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
38780 1s4h 6107 cing 2-parsed STAR distance NOE simple 104


data_1s4h_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1s4h 
    _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_1s4h   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1s4h 
    _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   1s4h   "Master copy"    parsed_1s4h   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1s4h 
    _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   1s4h.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"      0   parsed_1s4h   1   
        1   1s4h.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             104   parsed_1s4h   1   
        1   1s4h.mr   .   .   "MR format"    3   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_1s4h   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_2
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_1s4h 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type     NOE 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            2 
    _Distance_constraint_list.Details            "Generated by Wattos" 

    loop_
        _Dist_constraint_tree.Constraint_ID 
        _Dist_constraint_tree.Node_ID 
        _Dist_constraint_tree.Down_node_ID 
        _Dist_constraint_tree.Right_node_ID 
        _Dist_constraint_tree.Logic_operation 
        _Dist_constraint_tree.Entry_ID 
        _Dist_constraint_tree.Distance_constraint_list_ID 

          1   1   .   .   .   parsed_1s4h   1   
          2   1   .   .   .   parsed_1s4h   1   
          3   1   .   .   .   parsed_1s4h   1   
          4   1   .   .   .   parsed_1s4h   1   
          5   1   .   .   .   parsed_1s4h   1   
          6   1   .   .   .   parsed_1s4h   1   
          7   1   .   .   .   parsed_1s4h   1   
          8   1   .   .   .   parsed_1s4h   1   
          9   1   .   .   .   parsed_1s4h   1   
         10   1   .   .   .   parsed_1s4h   1   
         11   1   .   .   .   parsed_1s4h   1   
         12   1   .   .   .   parsed_1s4h   1   
         13   1   .   .   .   parsed_1s4h   1   
         14   1   .   .   .   parsed_1s4h   1   
         15   1   .   .   .   parsed_1s4h   1   
         16   1   .   .   .   parsed_1s4h   1   
         17   1   .   .   .   parsed_1s4h   1   
         18   1   .   .   .   parsed_1s4h   1   
         19   1   .   .   .   parsed_1s4h   1   
         20   1   .   .   .   parsed_1s4h   1   
         21   1   .   .   .   parsed_1s4h   1   
         22   1   .   .   .   parsed_1s4h   1   
         23   1   .   .   .   parsed_1s4h   1   
         24   1   .   .   .   parsed_1s4h   1   
         25   1   .   .   .   parsed_1s4h   1   
         26   1   .   .   .   parsed_1s4h   1   
         27   1   .   .   .   parsed_1s4h   1   
         28   1   .   .   .   parsed_1s4h   1   
         29   1   .   .   .   parsed_1s4h   1   
         30   1   .   .   .   parsed_1s4h   1   
         31   1   .   .   .   parsed_1s4h   1   
         32   1   .   .   .   parsed_1s4h   1   
         33   1   .   .   .   parsed_1s4h   1   
         34   1   .   .   .   parsed_1s4h   1   
         35   1   .   .   .   parsed_1s4h   1   
         36   1   .   .   .   parsed_1s4h   1   
         37   1   .   .   .   parsed_1s4h   1   
         38   1   .   .   .   parsed_1s4h   1   
         39   1   .   .   .   parsed_1s4h   1   
         40   1   .   .   .   parsed_1s4h   1   
         41   1   .   .   .   parsed_1s4h   1   
         42   1   .   .   .   parsed_1s4h   1   
         43   1   .   .   .   parsed_1s4h   1   
         44   1   .   .   .   parsed_1s4h   1   
         45   1   .   .   .   parsed_1s4h   1   
         46   1   .   .   .   parsed_1s4h   1   
         47   1   .   .   .   parsed_1s4h   1   
         48   1   .   .   .   parsed_1s4h   1   
         49   1   .   .   .   parsed_1s4h   1   
         50   1   .   .   .   parsed_1s4h   1   
         51   1   .   .   .   parsed_1s4h   1   
         52   1   .   .   .   parsed_1s4h   1   
         53   1   .   .   .   parsed_1s4h   1   
         54   1   .   .   .   parsed_1s4h   1   
         55   1   .   .   .   parsed_1s4h   1   
         56   1   .   .   .   parsed_1s4h   1   
         57   1   .   .   .   parsed_1s4h   1   
         58   1   .   .   .   parsed_1s4h   1   
         59   1   .   .   .   parsed_1s4h   1   
         60   1   .   .   .   parsed_1s4h   1   
