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
145037 2kdr 16122 cing 2-parsed STAR distance NOE simple 163


data_2kdr_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2kdr 
    _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_2kdr   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2kdr 
    _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   2kdr   "Master copy"    parsed_2kdr   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2kdr 
    _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   2kdr.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"      0   parsed_2kdr   1   
        1   2kdr.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             163   parsed_2kdr   1   
        1   2kdr.mr   .   .    XPLOR/CNS     3   "dihedral angle"          "Not applicable"    "Not applicable"      0   parsed_2kdr   1   
        1   2kdr.mr   .   .   "MR format"    4   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_2kdr   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_2
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_2kdr 
    _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_2kdr   1   
          2   1   .   .   .   parsed_2kdr   1   
          3   1   .   .   .   parsed_2kdr   1   
          4   1   .   .   .   parsed_2kdr   1   
          5   1   .   .   .   parsed_2kdr   1   
          6   1   .   .   .   parsed_2kdr   1   
          7   1   .   .   .   parsed_2kdr   1   
          8   1   .   .   .   parsed_2kdr   1   
          9   1   .   .   .   parsed_2kdr   1   
         10   1   .   .   .   parsed_2kdr   1   
         11   1   .   .   .   parsed_2kdr   1   
         12   1   .   .   .   parsed_2kdr   1   
         13   1   .   .   .   parsed_2kdr   1   
         14   1   .   .   .   parsed_2kdr   1   
         15   1   .   .   .   parsed_2kdr   1   
         16   1   .   .   .   parsed_2kdr   1   
         17   1   .   .   .   parsed_2kdr   1   
         18   1   .   .   .   parsed_2kdr   1   
         19   1   .   .   .   parsed_2kdr   1   
         20   1   .   .   .   parsed_2kdr   1   
         21   1   .   .   .   parsed_2kdr   1   
         22   1   .   .   .   parsed_2kdr   1   
         23   1   .   .   .   parsed_2kdr   1   
         24   1   .   .   .   parsed_2kdr   1   
         25   1   .   .   .   parsed_2kdr   1   
         26   1   .   .   .   parsed_2kdr   1   
         27   1   .   .   .   parsed_2kdr   1   
         28   1   .   .   .   parsed_2kdr   1   
         29   1   .   .   .   parsed_2kdr   1   
         30   1   .   .   .   parsed_2kdr   1   
         31   1   .   .   .   parsed_2kdr   1   
         32   1   .   .   .   parsed_2kdr   1   
         33   1   .   .   .   parsed_2kdr   1   
         34   1   .   .   .   parsed_2kdr   1   
         35   1   .   .   .   parsed_2kdr   1   
         36   1   .   .   .   parsed_2kdr   1   
         37   1   .   .   .   parsed_2kdr   1   
         38   1   .   .   .   parsed_2kdr   1   
         39   1   .   .   .   parsed_2kdr   1   
         40   1   .   .   .   parsed_2kdr   1   
         41   1   .   .   .   parsed_2kdr   1   
         42   1   .   .   .   parsed_2kdr   1   
         43   1   .   .   .   parsed_2kdr   1   
         44   1   .   .   .   parsed_2kdr   1   
         45   1   .   .   .   parsed_2kdr   1   
         46   1   .   .   .   parsed_2kdr   1   
         47   1   .   .   .   parsed_2kdr   1   
         48   1   .   .   .   parsed_2kdr   1   
         49   1   .   .   .   parsed_2kdr   1   
         50   1   .   .   .   parsed_2kdr   1   
         51   1   .   .   .   parsed_2kdr   1   
         52   1   .   .   .   parsed_2kdr   1   
         53   1   .   .   .   parsed_2kdr   1   
         54   1   .   .   .   parsed_2kdr   1   
         55   1   .   .   .   parsed_2kdr   1   
         56   1   .   .   .   parsed_2kdr   1   
         57   1   .   .   .   parsed_2kdr   1   
         58   1   .   .   .   parsed_2kdr   1   
         59   1   .   .   .   parsed_2kdr   1   
         60   1   .   .   .   parsed_2kdr   1   
         61   1   .   .   .   parsed_2kdr   1   
         62   1   .   .   .   parsed_2kdr   1   
         63   1   .   .   .   parsed_2kdr   1   
         64   1   .   .   .   parsed_2kdr   1   
         65   1   .   .   .   parsed_2kdr   1   
         66   1   .   .   .   parsed_2kdr   1   
         67   1   .   .   .   parsed_2kdr   1   
         68   1   .   .   .   parsed_2kdr   1   
         69   1   .   .   .   parsed_2kdr   1   
         70   1   .   .   .   parsed_2kdr   1   
         71   1   .   .   .   parsed_2kdr   1   
         72   1   .   .   .   parsed_2kdr   1   
         73   1   .   .   .   parsed_2kdr   1   
         74   1   .   .   .   parsed_2kdr   1   
         75   1   .   .   .   parsed_2kdr   1   
         76   1   .   .   .   parsed_2kdr   1   
         77   1   .   .   .   parsed_2kdr   1   
         78   1   .   .   .   parsed_2kdr   1   
         79   1   .   .   .   parsed_2kdr   1   
         80   1   .   .   .   parsed_2kdr   1   
         81   1   .   .   .   parsed_2kdr   1   
         82   1   .   .   .   parsed_2kdr   1   
         83   1   .   .   .   parsed_2kdr   1   
         84   1   .   .   .   parsed_2kdr   1   
         85   1   .   .   .   parsed_2kdr   1   
         86   1   .   .   .   parsed_2kdr   1   
         87   1   .   .   .   parsed_2kdr   1   
         88   1   .   .   .   parsed_2kdr   1   
         89   1   .   .   .   parsed_2kdr   1   
         90   1   .   .   .   parsed_2kdr   1   
         91   1   .   .   .   parsed_2kdr   1   
         92   1   .   .   .   parsed_2kdr   1   
         93   1   .   .   .   parsed_2kdr   1   
         94   1   .   .   .   parsed_2kdr   1   
         95   1   .   .   .   parsed_2kdr   1   
         96   1   .   .   .   parsed_2kdr   1   
         97   1   .   .   .   parsed_2kdr   1   
         98   1   .   .   .   parsed_2kdr   1   
         99   1   .   .   .   parsed_2kdr   1   
        100   1   .   .   .   parsed_2kdr   1   
        101   1   .   .   .   parsed_2kdr   1   
        102   1   .   .   .   parsed_2kdr   1   
        103   1   .   .   .   parsed_2kdr   1   
        104   1   .   .   .   parsed_2kdr   1   
        105   1   .   .   .   parsed_2kdr   1   
        106   1   .   .   .   parsed_2kdr   1   
        107   1   .   .   .   parsed_2kdr   1   
        108   1   .   .   .   parsed_2kdr   1   
        109   1   .   .   .   parsed_2kdr   1   
        110   1   .   .   .   parsed_2kdr   1   
        111   1   .   .   .   parsed_2kdr   1   
        112   1   .   .   .   parsed_2kdr   1   
        113   1   .   .   .   parsed_2kdr   1   
        114   1   .   .   .   parsed_2kdr   1   
        115   1   .   .   .   parsed_2kdr   1   
        116   1   .   .   .   parsed_2kdr   1   
        117   1   .   .   .   parsed_2kdr   1   
        118   1   .   .   .   parsed_2kdr   1   
