xv8   1   
        43   1   2   .   .   .   .   .   .   .   .   B    50   .   HN   parsed_5xv8   1   
        44   1   1   .   .   .   .   .   .   .   .   B    47   .   O    parsed_5xv8   1   
        44   1   2   .   .   .   .   .   .   .   .   B    50   .   N    parsed_5xv8   1   
        45   1   1   .   .   .   .   .   .   .   .   B    68   .   O    parsed_5xv8   1   
        45   1   2   .   .   .   .   .   .   .   .   B    51   .   HN   parsed_5xv8   1   
        46   1   1   .   .   .   .   .   .   .   .   B    68   .   O    parsed_5xv8   1   
        46   1   2   .   .   .   .   .   .   .   .   B    51   .   N    parsed_5xv8   1   
        47   1   1   .   .   .   .   .   .   .   .   B    68   .   O    parsed_5xv8   1   
        47   1   2   .   .   .   .   .   .   .   .   B    52   .   HN   parsed_5xv8   1   
        48   1   1   .   .   .   .   .   .   .   .   B    68   .   O    parsed_5xv8   1   
        48   1   2   .   .   .   .   .   .   .   .   B    52   .   N    parsed_5xv8   1   
        49   1   1   .   .   .   .   .   .   .   .   B    66   .   O    parsed_5xv8   1   
        49   1   2   .   .   .   .   .   .   .   .   B    54   .   HN   parsed_5xv8   1   
        50   1   1   .   .   .   .   .   .   .   .   B    66   .   O    parsed_5xv8   1   
        50   1   2   .   .   .   .   .   .   .   .   B    54   .   N    parsed_5xv8   1   
        51   1   1   .   .   .   .   .   .   .   .   B    56   .   O    parsed_5xv8   1   
        51   1   2   .   .   .   .   .   .   .   .   B    64   .   HN   parsed_5xv8   1   
        52   1   1   .   .   .   .   .   .   .   .   B    56   .   O    parsed_5xv8   1   
        52   1   2   .   .   .   .   .   .   .   .   B    64   .   N    parsed_5xv8   1   
        53   1   1   .   .   .   .   .   .   .   .   B    77   .   O    parsed_5xv8   1   
        53   1   2   .   .   .   .   .   .   .   .   B    65   .   HN   parsed_5xv8   1   
        54   1   1   .   .   .   .   .   .   .   .   B    77   .   O    parsed_5xv8   1   
        54   1   2   .   .   .   .   .   .   .   .   B    65   .   N    parsed_5xv8   1   
        55   1   1   .   .   .   .   .   .   .   .   B    54   .   O    parsed_5xv8   1   
        55   1   2   .   .   .   .   .   .   .   .   B    66   .   HN   parsed_5xv8   1   
        56   1   1   .   .   .   .   .   .   .   .   B    54   .   O    parsed_5xv8   1   
        56   1   2   .   .   .   .   .   .   .   .   B    66   .   N    parsed_5xv8   1   
        57   1   1   .   .   .   .   .   .   .   .   B    75   .   O    parsed_5xv8   1   
        57   1   2   .   .   .   .   .   .   .   .   B    67   .   HN   parsed_5xv8   1   
        58   1   1   .   .   .   .   .   .   .   .   B    75   .   O    parsed_5xv8   1   
        58   1   2   .   .   .   .   .   .   .   .   B    67   .   N    parsed_5xv8   1   
        59   1   1   .   .   .   .   .   .   .   .   B    52   .   O    parsed_5xv8   1   
        59   1   2   .   .   .   .   .   .   .   .   B    68   .   HN   parsed_5xv8   1   
        60   1   1   .   .   .   .   .   .   .   .   B    52   .   O    parsed_5xv8   1   
        60   1   2   .   .   .   .   .   .   .   .   B    68   .   N    parsed_5xv8   1   
        61   1   1   .   .   .   .   .   .   .   .   B    73   .   O    parsed_5xv8   1   
        61   1   2   .   .   .   .   .   .   .   .   B    69   .   HN   parsed_5xv8   1   
        62   1   1   .   .   .   .   .   .   .   .   B    73   .   O    parsed_5xv8   1   
        62   1   2   .   .   .   .   .   .   .   .   B    69   .   N    parsed_5xv8   1   
        63   1   1   .   .   .   .   .   .   .   .   B    67   .   O    parsed_5xv8   1   
        63   1   2   .   .   .   .   .   .   .   .   B    75   .   HN   parsed_5xv8   1   
        64   1   1   .   .   .   .   .   .   .   .   B    67   .   O    parsed_5xv8   1   
        64   1   2   .   .   .   .   .   .   .   .   B    75   .   N    parsed_5xv8   1   
        65   1   1   .   .   .   .   .   .   .   .   B    65   .   O    parsed_5xv8   1   
        65   1   2   .   .   .   .   .   .   .   .   B    77   .   HN   parsed_5xv8   1   
        66   1   1   .   .   .   .   .   .   .   .   B    65   .   O    parsed_5xv8   1   
        66   1   2   .   .   .   .   .   .   .   .   B    77   .   N    parsed_5xv8   1   
        67   1   1   .   .   .   .   .   .   .   .   B    16   .   O    parsed_5xv8   1   
        67   1   2   .   .   .   .   .   .   .   .   B    78   .   HN   parsed_5xv8   1   
        68   1   1   .   .   .   .   .   .   .   .   B    16   .   O    parsed_5xv8   1   
        68   1   2   .   .   .   .   .   .   .   .   B    78   .   N    parsed_5xv8   1   
        69   1   1   .   .   .   .   .   .   .   .   B    63   .   O    parsed_5xv8   1   
        69   1   2   .   .   .   .   .   .   .   .   B    79   .   HN   parsed_5xv8   1   
        70   1   1   .   .   .   .   .   .   .   .   B    63   .   O    parsed_5xv8   1   
        70   1   2   .   .   .   .   .   .   .   .   B    79   .   N    parsed_5xv8   1   
        71   1   1   .   .   .   .   .   .   .   .   B    84   .   O    parsed_5xv8   1   
        71   1   2   .   .   .   .   .   .   .   .   B    88   .   HN   parsed_5xv8   1   
        72   1   1   .   .   .   .   .   .   .   .   B    84   .   O    parsed_5xv8   1   
        72   1   2   .   .   .   .   .   .   .   .   B    88   .   N    parsed_5xv8   1   
        73   1   1   .   .   .   .   .   .   .   .   B    85   .   O    parsed_5xv8   1   