         61   1   .   .   .   parsed_1s4h   1   
         62   1   .   .   .   parsed_1s4h   1   
         63   1   .   .   .   parsed_1s4h   1   
         64   1   .   .   .   parsed_1s4h   1   
         65   1   .   .   .   parsed_1s4h   1   
         66   1   .   .   .   parsed_1s4h   1   
         67   1   .   .   .   parsed_1s4h   1   
         68   1   .   .   .   parsed_1s4h   1   
         69   1   .   .   .   parsed_1s4h   1   
         70   1   .   .   .   parsed_1s4h   1   
         71   1   .   .   .   parsed_1s4h   1   
         72   1   .   .   .   parsed_1s4h   1   
         73   1   .   .   .   parsed_1s4h   1   
         74   1   .   .   .   parsed_1s4h   1   
         75   1   .   .   .   parsed_1s4h   1   
         76   1   .   .   .   parsed_1s4h   1   
         77   1   .   .   .   parsed_1s4h   1   
         78   1   .   .   .   parsed_1s4h   1   
         79   1   .   .   .   parsed_1s4h   1   
         80   1   .   .   .   parsed_1s4h   1   
         81   1   .   .   .   parsed_1s4h   1   
         82   1   .   .   .   parsed_1s4h   1   
         83   1   .   .   .   parsed_1s4h   1   
         84   1   .   .   .   parsed_1s4h   1   
         85   1   .   .   .   parsed_1s4h   1   
         86   1   .   .   .   parsed_1s4h   1   
         87   1   .   .   .   parsed_1s4h   1   
         88   1   .   .   .   parsed_1s4h   1   
         89   1   .   .   .   parsed_1s4h   1   
         90   1   .   .   .   parsed_1s4h   1   
         91   1   .   .   .   parsed_1s4h   1   
         92   1   .   .   .   parsed_1s4h   1   
         93   1   .   .   .   parsed_1s4h   1   
         94   1   .   .   .   parsed_1s4h   1   
         95   1   .   .   .   parsed_1s4h   1   
         96   1   .   .   .   parsed_1s4h   1   
         97   1   .   .   .   parsed_1s4h   1   
         98   1   .   .   .   parsed_1s4h   1   
         99   1   .   .   .   parsed_1s4h   1   
        100   1   .   .   .   parsed_1s4h   1   
        101   1   .   .   .   parsed_1s4h   1   
        102   1   .   .   .   parsed_1s4h   1   
        103   1   .   .   .   parsed_1s4h   1   
        104   1   .   .   .   parsed_1s4h   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   .   .   .   .   .   .   .   .   .    1   .   HT1    parsed_1s4h   1   
          1   1   2   .   .   .   .   .   .   .   .   .    1   .   HA     parsed_1s4h   1   
          2   1   1   .   .   .   .   .   .   .   .   .    1   .   HT1    parsed_1s4h   1   
          2   1   2   .   .   .   .   .   .   .   .   .    1   .   HB#    parsed_1s4h   1   
          3   1   1   .   .   .   .   .   .   .   .   .    2   .   HG#    parsed_1s4h   1   
          3   1   2   .   .   .   .   .   .   .   .   .    2   .   HB2    parsed_1s4h   1   
          4   1   1   .   .   .   .   .   .   .   .   .    2   .   HG#    parsed_1s4h   1   
          4   1   2   .   .   .   .   .   .   .   .   .    2   .   HB1    parsed_1s4h   1   
          5   1   1   .   .   .   .   .   .   .   .   .    2   .   HG#    parsed_1s4h   1   
          5   1   2   .   .   .   .   .   .   .   .   .    2   .   HA     parsed_1s4h   1   
          6   1   1   .   .   .   .   .   .   .   .   .    2   .   HA     parsed_1s4h   1   
          6   1   2   .   .   .   .   .   .   .   .   .    2   .   HB2    parsed_1s4h   1   
          7   1   1   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_1s4h   1   
          7   1   2   .   .   .   .   .   .   .   .   .    2   .   HG#    parsed_1s4h   1   
          8   1   1   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_1s4h   1   
          8   1   2   .   .   .   .   .   .   .   .   .    2   .   HA     parsed_1s4h   1   
          9   1   1   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_1s4h   1   
          9   1   2   .   .   .   .   .   .   .   .   .    2   .   HB2    parsed_1s4h   1   
         10   1   1   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_1s4h   1   
         10   1   2   .   .   .   .   .   .   .   .   .    2   .   HB1    parsed_1s4h   1   
         11   1   1   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_1s4h   1   
         11   1   2   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_1s4h   1   
         12   1   1   .   .   .   .   .   .   .   .   .    3   .   HA     parsed_1s4h   1   
         12   1   2   .   .   .   .   .   .   .   .   .    3   .   HB#    parsed_1s4h   1   