        119   1   .   .   .   parsed_2kdr   1   
        120   1   .   .   .   parsed_2kdr   1   
        121   1   .   .   .   parsed_2kdr   1   
        122   1   .   .   .   parsed_2kdr   1   
        123   1   .   .   .   parsed_2kdr   1   
        124   1   .   .   .   parsed_2kdr   1   
        125   1   .   .   .   parsed_2kdr   1   
        126   1   .   .   .   parsed_2kdr   1   
        127   1   .   .   .   parsed_2kdr   1   
        128   1   .   .   .   parsed_2kdr   1   
        129   1   .   .   .   parsed_2kdr   1   
        130   1   .   .   .   parsed_2kdr   1   
        131   1   .   .   .   parsed_2kdr   1   
        132   1   .   .   .   parsed_2kdr   1   
        133   1   .   .   .   parsed_2kdr   1   
        134   1   .   .   .   parsed_2kdr   1   
        135   1   .   .   .   parsed_2kdr   1   
        136   1   .   .   .   parsed_2kdr   1   
        137   1   .   .   .   parsed_2kdr   1   
        138   1   .   .   .   parsed_2kdr   1   
        139   1   .   .   .   parsed_2kdr   1   
        140   1   .   .   .   parsed_2kdr   1   
        141   1   .   .   .   parsed_2kdr   1   
        142   1   .   .   .   parsed_2kdr   1   
        143   1   .   .   .   parsed_2kdr   1   
        144   1   .   .   .   parsed_2kdr   1   
        145   1   .   .   .   parsed_2kdr   1   
        146   1   .   .   .   parsed_2kdr   1   
        147   1   .   .   .   parsed_2kdr   1   
        148   1   .   .   .   parsed_2kdr   1   
        149   1   .   .   .   parsed_2kdr   1   
        150   1   .   .   .   parsed_2kdr   1   
        151   1   .   .   .   parsed_2kdr   1   
        152   1   .   .   .   parsed_2kdr   1   
        153   1   .   .   .   parsed_2kdr   1   
        154   1   .   .   .   parsed_2kdr   1   
        155   1   .   .   .   parsed_2kdr   1   
        156   1   .   .   .   parsed_2kdr   1   
        157   1   .   .   .   parsed_2kdr   1   
        158   1   .   .   .   parsed_2kdr   1   
        159   1   .   .   .   parsed_2kdr   1   
        160   1   .   .   .   parsed_2kdr   1   
        161   1   .   .   .   parsed_2kdr   1   
        162   1   .   .   .   parsed_2kdr   1   
        163   1   .   .   .   parsed_2kdr   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   .   HA     parsed_2kdr   1   
          1   1   2   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_2kdr   1   
          2   1   1   .   .   .   .   .   .   .   .   .    1   .   HB2    parsed_2kdr   1   
          2   1   2   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_2kdr   1   
          3   1   1   .   .   .   .   .   .   .   .   .    1   .   HB1    parsed_2kdr   1   
          3   1   2   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_2kdr   1   
          4   1   1   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_2kdr   1   
          4   1   2   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_2kdr   1   
          5   1   1   .   .   .   .   .   .   .   .   .    2   .   HB#    parsed_2kdr   1   
          5   1   2   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_2kdr   1   
          6   1   1   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_2kdr   1   
          6   1   2   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_2kdr   1   
          7   1   1   .   .   .   .   .   .   .   .   .    3   .   HB#    parsed_2kdr   1   
          7   1   2   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_2kdr   1   
          8   1   1   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_2kdr   1   
          8   1   2   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_2kdr   1   
          9   1   1   .   .   .   .   .   .   .   .   .    4   .   HB#    parsed_2kdr   1   
          9   1   2   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_2kdr   1   
         10   1   1   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_2kdr   1   
         10   1   2   .   .   .   .   .   .   .   .   .    6   .   HN     parsed_2kdr   1   
         11   1   1   .   .   .   .   .   .   .   .   .    4   .   HA     parsed_2kdr   1   
         11   1   2   .   .   .   .   .   .   .   .   .    7   .   HB     parsed_2kdr   1   
         12   1   1   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_2kdr   1   
         12   1   2   .   .   .   .   .   .   .   .   .    6   .   HN     parsed_2kdr   1   
         13   1   1   .   .   .   .   .   .   .   .   .    5   .   HB#    parsed_2kdr   1   
         13   1   2   .   .   .   .   .   .   .   .   .    6   .   HN     parsed_2kdr   1   
         14   1   1   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_2kdr   1   
         14   1   2   .   .   .   .   .   .   .   .   .    7   .   HN     parsed_2kdr   1   
         15   1   1   .   .   .   .   .   .   .   .   .    5   .   HA     parsed_2kdr   1   
         15   1   2   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_2kdr   1   
         16   1   1   .   .   .   .   .   .   .   .   .    5   .   HA     parsed_2kdr   1   
         16   1   2   .   .   .   .   .   .   .   .   .    8   .   HB     parsed_2kdr   1   
         17   1   1   .   .   .   .   .   .   .   .   .    5   .   HA     parsed_2kdr   1   
         17   1   2   .   .   .   .   .   .   .   .   .    8   .   HG2#   parsed_2kdr   1   
         18   1   1   .   .   .   .   .   .   .   .   .    6   .   HN     parsed_2kdr   1   
         18   1   2   .   .   .   .   .   .   .   .   .    7   .   HN     parsed_2kdr   1   
         19   1   1   .   .   .   .   .   .   .   .   .    6   .   HA     parsed_2kdr   1   
         19   1   2   .   .   .   .   .   .   .   .   .    7   .   HN     parsed_2kdr   1   
         20   1   1   .   .   .   .   .   .   .   .   .    6   .   HB#    parsed_2kdr   1   
         20   1   2   .   .   .   .   .   .   .   .   .    7   .   HN     parsed_2kdr   1   
         21   1   1   .   .   .   .   .   .   .   .   .    6   .   HN     parsed_2kdr   1   
         21   1   2   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_2kdr   1   
         22   1   1   .   .   .   .   .   .   .   .   .    6   .   HA     parsed_2kdr   1   
         22   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2kdr   1   
         23   1   1   .   .   .   .   .   .   .   .   .    6   .   HA     parsed_2kdr   1   
         23   1   2   .   .   .   .   .   .   .   .   .    9   .   HB#    parsed_2kdr   1   
         24   1   1   .   .   .   .   .   .   .   .   .    7   .   HN     parsed_2kdr   1   
         24   1   2   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_2kdr   1   
         25   1   1   .   .   .   .   .   .   .   .   .    7   .   HA     parsed_2kdr   1   
         25   1   2   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_2kdr   1   
         26   1   1   .   .   .   .   .   .   .   .   .    7   .   HB     parsed_2kdr   1   
         26   1   2   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_2kdr   1   