        73   1   2   .   .   .   .   .   .   .   .   B    89   .   HN   parsed_5xv8   1   
        74   1   1   .   .   .   .   .   .   .   .   B    85   .   O    parsed_5xv8   1   
        74   1   2   .   .   .   .   .   .   .   .   B    89   .   N    parsed_5xv8   1   
        75   1   1   .   .   .   .   .   .   .   .   B    86   .   O    parsed_5xv8   1   
        75   1   2   .   .   .   .   .   .   .   .   B    90   .   HN   parsed_5xv8   1   
        76   1   1   .   .   .   .   .   .   .   .   B    86   .   O    parsed_5xv8   1   
        76   1   2   .   .   .   .   .   .   .   .   B    90   .   N    parsed_5xv8   1   
        77   1   1   .   .   .   .   .   .   .   .   B    87   .   O    parsed_5xv8   1   
        77   1   2   .   .   .   .   .   .   .   .   B    91   .   HN   parsed_5xv8   1   
        78   1   1   .   .   .   .   .   .   .   .   B    87   .   O    parsed_5xv8   1   
        78   1   2   .   .   .   .   .   .   .   .   B    91   .   N    parsed_5xv8   1   
        79   1   1   .   .   .   .   .   .   .   .   B    88   .   O    parsed_5xv8   1   
        79   1   2   .   .   .   .   .   .   .   .   B    92   .   HN   parsed_5xv8   1   
        80   1   1   .   .   .   .   .   .   .   .   B    88   .   O    parsed_5xv8   1   
        80   1   2   .   .   .   .   .   .   .   .   B    92   .   N    parsed_5xv8   1   
        81   1   1   .   .   .   .   .   .   .   .   B    89   .   O    parsed_5xv8   1   
        81   1   2   .   .   .   .   .   .   .   .   B    93   .   HN   parsed_5xv8   1   
        82   1   1   .   .   .   .   .   .   .   .   B    89   .   O    parsed_5xv8   1   
        82   1   2   .   .   .   .   .   .   .   .   B    93   .   N    parsed_5xv8   1   
        83   1   1   .   .   .   .   .   .   .   .   B    90   .   O    parsed_5xv8   1   
        83   1   2   .   .   .   .   .   .   .   .   B    94   .   HN   parsed_5xv8   1   
        84   1   1   .   .   .   .   .   .   .   .   B    90   .   O    parsed_5xv8   1   
        84   1   2   .   .   .   .   .   .   .   .   B    94   .   N    parsed_5xv8   1   
        85   1   1   .   .   .   .   .   .   .   .   B    91   .   O    parsed_5xv8   1   
        85   1   2   .   .   .   .   .   .   .   .   B    95   .   HN   parsed_5xv8   1   
        86   1   1   .   .   .   .   .   .   .   .   B    91   .   O    parsed_5xv8   1   
        86   1   2   .   .   .   .   .   .   .   .   B    95   .   N    parsed_5xv8   1   
        87   1   1   .   .   .   .   .   .   .   .   B    92   .   O    parsed_5xv8   1   
        87   1   2   .   .   .   .   .   .   .   .   B    96   .   HN   parsed_5xv8   1   
        88   1   1   .   .   .   .   .   .   .   .   B    92   .   O    parsed_5xv8   1   
        88   1   2   .   .   .   .   .   .   .   .   B    96   .   N    parsed_5xv8   1   
        89   1   1   .   .   .   .   .   .   .   .   B    93   .   O    parsed_5xv8   1   
        89   1   2   .   .   .   .   .   .   .   .   B    97   .   HN   parsed_5xv8   1   
        90   1   1   .   .   .   .   .   .   .   .   B    93   .   O    parsed_5xv8   1   
        90   1   2   .   .   .   .   .   .   .   .   B    97   .   N    parsed_5xv8   1   
        91   1   1   .   .   .   .   .   .   .   .   B    94   .   O    parsed_5xv8   1   
        91   1   2   .   .   .   .   .   .   .   .   B    98   .   HN   parsed_5xv8   1   
        92   1   1   .   .   .   .   .   .   .   .   B    94   .   O    parsed_5xv8   1   
        92   1   2   .   .   .   .   .   .   .   .   B    98   .   N    parsed_5xv8   1   
        93   1   1   .   .   .   .   .   .   .   .   B    95   .   O    parsed_5xv8   1   
        93   1   2   .   .   .   .   .   .   .   .   B    99   .   HN   parsed_5xv8   1   
        94   1   1   .   .   .   .   .   .   .   .   B    95   .   O    parsed_5xv8   1   
        94   1   2   .   .   .   .   .   .   .   .   B    99   .   N    parsed_5xv8   1   
        95   1   1   .   .   .   .   .   .   .   .   B    96   .   O    parsed_5xv8   1   
        95   1   2   .   .   .   .   .   .   .   .   B   100   .   HN   parsed_5xv8   1   
        96   1   1   .   .   .   .   .   .   .   .   B    96   .   O    parsed_5xv8   1   
        96   1   2   .   .   .   .   .   .   .   .   B   100   .   N    parsed_5xv8   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   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
         2   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
         3   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
         4   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
         5   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
         6   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
         7   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
         8   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
         9   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        10   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        11   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        12   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        13   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        14   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        15   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        16   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        17   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        18   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        19   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        20   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        21   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        22   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        23   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        24   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        25   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        26   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        27   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        28   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        29   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        30   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        31   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        32   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        33   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        34   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        35   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        36   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        37   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        38   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        39   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        40   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        41   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        42   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        43   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        44   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        45   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        46   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        47   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        48   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        49   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        50   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        51   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        52   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        53   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        54   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        55   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        56   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        57   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        58   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        59   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        60   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        61   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        62   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        63   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        64   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        65   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        66   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        67   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        68   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        69   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        70   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        71   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        72   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        73   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        74   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        75   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        76   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        77   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        78   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        79   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        80   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        81   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        82   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        83   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        84   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        85   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        86   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        87   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        88   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        89   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        90   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        91   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        92   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        93   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        94   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   1   
        95   1   .   .   .   .   .   2.00   1.50   2.30   parsed_5xv8   1   
        96   1   .   .   .   .   .   3.00   2.50   3.30   parsed_5xv8   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   "! H-bond"    1   1   1   10   parsed_5xv8   1   
    stop_

save_





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