         13   1   1   .   .   .   .   .   .   .   .   .    3   .   HA     parsed_1s4h   1   
         13   1   2   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_1s4h   1   
         14   1   1   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_1s4h   1   
         14   1   2   .   .   .   .   .   .   .   .   .    2   .   HA     parsed_1s4h   1   
         15   1   1   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_1s4h   1   
         15   1   2   .   .   .   .   .   .   .   .   .    2   .   HB2    parsed_1s4h   1   
         16   1   1   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_1s4h   1   
         16   1   2   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_1s4h   1   
         17   1   1   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_1s4h   1   
         17   1   2   .   .   .   .   .   .   .   .   .    3   .   HB#    parsed_1s4h   1   
         18   1   1   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_1s4h   1   
         18   1   2   .   .   .   .   .   .   .   .   .    2   .   HB1    parsed_1s4h   1   
         19   1   1   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_1s4h   1   
         19   1   2   .   .   .   .   .   .   .   .   .    2   .   HG#    parsed_1s4h   1   
         20   1   1   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_1s4h   1   
         20   1   2   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_1s4h   1   
         21   1   1   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_1s4h   1   
         21   1   2   .   .   .   .   .   .   .   .   .    3   .   HB#    parsed_1s4h   1   
         22   1   1   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_1s4h   1   
         22   1   2   .   .   .   .   .   .   .   .   .    3   .   HA     parsed_1s4h   1   
         23   1   1   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_1s4h   1   
         23   1   2   .   .   .   .   .   .   .   .   .    4   .   HA     parsed_1s4h   1   
         24   1   1   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_1s4h   1   
         24   1   2   .   .   .   .   .   .   .   .   .    4   .   HB#    parsed_1s4h   1   
         25   1   1   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_1s4h   1   
         25   1   2   .   .   .   .   .   .   .   .   .    3   .   HB#    parsed_1s4h   1   
         26   1   1   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_1s4h   1   
         26   1   2   .   .   .   .   .   .   .   .   .    5   .   HB#    parsed_1s4h   1   
         27   1   1   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_1s4h   1   
         27   1   2   .   .   .   .   .   .   .   .   .    5   .   HA     parsed_1s4h   1   
         28   1   1   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_1s4h   1   
         28   1   2   .   .   .   .   .   .   .   .   .    3   .   HA     parsed_1s4h   1   
         29   1   1   .   .   .   .   .   .   .   .   .    6   .   HB2    parsed_1s4h   1   
         29   1   2   .   .   .   .   .   .   .   .   .    6   .   HN     parsed_1s4h   1   
         30   1   1   .   .   .   .   .   .   .   .   .    6   .   HN     parsed_1s4h   1   
         30   1   2   .   .   .   .   .   .   .   .   .    6   .   HA     parsed_1s4h   1   
         31   1   1   .   .   .   .   .   .   .   .   .    6   .   HB1    parsed_1s4h   1   
         31   1   2   .   .   .   .   .   .   .   .   .    6   .   HN     parsed_1s4h   1   
         32   1   1   .   .   .   .   .   .   .   .   .    7   .   HB1    parsed_1s4h   1   
         32   1   2   .   .   .   .   .   .   .   .   .    7   .   HA     parsed_1s4h   1   
         33   1   1   .   .   .   .   .   .   .   .   .    7   .   HB2    parsed_1s4h   1   
         33   1   2   .   .   .   .   .   .   .   .   .    7   .   HA     parsed_1s4h   1   
         34   1   1   .   .   .   .   .   .   .   .   .    7   .   HG2    parsed_1s4h   1   
         34   1   2   .   .   .   .   .   .   .   .   .    7   .   HG1    parsed_1s4h   1   
         35   1   1   .   .   .   .   .   .   .   .   .    7   .   HB2    parsed_1s4h   1   
         35   1   2   .   .   .   .   .   .   .   .   .    7   .   HN     parsed_1s4h   1   
         36   1   1   .   .   .   .   .   .   .   .   .    7   .   HB1    parsed_1s4h   1   
         36   1   2   .   .   .   .   .   .   .   .   .    7   .   HN     parsed_1s4h   1   
         37   1   1   .   .   .   .   .   .   .   .   .    7   .   HG2    parsed_1s4h   1   