         27   1   1   .   .   .   .   .   .   .   .   .    7   .   HG2#   parsed_2kdr   1   
         27   1   2   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_2kdr   1   
         28   1   1   .   .   .   .   .   .   .   .   .    7   .   HG1#   parsed_2kdr   1   
         28   1   2   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_2kdr   1   
         29   1   1   .   .   .   .   .   .   .   .   .    7   .   HN     parsed_2kdr   1   
         29   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2kdr   1   
         30   1   1   .   .   .   .   .   .   .   .   .    7   .   HA     parsed_2kdr   1   
         30   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2kdr   1   
         31   1   1   .   .   .   .   .   .   .   .   .    7   .   HA     parsed_2kdr   1   
         31   1   2   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_2kdr   1   
         32   1   1   .   .   .   .   .   .   .   .   .    7   .   HA     parsed_2kdr   1   
         32   1   2   .   .   .   .   .   .   .   .   .   10   .   HB     parsed_2kdr   1   
         33   1   1   .   .   .   .   .   .   .   .   .    7   .   HA     parsed_2kdr   1   
         33   1   2   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2kdr   1   
         34   1   1   .   .   .   .   .   .   .   .   .    8   .   HA     parsed_2kdr   1   
         34   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2kdr   1   
         35   1   1   .   .   .   .   .   .   .   .   .    8   .   HB     parsed_2kdr   1   
         35   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2kdr   1   
         36   1   1   .   .   .   .   .   .   .   .   .    8   .   HG2#   parsed_2kdr   1   
         36   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2kdr   1   
         37   1   1   .   .   .   .   .   .   .   .   .    8   .   HA     parsed_2kdr   1   
         37   1   2   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_2kdr   1   
         38   1   1   .   .   .   .   .   .   .   .   .    8   .   HA     parsed_2kdr   1   
         38   1   2   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2kdr   1   
         39   1   1   .   .   .   .   .   .   .   .   .    8   .   HA     parsed_2kdr   1   
         39   1   2   .   .   .   .   .   .   .   .   .   11   .   HB2    parsed_2kdr   1   
         40   1   1   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2kdr   1   
         40   1   2   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_2kdr   1   
         41   1   1   .   .   .   .   .   .   .   .   .    9   .   HA     parsed_2kdr   1   
         41   1   2   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_2kdr   1   
         42   1   1   .   .   .   .   .   .   .   .   .    9   .   HB#    parsed_2kdr   1   
         42   1   2   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_2kdr   1   
         43   1   1   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2kdr   1   
         43   1   2   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2kdr   1   
         44   1   1   .   .   .   .   .   .   .   .   .    9   .   HA     parsed_2kdr   1   
         44   1   2   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2kdr   1   
         45   1   1   .   .   .   .   .   .   .   .   .    9   .   HA     parsed_2kdr   1   
         45   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2kdr   1   
         46   1   1   .   .   .   .   .   .   .   .   .    9   .   HA     parsed_2kdr   1   
         46   1   2   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_2kdr   1   
         47   1   1   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_2kdr   1   
         47   1   2   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2kdr   1   
         48   1   1   .   .   .   .   .   .   .   .   .   10   .   HA     parsed_2kdr   1   
         48   1   2   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2kdr   1   
         49   1   1   .   .   .   .   .   .   .   .   .   10   .   HB     parsed_2kdr   1   
         49   1   2   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2kdr   1   
         50   1   1   .   .   .   .   .   .   .   .   .   10   .   HA     parsed_2kdr   1   
         50   1   2   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_2kdr   1   
         51   1   1   .   .   .   .   .   .   .   .   .   10   .   HA     parsed_2kdr   1   
         51   1   2   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2kdr   1   
         52   1   1   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2kdr   1   
         52   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2kdr   1   
         53   1   1   .   .   .   .   .   .   .   .   .   11   .   HA     parsed_2kdr   1   
         53   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2kdr   1   
         54   1   1   .   .   .   .   .   .   .   .   .   11   .   HB2    parsed_2kdr   1   
         54   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2kdr   1   
         55   1   1   .   .   .   .   .   .   .   .   .   11   .   HB1    parsed_2kdr   1   
         55   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2kdr   1   
         56   1   1   .   .   .   .   .   .   .   .   .   11   .   HA     parsed_2kdr   1   
         56   1   2   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_2kdr   1   
         57   1   1   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2kdr   1   
         57   1   2   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_2kdr   1   
         58   1   1   .   .   .   .   .   .   .   .   .   12   .   HA     parsed_2kdr   1   
         58   1   2   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_2kdr   1   
         59   1   1   .   .   .   .   .   .   .   .   .   12   .   HB#    parsed_2kdr   1   
         59   1   2   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_2kdr   1   
         60   1   1   .   .   .   .   .   .   .   .   .   13   .   HB1    parsed_2kdr   1   
         60   1   2   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2kdr   1   
         61   1   1   .   .   .   .   .   .   .   .   .   13   .   HN     parsed_2kdr   1   
         61   1   2   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2kdr   1   
         62   1   1   .   .   .   .   .   .   .   .   .   13   .   HA     parsed_2kdr   1   
         62   1   2   .   .   .   .   .   .   .   .   .   16   .   HN     parsed_2kdr   1   
         63   1   1   .   .   .   .   .   .   .   .   .   13   .   HA     parsed_2kdr   1   
         63   1   2   .   .   .   .   .   .   .   .   .   16   .   HB     parsed_2kdr   1   
         64   1   1   .   .   .   .   .   .   .   .   .   13   .   HA     parsed_2kdr   1   
         64   1   2   .   .   .   .   .   .   .   .   .   16   .   HG1#   parsed_2kdr   1   
         65   1   1   .   .   .   .   .   .   .   .   .   13   .   HA     parsed_2kdr   1   
         65   1   2   .   .   .   .   .   .   .   .   .   16   .   HG2#   parsed_2kdr   1   
         66   1   1   .   .   .   .   .   .   .   .   .   13   .   HA     parsed_2kdr   1   
         66   1   2   .   .   .   .   .   .   .   .   .   17   .   HN     parsed_2kdr   1   
         67   1   1   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2kdr   1   
         67   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2kdr   1   
         68   1   1   .   .   .   .   .   .   .   .   .   14   .   HA     parsed_2kdr   1   
         68   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2kdr   1   
         69   1   1   .   .   .   .   .   .   .   .   .   14   .   HB1    parsed_2kdr   1   
         69   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2kdr   1   
         70   1   1   .   .   .   .   .   .   .   .   .   14   .   HB2    parsed_2kdr   1   
         70   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2kdr   1   
         71   1   1   .   .   .   .   .   .   .   .   .   14   .   HD*    parsed_2kdr   1   
         71   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2kdr   1   
         72   1   1   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2kdr   1   
         72   1   2   .   .   .   .   .   .   .   .   .   16   .   HN     parsed_2kdr   1   
         73   1   1   .   .   .   .   .   .   .   .   .   14   .   HA     parsed_2kdr   1   
         73   1   2   .   .   .   .   .   .   .   .   .   17   .   HN     parsed_2kdr   1   
         74   1   1   .   .   .   .   .   .   .   .   .   14   .   HA     parsed_2kdr   1   
         74   1   2   .   .   .   .   .   .   .   .   .   17   .   HB     parsed_2kdr   1   
         75   1   1   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2kdr   1   
         75   1   2   .   .   .   .   .   .   .   .   .   16   .   HN     parsed_2kdr   1   
         76   1   1   .   .   .   .   .   .   .   .   .   15   .   HA     parsed_2kdr   1   
         76   1   2   .   .   .   .   .   .   .   .   .   16   .   HN     parsed_2kdr   1   
         77   1   1   .   .   .   .   .   .   .   .   .   15   .   HB     parsed_2kdr   1   
         77   1   2   .   .   .   .   .   .   .   .   .   16   .   HN     parsed_2kdr   1   
         78   1   1   .   .   .   .   .   .   .   .   .   15   .   HG2#   parsed_2kdr   1   
         78   1   2   .   .   .   .   .   .   .   .   .   16   .   HN     parsed_2kdr   1   
         79   1   1   .   .   .   .   .   .   .   .   .   15   .   HA     parsed_2kdr   1   
         79   1   2   .   .   .   .   .   .   .   .   .   18   .   HN     parsed_2kdr   1   
         80   1   1   .   .   .   .   .   .   .   .   .   15   .   HA     parsed_2kdr   1   
         80   1   2   .   .   .   .   .   .   .   .   .   18   .   HB2    parsed_2kdr   1   
         81   1   1   .   .   .   .   .   .   .   .   .   15   .   HA     parsed_2kdr   1   
         81   1   2   .   .   .   .   .   .   .   .   .   18   .   HB1    parsed_2kdr   1   
         82   1   1   .   .   .   .   .   .   .   .   .   15   .   HA     parsed_2kdr   1   
         82   1   2   .   .   .   .   .   .   .   .   .   19   .   HN     parsed_2kdr   1   
         83   1   1   .   .   .   .   .   .   .   .   .   16   .   HN     parsed_2kdr   1   
         83   1   2   .   .   .   .   .   .   .   .   .   17   .   HN     parsed_2kdr   1   
         84   1   1   .   .   .   .   .   .   .   .   .   16   .   HA     parsed_2kdr   1   
         84   1   2   .   .   .   .   .   .   .   .   .   17   .   HN     parsed_2kdr   1   
         85   1   1   .   .   .   .   .   .   .   .   .   16   .   HB     parsed_2kdr   1   
         85   1   2   .   .   .   .   .   .   .   .   .   17   .   HN     parsed_2kdr   1   
         86   1   1   .   .   .   .   .   .   .   .   .   16   .   HG1#   parsed_2kdr   1   
         86   1   2   .   .   .   .   .   .   .   .   .   17   .   HN     parsed_2kdr   1   
         87   1   1   .   .   .   .   .   .   .   .   .   16   .   HG2#   parsed_2kdr   1   
         87   1   2   .   .   .   .   .   .   .   .   .   17   .   HN     parsed_2kdr   1   
         88   1   1   .   .   .   .   .   .   .   .   .   16   .   HN     parsed_2kdr   1   
         88   1   2   .   .   .   .   .   .   .   .   .   18   .   HN     parsed_2kdr   1   
         89   1   1   .   .   .   .   .   .   .   .   .   16   .   HA     parsed_2kdr   1   
         89   1   2   .   .   .   .   .   .   .   .   .   18   .   HN     parsed_2kdr   1   
         90   1   1   .   .   .   .   .   .   .   .   .   16   .   HA     parsed_2kdr   1   
         90   1   2   .   .   .   .   .   .   .   .   .   19   .   HN     parsed_2kdr   1   
         91   1   1   .   .   .   .   .   .   .   .   .   16   .   HA     parsed_2kdr   1   
         91   1   2   .   .   .   .   .   .   .   .   .   19   .   HB#    parsed_2kdr   1   
         92   1   1   .   .   .   .   .   .   .   .   .   16   .   HA     parsed_2kdr   1   
         92   1   2   .   .   .   .   .   .   .   .   .   19   .   HG     parsed_2kdr   1   
         93   1   1   .   .   .   .   .   .   .   .   .   16   .   HA     parsed_2kdr   1   
         93   1   2   .   .   .   .   .   .   .   .   .   20   .   HN     parsed_2kdr   1   
         94   1   1   .   .   .   .   .   .   .   .   .   17   .   HN     parsed_2kdr   1   
         94   1   2   .   .   .   .   .   .   .   .   .   18   .   HN     parsed_2kdr   1   
         95   1   1   .   .   .   .   .   .   .   .   .   17   .   HA     parsed_2kdr   1   
         95   1   2   .   .   .   .   .   .   .   .   .   18   .   HN     parsed_2kdr   1   
         96   1   1   .   .   .   .   .   .   .   .   .   17   .   HB     parsed_2kdr   1   
         96   1   2   .   .   .   .   .   .   .   .   .   18   .   HN     parsed_2kdr   1   
         97   1   1   .   .   .   .   .   .   .   .   .   17   .   HG2#   parsed_2kdr   1   
         97   1   2   .   .   .   .   .   .   .   .   .   18   .   HN     parsed_2kdr   1   
         98   1   1   .   .   .   .   .   .   .   .   .   17   .   HA     parsed_2kdr   1   
         98   1   2   .   .   .   .   .   .   .   .   .   19   .   HN     parsed_2kdr   1   
         99   1   1   .   .   .   .   .   .   .   .   .   17   .   HA     parsed_2kdr   1   
         99   1   2   .   .   .   .   .   .   .   .   .   20   .   HN     parsed_2kdr   1   
        100   1   1   .   .   .   .   .   .   .   .   .   17   .   HA     parsed_2kdr   1   
        100   1   2   .   .   .   .   .   .   .   .   .   20   .   HB2    parsed_2kdr   1   
        101   1   1   .   .   .   .   .   .   .   .   .   17   .   HA     parsed_2kdr   1   
        101   1   2   .   .   .   .   .   .   .   .   .   20   .   HB1    parsed_2kdr   1   
        102   1   1   .   .   .   .   .   .   .   .   .   17   .   HA     parsed_2kdr   1   
        102   1   2   .   .   .   .   .   .   .   .   .   21   .   HN     parsed_2kdr   1   