         37   1   2   .   .   .   .   .   .   .   .   .    7   .   HN     parsed_1s4h   1   
         38   1   1   .   .   .   .   .   .   .   .   .    7   .   HG1    parsed_1s4h   1   
         38   1   2   .   .   .   .   .   .   .   .   .    7   .   HN     parsed_1s4h   1   
         39   1   1   .   .   .   .   .   .   .   .   .    7   .   HN     parsed_1s4h   1   
         39   1   2   .   .   .   .   .   .   .   .   .    7   .   HA     parsed_1s4h   1   
         40   1   1   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_1s4h   1   
         40   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_1s4h   1   
         41   1   1   .   .   .   .   .   .   .   .   .    8   .   HA1    parsed_1s4h   1   
         41   1   2   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_1s4h   1   
         42   1   1   .   .   .   .   .   .   .   .   .    8   .   HA1    parsed_1s4h   1   
         42   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_1s4h   1   
         43   1   1   .   .   .   .   .   .   .   .   .    8   .   HA2    parsed_1s4h   1   
         43   1   2   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_1s4h   1   
         44   1   1   .   .   .   .   .   .   .   .   .    8   .   HA2    parsed_1s4h   1   
         44   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_1s4h   1   
         45   1   1   .   .   .   .   .   .   .   .   .    9   .   HA     parsed_1s4h   1   
         45   1   2   .   .   .   .   .   .   .   .   .    9   .   HB1    parsed_1s4h   1   
         46   1   1   .   .   .   .   .   .   .   .   .    9   .   HA     parsed_1s4h   1   
         46   1   2   .   .   .   .   .   .   .   .   .    9   .   HB2    parsed_1s4h   1   
         47   1   1   .   .   .   .   .   .   .   .   .    9   .   HD2    parsed_1s4h   1   
         47   1   2   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_1s4h   1   
         48   1   1   .   .   .   .   .   .   .   .   .    9   .   HB2    parsed_1s4h   1   
         48   1   2   .   .   .   .   .   .   .   .   .    9   .   HB1    parsed_1s4h   1   
         49   1   1   .   .   .   .   .   .   .   .   .    9   .   HD1    parsed_1s4h   1   
         49   1   2   .   .   .   .   .   .   .   .   .    9   .   HB2    parsed_1s4h   1   
         50   1   1   .   .   .   .   .   .   .   .   .    9   .   HD1    parsed_1s4h   1   
         50   1   2   .   .   .   .   .   .   .   .   .    9   .   HB1    parsed_1s4h   1   
         51   1   1   .   .   .   .   .   .   .   .   .    9   .   HD2    parsed_1s4h   1   
         51   1   2   .   .   .   .   .   .   .   .   .    7   .   HB2    parsed_1s4h   1   
         52   1   1   .   .   .   .   .   .   .   .   .    9   .   HB2    parsed_1s4h   1   
         52   1   2   .   .   .   .   .   .   .   .   .    9   .   HD2    parsed_1s4h   1   
         53   1   1   .   .   .   .   .   .   .   .   .    9   .   HB1    parsed_1s4h   1   
         53   1   2   .   .   .   .   .   .   .   .   .    9   .   HD2    parsed_1s4h   1   
         54   1   1   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_1s4h   1   
         54   1   2   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_1s4h   1   
         55   1   1   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_1s4h   1   
         55   1   2   .   .   .   .   .   .   .   .   .    9   .   HB1    parsed_1s4h   1   
         56   1   1   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_1s4h   1   
         56   1   2   .   .   .   .   .   .   .   .   .    9   .   HB2    parsed_1s4h   1   
         57   1   1   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_1s4h   1   
         57   1   2   .   .   .   .   .   .   .   .   .    9   .   HA     parsed_1s4h   1   
         58   1   1   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_1s4h   1   
         58   1   2   .   .   .   .   .   .   .   .   .    9   .   HD2    parsed_1s4h   1   
         59   1   1   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_1s4h   1   
         59   1   2   .   .   .   .   .   .   .   .   .    8   .   HA2    parsed_1s4h   1   
         60   1   1   .   .   .   .   .   .   .   .   .   10   .   HA2    parsed_1s4h   1   
         60   1   2   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_1s4h   1   
         61   1   1   .   .   .   .   .   .   .   .   .   10   .   HA1    parsed_1s4h   1   