        103   1   1   .   .   .   .   .   .   .   .   .   18   .   HN     parsed_2kdr   1   
        103   1   2   .   .   .   .   .   .   .   .   .   19   .   HN     parsed_2kdr   1   
        104   1   1   .   .   .   .   .   .   .   .   .   18   .   HA     parsed_2kdr   1   
        104   1   2   .   .   .   .   .   .   .   .   .   19   .   HN     parsed_2kdr   1   
        105   1   1   .   .   .   .   .   .   .   .   .   18   .   HB1    parsed_2kdr   1   
        105   1   2   .   .   .   .   .   .   .   .   .   19   .   HN     parsed_2kdr   1   
        106   1   1   .   .   .   .   .   .   .   .   .   18   .   HB2    parsed_2kdr   1   
        106   1   2   .   .   .   .   .   .   .   .   .   19   .   HN     parsed_2kdr   1   
        107   1   1   .   .   .   .   .   .   .   .   .   18   .   HN     parsed_2kdr   1   
        107   1   2   .   .   .   .   .   .   .   .   .   20   .   HN     parsed_2kdr   1   
        108   1   1   .   .   .   .   .   .   .   .   .   18   .   HA     parsed_2kdr   1   
        108   1   2   .   .   .   .   .   .   .   .   .   21   .   HN     parsed_2kdr   1   
        109   1   1   .   .   .   .   .   .   .   .   .   18   .   HA     parsed_2kdr   1   
        109   1   2   .   .   .   .   .   .   .   .   .   22   .   HN     parsed_2kdr   1   
        110   1   1   .   .   .   .   .   .   .   .   .   19   .   HN     parsed_2kdr   1   
        110   1   2   .   .   .   .   .   .   .   .   .   20   .   HN     parsed_2kdr   1   
        111   1   1   .   .   .   .   .   .   .   .   .   19   .   HB#    parsed_2kdr   1   
        111   1   2   .   .   .   .   .   .   .   .   .   20   .   HN     parsed_2kdr   1   
        112   1   1   .   .   .   .   .   .   .   .   .   20   .   HN     parsed_2kdr   1   
        112   1   2   .   .   .   .   .   .   .   .   .   21   .   HN     parsed_2kdr   1   
        113   1   1   .   .   .   .   .   .   .   .   .   20   .   HA     parsed_2kdr   1   
        113   1   2   .   .   .   .   .   .   .   .   .   21   .   HN     parsed_2kdr   1   
        114   1   1   .   .   .   .   .   .   .   .   .   20   .   HB1    parsed_2kdr   1   
        114   1   2   .   .   .   .   .   .   .   .   .   21   .   HN     parsed_2kdr   1   
        115   1   1   .   .   .   .   .   .   .   .   .   20   .   HN     parsed_2kdr   1   
        115   1   2   .   .   .   .   .   .   .   .   .   22   .   HN     parsed_2kdr   1   
        116   1   1   .   .   .   .   .   .   .   .   .   20   .   HA     parsed_2kdr   1   
        116   1   2   .   .   .   .   .   .   .   .   .   23   .   HN     parsed_2kdr   1   
        117   1   1   .   .   .   .   .   .   .   .   .   20   .   HA     parsed_2kdr   1   
        117   1   2   .   .   .   .   .   .   .   .   .   23   .   HB1    parsed_2kdr   1   
        118   1   1   .   .   .   .   .   .   .   .   .   21   .   HN     parsed_2kdr   1   
        118   1   2   .   .   .   .   .   .   .   .   .   22   .   HN     parsed_2kdr   1   
        119   1   1   .   .   .   .   .   .   .   .   .   21   .   HA     parsed_2kdr   1   
        119   1   2   .   .   .   .   .   .   .   .   .   22   .   HN     parsed_2kdr   1   
        120   1   1   .   .   .   .   .   .   .   .   .   21   .   HN     parsed_2kdr   1   
        120   1   2   .   .   .   .   .   .   .   .   .   23   .   HN     parsed_2kdr   1   
        121   1   1   .   .   .   .   .   .   .   .   .   21   .   HA     parsed_2kdr   1   
        121   1   2   .   .   .   .   .   .   .   .   .   23   .   HN     parsed_2kdr   1   
        122   1   1   .   .   .   .   .   .   .   .   .   21   .   HA     parsed_2kdr   1   
        122   1   2   .   .   .   .   .   .   .   .   .   24   .   HN     parsed_2kdr   1   
        123   1   1   .   .   .   .   .   .   .   .   .   21   .   HA     parsed_2kdr   1   
        123   1   2   .   .   .   .   .   .   .   .   .   24   .   HB#    parsed_2kdr   1   
        124   1   1   .   .   .   .   .   .   .   .   .   22   .   HN     parsed_2kdr   1   
        124   1   2   .   .   .   .   .   .   .   .   .   23   .   HN     parsed_2kdr   1   
        125   1   1   .   .   .   .   .   .   .   .   .   22   .   HA     parsed_2kdr   1   
        125   1   2   .   .   .   .   .   .   .   .   .   23   .   HN     parsed_2kdr   1   
        126   1   1   .   .   .   .   .   .   .   .   .   22   .   HB2    parsed_2kdr   1   
        126   1   2   .   .   .   .   .   .   .   .   .   23   .   HN     parsed_2kdr   1   
        127   1   1   .   .   .   .   .   .   .   .   .   22   .   HB1    parsed_2kdr   1   
        127   1   2   .   .   .   .   .   .   .   .   .   23   .   HN     parsed_2kdr   1   
        128   1   1   .   .   .   .   .   .   .   .   .   22   .   HN     parsed_2kdr   1   
        128   1   2   .   .   .   .   .   .   .   .   .   24   .   HN     parsed_2kdr   1   
        129   1   1   .   .   .   .   .   .   .   .   .   22   .   HA     parsed_2kdr   1   
        129   1   2   .   .   .   .   .   .   .   .   .   24   .   HN     parsed_2kdr   1   
        130   1   1   .   .   .   .   .   .   .   .   .   22   .   HA     parsed_2kdr   1   
        130   1   2   .   .   .   .   .   .   .   .   .   25   .   HB2    parsed_2kdr   1   
        131   1   1   .   .   .   .   .   .   .   .   .   22   .   HA     parsed_2kdr   1   
        131   1   2   .   .   .   .   .   .   .   .   .   25   .   HB1    parsed_2kdr   1   
        132   1   1   .   .   .   .   .   .   .   .   .   22   .   HA     parsed_2kdr   1   
        132   1   2   .   .   .   .   .   .   .   .   .   26   .   HN     parsed_2kdr   1   
        133   1   1   .   .   .   .   .   .   .   .   .   23   .   HN     parsed_2kdr   1   
        133   1   2   .   .   .   .   .   .   .   .   .   24   .   HN     parsed_2kdr   1   
        134   1   1   .   .   .   .   .   .   .   .   .   23   .   HA     parsed_2kdr   1   
        134   1   2   .   .   .   .   .   .   .   .   .   24   .   HN     parsed_2kdr   1   
        135   1   1   .   .   .   .   .   .   .   .   .   23   .   HB1    parsed_2kdr   1   
        135   1   2   .   .   .   .   .   .   .   .   .   24   .   HN     parsed_2kdr   1   
        136   1   1   .   .   .   .   .   .   .   .   .   23   .   HB2    parsed_2kdr   1   
        136   1   2   .   .   .   .   .   .   .   .   .   24   .   HN     parsed_2kdr   1   
        137   1   1   .   .   .   .   .   .   .   .   .   23   .   HN     parsed_2kdr   1   
        137   1   2   .   .   .   .   .   .   .   .   .   25   .   HN     parsed_2kdr   1   
        138   1   1   .   .   .   .   .   .   .   .   .   23   .   HA     parsed_2kdr   1   
        138   1   2   .   .   .   .   .   .   .   .   .   26   .   HN     parsed_2kdr   1   
        139   1   1   .   .   .   .   .   .   .   .   .   23   .   HA     parsed_2kdr   1   
        139   1   2   .   .   .   .   .   .   .   .   .   26   .   HB2    parsed_2kdr   1   