         61   1   2   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_1s4h   1   
         62   1   1   .   .   .   .   .   .   .   .   .   10   .   HA2    parsed_1s4h   1   
         62   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_1s4h   1   
         63   1   1   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_1s4h   1   
         63   1   2   .   .   .   .   .   .   .   .   .    9   .   HB1    parsed_1s4h   1   
         64   1   1   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_1s4h   1   
         64   1   2   .   .   .   .   .   .   .   .   .    9   .   HB2    parsed_1s4h   1   
         65   1   1   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_1s4h   1   
         65   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_1s4h   1   
         66   1   1   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_1s4h   1   
         66   1   2   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_1s4h   1   
         67   1   1   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_1s4h   1   
         67   1   2   .   .   .   .   .   .   .   .   .   11   .   HA     parsed_1s4h   1   
         68   1   1   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_1s4h   1   
         68   1   2   .   .   .   .   .   .   .   .   .   10   .   HA2    parsed_1s4h   1   
         69   1   1   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_1s4h   1   
         69   1   2   .   .   .   .   .   .   .   .   .   11   .   HB2    parsed_1s4h   1   
         70   1   1   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_1s4h   1   
         70   1   2   .   .   .   .   .   .   .   .   .   11   .   HB1    parsed_1s4h   1   
         71   1   1   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_1s4h   1   
         71   1   2   .   .   .   .   .   .   .   .   .   11   .   HD##   parsed_1s4h   1   
         72   1   1   .   .   .   .   .   .   .   .   .   11   .   HA     parsed_1s4h   1   
         72   1   2   .   .   .   .   .   .   .   .   .   11   .   HD##   parsed_1s4h   1   
         73   1   1   .   .   .   .   .   .   .   .   .   11   .   HA     parsed_1s4h   1   
         73   1   2   .   .   .   .   .   .   .   .   .   11   .   HB2    parsed_1s4h   1   
         74   1   1   .   .   .   .   .   .   .   .   .   11   .   HB1    parsed_1s4h   1   
         74   1   2   .   .   .   .   .   .   .   .   .   11   .   HD##   parsed_1s4h   1   
         75   1   1   .   .   .   .   .   .   .   .   .   11   .   HB1    parsed_1s4h   1   
         75   1   2   .   .   .   .   .   .   .   .   .   11   .   HB2    parsed_1s4h   1   
         76   1   1   .   .   .   .   .   .   .   .   .   12   .   HD2    parsed_1s4h   1   
         76   1   2   .   .   .   .   .   .   .   .   .    7   .   HB2    parsed_1s4h   1   
         77   1   1   .   .   .   .   .   .   .   .   .   12   .   HD2    parsed_1s4h   1   
         77   1   2   .   .   .   .   .   .   .   .   .   12   .   HA     parsed_1s4h   1   
         78   1   1   .   .   .   .   .   .   .   .   .   12   .   HD2    parsed_1s4h   1   
         78   1   2   .   .   .   .   .   .   .   .   .    3   .   HB#    parsed_1s4h   1   
         79   1   1   .   .   .   .   .   .   .   .   .   12   .   HD1    parsed_1s4h   1   
         79   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_1s4h   1   
         80   1   1   .   .   .   .   .   .   .   .   .   12   .   HD2    parsed_1s4h   1   
         80   1   2   .   .   .   .   .   .   .   .   .   12   .   HB2    parsed_1s4h   1   
         81   1   1   .   .   .   .   .   .   .   .   .   12   .   HD2    parsed_1s4h   1   
         81   1   2   .   .   .   .   .   .   .   .   .   12   .   HB1    parsed_1s4h   1   
         82   1   1   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_1s4h   1   
         82   1   2   .   .   .   .   .   .   .   .   .   12   .   HB2    parsed_1s4h   1   
         83   1   1   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_1s4h   1   
         83   1   2   .   .   .   .   .   .   .   .   .   11   .   HB2    parsed_1s4h   1   
         84   1   1   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_1s4h   1   
         84   1   2   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_1s4h   1   
         85   1   1   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_1s4h   1   
         85   1   2   .   .   .   .   .   .   .   .   .   12   .   HB1    parsed_1s4h   1   