        140   1   1   .   .   .   .   .   .   .   .   .   23   .   HA     parsed_2kdr   1   
        140   1   2   .   .   .   .   .   .   .   .   .   26   .   HB1    parsed_2kdr   1   
        141   1   1   .   .   .   .   .   .   .   .   .   23   .   HA     parsed_2kdr   1   
        141   1   2   .   .   .   .   .   .   .   .   .   27   .   HN     parsed_2kdr   1   
        142   1   1   .   .   .   .   .   .   .   .   .   24   .   HN     parsed_2kdr   1   
        142   1   2   .   .   .   .   .   .   .   .   .   25   .   HN     parsed_2kdr   1   
        143   1   1   .   .   .   .   .   .   .   .   .   24   .   HA     parsed_2kdr   1   
        143   1   2   .   .   .   .   .   .   .   .   .   25   .   HN     parsed_2kdr   1   
        144   1   1   .   .   .   .   .   .   .   .   .   24   .   HB#    parsed_2kdr   1   
        144   1   2   .   .   .   .   .   .   .   .   .   25   .   HN     parsed_2kdr   1   
        145   1   1   .   .   .   .   .   .   .   .   .   24   .   HA     parsed_2kdr   1   
        145   1   2   .   .   .   .   .   .   .   .   .   27   .   HN     parsed_2kdr   1   
        146   1   1   .   .   .   .   .   .   .   .   .   24   .   HA     parsed_2kdr   1   
        146   1   2   .   .   .   .   .   .   .   .   .   27   .   HB     parsed_2kdr   1   
        147   1   1   .   .   .   .   .   .   .   .   .   24   .   HA     parsed_2kdr   1   
        147   1   2   .   .   .   .   .   .   .   .   .   27   .   HG12   parsed_2kdr   1   
        148   1   1   .   .   .   .   .   .   .   .   .   24   .   HA     parsed_2kdr   1   
        148   1   2   .   .   .   .   .   .   .   .   .   27   .   HD1#   parsed_2kdr   1   
        149   1   1   .   .   .   .   .   .   .   .   .   24   .   HA     parsed_2kdr   1   
        149   1   2   .   .   .   .   .   .   .   .   .   27   .   HG2#   parsed_2kdr   1   
        150   1   1   .   .   .   .   .   .   .   .   .   25   .   HN     parsed_2kdr   1   
        150   1   2   .   .   .   .   .   .   .   .   .   26   .   HN     parsed_2kdr   1   
        151   1   1   .   .   .   .   .   .   .   .   .   25   .   HA     parsed_2kdr   1   
        151   1   2   .   .   .   .   .   .   .   .   .   26   .   HN     parsed_2kdr   1   
        152   1   1   .   .   .   .   .   .   .   .   .   25   .   HB1    parsed_2kdr   1   
        152   1   2   .   .   .   .   .   .   .   .   .   26   .   HN     parsed_2kdr   1   
        153   1   1   .   .   .   .   .   .   .   .   .   25   .   HB2    parsed_2kdr   1   
        153   1   2   .   .   .   .   .   .   .   .   .   26   .   HN     parsed_2kdr   1   
        154   1   1   .   .   .   .   .   .   .   .   .   25   .   HA     parsed_2kdr   1   
        154   1   2   .   .   .   .   .   .   .   .   .   27   .   HN     parsed_2kdr   1   
        155   1   1   .   .   .   .   .   .   .   .   .   25   .   HA     parsed_2kdr   1   
        155   1   2   .   .   .   .   .   .   .   .   .   28   .   HN     parsed_2kdr   1   
        156   1   1   .   .   .   .   .   .   .   .   .   26   .   HB2    parsed_2kdr   1   
        156   1   2   .   .   .   .   .   .   .   .   .   27   .   HN     parsed_2kdr   1   
        157   1   1   .   .   .   .   .   .   .   .   .   26   .   HB1    parsed_2kdr   1   
        157   1   2   .   .   .   .   .   .   .   .   .   27   .   HN     parsed_2kdr   1   
        158   1   1   .   .   .   .   .   .   .   .   .   26   .   HN     parsed_2kdr   1   
        158   1   2   .   .   .   .   .   .   .   .   .   28   .   HN     parsed_2kdr   1   
        159   1   1   .   .   .   .   .   .   .   .   .   27   .   HN     parsed_2kdr   1   
        159   1   2   .   .   .   .   .   .   .   .   .   28   .   HN     parsed_2kdr   1   
        160   1   1   .   .   .   .   .   .   .   .   .   27   .   HA     parsed_2kdr   1   
        160   1   2   .   .   .   .   .   .   .   .   .   28   .   HN     parsed_2kdr   1   
        161   1   1   .   .   .   .   .   .   .   .   .   27   .   HB     parsed_2kdr   1   
        161   1   2   .   .   .   .   .   .   .   .   .   28   .   HN     parsed_2kdr   1   
        162   1   1   .   .   .   .   .   .   .   .   .   27   .   HG12   parsed_2kdr   1   
        162   1   2   .   .   .   .   .   .   .   .   .   28   .   HN     parsed_2kdr   1   
        163   1   1   .   .   .   .   .   .   .   .   .   27   .   HG2#   parsed_2kdr   1   
        163   1   2   .   .   .   .   .   .   .   .   .   28   .   HN     parsed_2kdr   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   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
          2   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
          3   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
          4   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
          5   1   .   .   .   .   .   3.9   1.8   5.3   parsed_2kdr   1   
          6   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
          7   1   .   .   .   .   .   2.8   1.8   4.1   parsed_2kdr   1   
          8   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
          9   1   .   .   .   .   .   2.8   1.8   4.1   parsed_2kdr   1   
         10   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         11   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         12   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         13   1   .   .   .   .   .   2.8   1.8   4.1   parsed_2kdr   1   
         14   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         15   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         16   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         17   1   .   .   .   .   .   5.0   1.8   6.5   parsed_2kdr   1   
         18   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         19   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         20   1   .   .   .   .   .   2.8   1.8   4.1   parsed_2kdr   1   
         21   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         22   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         23   1   .   .   .   .   .   2.8   1.8   4.1   parsed_2kdr   1   
         24   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         25   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         26   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         27   1   .   .   .   .   .   5.0   1.8   6.5   parsed_2kdr   1   
         28   1   .   .   .   .   .   5.0   1.8   6.5   parsed_2kdr   1   
         29   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         30   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         31   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         32   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         33   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         34   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         35   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         36   1   .   .   .   .   .   3.9   1.8   5.3   parsed_2kdr   1   
         37   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         38   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         39   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         40   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         41   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         42   1   .   .   .   .   .   2.8   1.8   4.1   parsed_2kdr   1   
         43   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         44   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         45   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         46   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         47   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         48   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         49   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         50   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         51   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         52   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         53   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         54   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         55   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         56   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         57   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         58   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         59   1   .   .   .   .   .   5.0   1.8   6.5   parsed_2kdr   1   
         60   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         61   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         62   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         63   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         64   1   .   .   .   .   .   5.0   1.8   6.5   parsed_2kdr   1   
         65   1   .   .   .   .   .   5.0   1.8   6.5   parsed_2kdr   1   
         66   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         67   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         68   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         69   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         70   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         71   1   .   .   .   .   .   5.0   1.8   7.9   parsed_2kdr   1   
         72   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         73   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         74   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         75   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         76   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         77   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         78   1   .   .   .   .   .   5.0   1.8   6.5   parsed_2kdr   1   
         79   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         80   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         81   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         82   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         83   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         84   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         85   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         86   1   .   .   .   .   .   5.0   1.8   6.5   parsed_2kdr   1   
         87   1   .   .   .   .   .   3.9   1.8   5.3   parsed_2kdr   1   
         88   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         89   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         90   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         91   1   .   .   .   .   .   2.8   1.8   4.1   parsed_2kdr   1   
         92   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         93   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         94   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
         95   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
         96   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         97   1   .   .   .   .   .   5.0   1.8   6.5   parsed_2kdr   1   
         98   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
         99   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        100   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        101   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        102   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        103   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        104   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        105   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        106   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        107   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        108   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        109   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        110   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        111   1   .   .   .   .   .   2.8   1.8   4.1   parsed_2kdr   1   
        112   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        113   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        114   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        115   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        116   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        117   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        118   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        119   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        120   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        121   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        122   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        123   1   .   .   .   .   .   2.8   1.8   4.1   parsed_2kdr   1   
        124   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        125   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        126   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        127   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        128   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        129   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        130   1   .   .   .   .   .   3.9   1.8   5.3   parsed_2kdr   1   
        131   1   .   .   .   .   .   3.9   1.8   5.3   parsed_2kdr   1   