         86   1   1   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_1s4h   1   
         86   1   2   .   .   .   .   .   .   .   .   .   11   .   HA     parsed_1s4h   1   
         87   1   1   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_1s4h   1   
         87   1   2   .   .   .   .   .   .   .   .   .   11   .   HB1    parsed_1s4h   1   
         88   1   1   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_1s4h   1   
         88   1   2   .   .   .   .   .   .   .   .   .   11   .   HD##   parsed_1s4h   1   
         89   1   1   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_1s4h   1   
         89   1   2   .   .   .   .   .   .   .   .   .   10   .   HA2    parsed_1s4h   1   
         90   1   1   .   .   .   .   .   .   .   .   .   12   .   HB2    parsed_1s4h   1   
         90   1   2   .   .   .   .   .   .   .   .   .   12   .   HB1    parsed_1s4h   1   
         91   1   1   .   .   .   .   .   .   .   .   .   12   .   HB2    parsed_1s4h   1   
         91   1   2   .   .   .   .   .   .   .   .   .   12   .   HD1    parsed_1s4h   1   
         92   1   1   .   .   .   .   .   .   .   .   .   12   .   HE2    parsed_1s4h   1   
         92   1   2   .   .   .   .   .   .   .   .   .   12   .   HZ     parsed_1s4h   1   
         93   1   1   .   .   .   .   .   .   .   .   .   12   .   HA     parsed_1s4h   1   
         93   1   2   .   .   .   .   .   .   .   .   .   12   .   HB2    parsed_1s4h   1   
         94   1   1   .   .   .   .   .   .   .   .   .   12   .   HA     parsed_1s4h   1   
         94   1   2   .   .   .   .   .   .   .   .   .   12   .   HB1    parsed_1s4h   1   
         95   1   1   .   .   .   .   .   .   .   .   .   13   .   HB1    parsed_1s4h   1   
         95   1   2   .   .   .   .   .   .   .   .   .   13   .   HA     parsed_1s4h   1   
         96   1   1   .   .   .   .   .   .   .   .   .   13   .   HB2    parsed_1s4h   1   
         96   1   2   .   .   .   .   .   .   .   .   .   13   .   HA     parsed_1s4h   1   
         97   1   1   .   .   .   .   .   .   .   .   .   13   .   HB1    parsed_1s4h   1   
         97   1   2   .   .   .   .   .   .   .   .   .    9   .   HB2    parsed_1s4h   1   
         98   1   1   .   .   .   .   .   .   .   .   .   13   .   HB2    parsed_1s4h   1   
         98   1   2   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_1s4h   1   
         99   1   1   .   .   .   .   .   .   .   .   .   13   .   HB1    parsed_1s4h   1   
         99   1   2   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_1s4h   1   
        100   1   1   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_1s4h   1   
        100   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_1s4h   1   
        101   1   1   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_1s4h   1   
        101   1   2   .   .   .   .   .   .   .   .   .   13   .   HA     parsed_1s4h   1   
        102   1   1   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_1s4h   1   
        102   1   2   .   .   .   .   .   .   .   .   .   12   .   HB2    parsed_1s4h   1   
        103   1   1   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_1s4h   1   
        103   1   2   .   .   .   .   .   .   .   .   .   12   .   HA     parsed_1s4h   1   
        104   1   1   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_1s4h   1   
        104   1   2   .   .   .   .   .   .   .   .   .   12   .   HB1    parsed_1s4h   1   
    stop_


    loop_
        _Dist_constraint_value.Constraint_ID 
        _Dist_constraint_value.Tree_node_ID 
        _Dist_constraint_value.Source_experiment_ID 
        _Dist_constraint_value.Spectral_peak_ID 
        _Dist_constraint_value.Intensity_val 
        _Dist_constraint_value.Intensity_lower_val_err 
        _Dist_constraint_value.Intensity_upper_val_err 
        _Dist_constraint_value.Distance_val 
        _Dist_constraint_value.Distance_lower_bound_val 
        _Dist_constraint_value.Distance_upper_bound_val 
        _Dist_constraint_value.Entry_ID 
        _Dist_constraint_value.Distance_constraint_list_ID 

          1   1   .   .   .   .   .   3.93047   1.80000   5.00000   parsed_1s4h   1   
          2   1   .   .   .   .   .   4.63301   1.80000   5.60000   parsed_1s4h   1   
          3   1   .   .   .   .   .   2.55538   1.80000   2.80000   parsed_1s4h   1   
          4   1   .   .   .   .   .   3.01496   1.80000   3.40000   parsed_1s4h   1   
          5   1   .   .   .   .   .   3.91405   1.80000   5.60000   parsed_1s4h   1   
          6   1   .   .   .   .   .   3.97344   1.80000   5.00000   parsed_1s4h   1   
          7   1   .   .   .   .   .   3.96178   1.80000   6.00000   parsed_1s4h   1   
          8   1   .   .   .   .   .   3.58135   1.80000   5.00000   parsed_1s4h   1   
          9   1   .   .   .   .   .   3.60905   1.80000   5.00000   parsed_1s4h   1   
         10   1   .   .   .   .   .   3.58105   1.80000   5.00000   parsed_1s4h   1   
         11   1   .   .   .   .   .   4.61156   1.80000   5.00000   parsed_1s4h   1   
         12   1   .   .   .   .   .   3.60121   1.80000   5.00000   parsed_1s4h   1   
         13   1   .   .   .   .   .   4.05102   1.80000   5.00000   parsed_1s4h   1   
         14   1   .   .   .   .   .   2.90386   1.80000   3.40000   parsed_1s4h   1   
         15   1   .   .   .   .   .   3.9345    1.8000    5.0000    parsed_1s4h   1   
         16   1   .   .   .   .   .   3.87421   1.80000   5.00000   parsed_1s4h   1   
         17   1   .   .   .   .   .   3.24213   1.80000   4.00000   parsed_1s4h   1   
         18   1   .   .   .   .   .   4.32295   1.80000   5.00000   parsed_1s4h   1   
         19   1   .   .   .   .   .   4.58909   1.80000   6.00000   parsed_1s4h   1   
         20   1   .   .   .   .   .   4.25824   1.80000   5.00000   parsed_1s4h   1   
         21   1   .   .   .   .   .   4.56244   1.80000   6.00000   parsed_1s4h   1   
         22   1   .   .   .   .   .   3.7012    1.8000    5.0000    parsed_1s4h   1   
         23   1   .   .   .   .   .   2.84996   1.80000   3.40000   parsed_1s4h   1   
         24   1   .   .   .   .   .   3.83559   1.80000   5.60000   parsed_1s4h   1   
         25   1   .   .   .   .   .   3.76954   1.80000   6.00000   parsed_1s4h   1   
         26   1   .   .   .   .   .   3.24512   1.80000   4.00000   parsed_1s4h   1   
         27   1   .   .   .   .   .   3.16254   1.80000   3.40000   parsed_1s4h   1   
         28   1   .   .   .   .   .   3.02689   1.80000   3.40000   parsed_1s4h   1   
         29   1   .   .   .   .   .   3.44899   1.80000   5.00000   parsed_1s4h   1   
         30   1   .   .   .   .   .   2.78273   1.80000   2.80000   parsed_1s4h   1   
         31   1   .   .   .   .   .   2.97553   1.80000   3.40000   parsed_1s4h   1   
         32   1   .   .   .   .   .   3.67939   1.80000   5.00000   parsed_1s4h   1   
         33   1   .   .   .   .   .   3.36657   1.80000   3.40000   parsed_1s4h   1   
         34   1   .   .   .   .   .   2.3739    1.8000    2.8000    parsed_1s4h   1   
         35   1   .   .   .   .   .   3.55393   1.80000   5.00000   parsed_1s4h   1   
         36   1   .   .   .   .   .   3.56629   1.80000   5.00000   parsed_1s4h   1   
         37   1   .   .   .   .   .   4.19158   1.80000   5.00000   parsed_1s4h   1   
         38   1   .   .   .   .   .   4.20896   1.80000   5.00000   parsed_1s4h   1   
         39   1   .   .   .   .   .   2.99642   1.80000   3.40000   parsed_1s4h   1   
         40   1   .   .   .   .   .   3.4745    1.8000    5.0000    parsed_1s4h   1   
         41   1   .   .   .   .   .   3.09835   1.80000   3.40000   parsed_1s4h   1   
         42   1   .   .   .   .   .   3.41176   1.80000   5.00000   parsed_1s4h   1   
         43   1   .   .   .   .   .   3.15767   1.80000   3.40000   parsed_1s4h   1   
         44   1   .   .   .   .   .   3.4219    1.8000    5.0000    parsed_1s4h   1   
         45   1   .   .   .   .   .   3.85082   1.80000   5.00000   parsed_1s4h   1   
         46   1   .   .   .   .   .   4.13734   1.80000   5.00000   parsed_1s4h   1   
         47   1   .   .   .   .   .   4.17382   1.80000   5.00000   parsed_1s4h   1   
         48   1   .   .   .   .   .   2.25894   1.80000   2.80000   parsed_1s4h   1   
         49   1   .   .   .   .   .   4.13406   1.80000   5.00000   parsed_1s4h   1   
         50   1   .   .   .   .   .   4.25123   1.80000   5.00000   parsed_1s4h   1   
         51   1   .   .   .   .   .   4.34458   1.80000   5.00000   parsed_1s4h   1   
         52   1   .   .   .   .   .   3.49859   1.80000   5.00000   parsed_1s4h   1   
         53   1   .   .   .   .   .   3.49884   1.80000   5.00000   parsed_1s4h   1   
         54   1   .   .   .   .   .   4.20066   1.80000   5.00000   parsed_1s4h   1   