        132   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        133   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        134   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        135   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        136   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        137   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        138   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        139   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        140   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        141   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        142   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        143   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        144   1   .   .   .   .   .   2.8   1.8   4.1   parsed_2kdr   1   
        145   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        146   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        147   1   .   .   .   .   .   3.9   1.8   5.3   parsed_2kdr   1   
        148   1   .   .   .   .   .   3.9   1.8   5.3   parsed_2kdr   1   
        149   1   .   .   .   .   .   3.9   1.8   5.3   parsed_2kdr   1   
        150   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        151   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        152   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        153   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        154   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        155   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        156   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        157   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        158   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        159   1   .   .   .   .   .   2.8   1.8   3.1   parsed_2kdr   1   
        160   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        161   1   .   .   .   .   .   3.9   1.8   4.3   parsed_2kdr   1   
        162   1   .   .   .   .   .   5.0   1.8   5.5   parsed_2kdr   1   
        163   1   .   .   .   .   .   5.0   1.8   6.5   parsed_2kdr   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   
;
============================================================================
> RESTRAINTS FROM s26stfe50
> SEQUENCE
SDAAARVTAILSSLTVTQLLRRLHQWIS

> CORRECTION FACTOR FOR PSEUDO-ATOMS
-CH2#       = +1.0 A (ex.: HB#  in F)
-CH3#       = +1.0 A (ex.: HG2# in I)
-Haromatic# = +2.0 A (ex.: HD*  in Y)
-CH3*       = +2.4 A (ex.: HD*  in L)
-Haromatic* = +2.4 A (ex.: H*   in F)
============================================================================

<========== S1 ==========>
;
     1   1    14   35   parsed_2kdr   1   
         2   "<========== D2 ==========>"                                         18   1    19   35   parsed_2kdr   1   
         3   "<========== A3 ==========>"                                         22   1    23   35   parsed_2kdr   1   
         4   "<========== A4 ==========>"                                         26   1    27   35   parsed_2kdr   1   
         5   "<========== A5 ==========>"                                         32   1    33   35   parsed_2kdr   1   
         6   "<========== R6 ==========>"                                         40   1    41   35   parsed_2kdr   1   
         7   "<========== V7 ==========>"                                         48   1    49   35   parsed_2kdr   1   
         8   "<========== T8 ==========>"                                         60   1    61   35   parsed_2kdr   1   
         9   "<========== A9 ==========>"                                         68   1    69   35   parsed_2kdr   1   
        10   "<========== I10 ==========>"                                        77   1    78   36   parsed_2kdr   1   
        11   
;
!!verrouillage supplementaire du run s26s_6:
assign (resid 10    and name HA   )(resid 13    and name HB#  )  3.9  2.1  1.4
;
    83   1    84   80   parsed_2kdr   1   
        12   "<========== L11 ==========>"                                        86   1    87   36   parsed_2kdr   1   
        13   "ssign (resid 11    and name HN   )(resid 13    and name HN   )"     92   1    92   66   parsed_2kdr   1   
        14   "<========== S12 ==========>"                                        94   1    95   36   parsed_2kdr   1   
        15   "<========== S13 ==========>"                                        99   1   100   36   parsed_2kdr   1   
        16   
;
s26s_2
ssign (resid 13    and name HA   )(resid 16    and name HG1# )  3.9  2.1  1.4
ssign (resid 13    and name HA   )(resid 16    and name HG2# )  3.9  2.1  1.4
;
   107   1   109   79   parsed_2kdr   1   
        17   "<========== L14 ==========>"                                       111   1   112   36   parsed_2kdr   1   
        18   "<========== T15 ==========>"                                       121   1   122   36   parsed_2kdr   1   
        19    s26s_3                                                             128   1   128    8   parsed_2kdr   1   
        20   "<========== V16 ==========>"                                       132   1   133   36   parsed_2kdr   1   
        21   
;
s26s_2
ssign (resid 16    and name HA   )(resid 19    and name HG   )  3.9  2.1  0.4
ssign (resid 16    and name HA   )(resid 20    and name HN   )  3.9  2.1  0.4

<========== T17 ==========>
;
   145   1   149   36   parsed_2kdr   1   
        22   
;
s26s_3
ssign (resid 17    and name HA   )(resid 19    and name HN   )  3.9  2.1  0.4
;
   155   1   156   79   parsed_2kdr   1   
        23   "<========== Q18 ==========>"                                       161   1   162   36   parsed_2kdr   1   
        24   "<========== L19 ==========>"                                       170   1   171   36   parsed_2kdr   1   
        25   "<========== L20 ==========>"                                       174   1   175   36   parsed_2kdr   1   
        26    s26s_3                                                             181   1   181    8   parsed_2kdr   1   
        27   "<========== R21 ==========>"                                       183   1   184   36   parsed_2kdr   1   
        28   "<========== R22 ==========>"                                       191   1   192   36   parsed_2kdr   1   
        29   "<========== L23 ==========>"                                       202   1   203   36   parsed_2kdr   1   
        30   "<========== H24 ==========>"                                       213   1   214   36   parsed_2kdr   1   
        31   "<========== Q25 ==========>"                                       223   1   224   36   parsed_2kdr   1   
        32   "<========== W26 ==========>"                                       231   1   232   36   parsed_2kdr   1   
        33   "<========== I27 ==========>"                                       236   1   237   36   parsed_2kdr   1   
        34   "<========== S28 ==========>"                                       243   1   244    2   parsed_2kdr   1   
    stop_

save_





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