         55   1   .   .   .   .   .   3.16962   1.80000   3.40000   parsed_1s4h   1   
         56   1   .   .   .   .   .   3.49884   1.80000   5.00000   parsed_1s4h   1   
         57   1   .   .   .   .   .   3.38904   1.80000   3.40000   parsed_1s4h   1   
         58   1   .   .   .   .   .   4.13487   1.80000   5.00000   parsed_1s4h   1   
         59   1   .   .   .   .   .   3.0097    1.8000    3.4000    parsed_1s4h   1   
         60   1   .   .   .   .   .   2.85748   1.80000   3.40000   parsed_1s4h   1   
         61   1   .   .   .   .   .   3.80912   1.80000   5.00000   parsed_1s4h   1   
         62   1   .   .   .   .   .   3.79771   1.80000   5.00000   parsed_1s4h   1   
         63   1   .   .   .   .   .   4.06105   1.80000   5.00000   parsed_1s4h   1   
         64   1   .   .   .   .   .   4.00597   1.80000   5.00000   parsed_1s4h   1   
         65   1   .   .   .   .   .   3.50913   1.80000   5.00000   parsed_1s4h   1   
         66   1   .   .   .   .   .   3.53828   1.80000   5.00000   parsed_1s4h   1   
         67   1   .   .   .   .   .   3.49732   1.80000   5.00000   parsed_1s4h   1   
         68   1   .   .   .   .   .   2.98681   1.80000   3.40000   parsed_1s4h   1   
         69   1   .   .   .   .   .   2.9843    1.8000    3.4000    parsed_1s4h   1   
         70   1   .   .   .   .   .   3.73508   1.80000   5.00000   parsed_1s4h   1   
         71   1   .   .   .   .   .   4.33882   1.80000   5.00000   parsed_1s4h   1   
         72   1   .   .   .   .   .   3.81144   1.80000   6.00000   parsed_1s4h   1   
         73   1   .   .   .   .   .   3.45969   1.80000   5.00000   parsed_1s4h   1   
         74   1   .   .   .   .   .   3.51095   1.80000   5.00000   parsed_1s4h   1   
         75   1   .   .   .   .   .   2.27226   1.80000   2.80000   parsed_1s4h   1   
         76   1   .   .   .   .   .   4.77858   1.80000   5.00000   parsed_1s4h   1   
         77   1   .   .   .   .   .   4.65895   1.80000   5.00000   parsed_1s4h   1   
         78   1   .   .   .   .   .   4.30314   1.80000   6.00000   parsed_1s4h   1   
         79   1   .   .   .   .   .   3.83753   1.80000   5.00000   parsed_1s4h   1   
         80   1   .   .   .   .   .   4.34691   1.80000   5.00000   parsed_1s4h   1   
         81   1   .   .   .   .   .   4.23843   1.80000   5.00000   parsed_1s4h   1   
         82   1   .   .   .   .   .   3.95274   1.80000   5.00000   parsed_1s4h   1   
         83   1   .   .   .   .   .   3.96973   1.80000   5.00000   parsed_1s4h   1   
         84   1   .   .   .   .   .   3.4318    1.8000    5.0000    parsed_1s4h   1   
         85   1   .   .   .   .   .   3.40414   1.80000   5.00000   parsed_1s4h   1   
         86   1   .   .   .   .   .   2.99019   1.80000   3.40000   parsed_1s4h   1   
         87   1   .   .   .   .   .   3.81005   1.80000   5.00000   parsed_1s4h   1   
         88   1   .   .   .   .   .   4.61156   1.80000   5.00000   parsed_1s4h   1   
         89   1   .   .   .   .   .   4.24431   1.80000   5.00000   parsed_1s4h   1   
         90   1   .   .   .   .   .   2.34058   1.80000   2.80000   parsed_1s4h   1   
         91   1   .   .   .   .   .   3.76911   1.80000   5.00000   parsed_1s4h   1   
         92   1   .   .   .   .   .   4.74771   1.80000   5.00000   parsed_1s4h   1   
         93   1   .   .   .   .   .   4.33311   1.80000   5.00000   parsed_1s4h   1   
         94   1   .   .   .   .   .   3.68084   1.80000   5.00000   parsed_1s4h   1   
         95   1   .   .   .   .   .   3.94502   1.80000   5.00000   parsed_1s4h   1   
         96   1   .   .   .   .   .   3.60653   1.80000   5.00000   parsed_1s4h   1   
         97   1   .   .   .   .   .   4.03908   1.80000   5.00000   parsed_1s4h   1   
         98   1   .   .   .   .   .   4.04467   1.80000   5.00000   parsed_1s4h   1   
         99   1   .   .   .   .   .   4.06686   1.80000   5.00000   parsed_1s4h   1   
        100   1   .   .   .   .   .   3.58466   1.80000   5.00000   parsed_1s4h   1   
        101   1   .   .   .   .   .   3.93799   1.80000   5.00000   parsed_1s4h   1   
        102   1   .   .   .   .   .   4.35275   1.80000   5.00000   parsed_1s4h   1   
        103   1   .   .   .   .   .   3.20458   1.80000   3.40000   parsed_1s4h   1   
        104   1   .   .   .   .   .   4.45036   1.80000   5.00000   parsed_1s4h   1   
    stop_

save_





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