########################
    #  Coupling constants  #
    ########################

save_J_values_set_1
   _Coupling_constant_list.Sf_category                  coupling_constants
   _Coupling_constant_list.Sf_framecode                 J_values_set_1
   _Coupling_constant_list.Entry_ID                     5985
   _Coupling_constant_list.ID                           1
   _Coupling_constant_list.Sample_condition_list_ID     1
   _Coupling_constant_list.Sample_condition_list_label  $sample_cond_1
   _Coupling_constant_list.Spectrometer_frequency_1H    600
   _Coupling_constant_list.Details                      .
   _Coupling_constant_list.Text_data_format             .
   _Coupling_constant_list.Text_data                    .

   loop_
      _Coupling_constant_experiment.Experiment_ID
      _Coupling_constant_experiment.Experiment_name
      _Coupling_constant_experiment.Sample_ID
      _Coupling_constant_experiment.Sample_label
      _Coupling_constant_experiment.Sample_state
      _Coupling_constant_experiment.Entry_ID
      _Coupling_constant_experiment.Coupling_constant_list_ID

     1   '2D NOESY'   1   $sample_1   .   5985   1    

   stop_

   loop_
      _Coupling_constant.ID
      _Coupling_constant.Code
      _Coupling_constant.Assembly_atom_ID_1
      _Coupling_constant.Entity_assembly_ID_1
      _Coupling_constant.Entity_ID_1
      _Coupling_constant.Comp_index_ID_1
      _Coupling_constant.Seq_ID_1
      _Coupling_constant.Comp_ID_1
      _Coupling_constant.Atom_ID_1
      _Coupling_constant.Atom_type_1
      _Coupling_constant.Atom_isotope_number_1
      _Coupling_constant.Ambiguity_code_1
      _Coupling_constant.Assembly_atom_ID_2
      _Coupling_constant.Entity_assembly_ID_2
      _Coupling_constant.Entity_ID_2
      _Coupling_constant.Comp_index_ID_2
      _Coupling_constant.Seq_ID_2
      _Coupling_constant.Comp_ID_2
      _Coupling_constant.Atom_ID_2
      _Coupling_constant.Atom_type_2
      _Coupling_constant.Atom_isotope_number_2
      _Coupling_constant.Ambiguity_code_2
      _Coupling_constant.Val
      _Coupling_constant.Val_min
      _Coupling_constant.Val_max
      _Coupling_constant.Val_err
      _Coupling_constant.Resonance_ID_1
      _Coupling_constant.Resonance_ID_2
      _Coupling_constant.Auth_entity_assembly_ID_1
      _Coupling_constant.Auth_asym_ID_1
      _Coupling_constant.Auth_seq_ID_1
      _Coupling_constant.Auth_comp_ID_1
      _Coupling_constant.Auth_atom_ID_1
      _Coupling_constant.Auth_entity_assembly_ID_2
      _Coupling_constant.Auth_asym_ID_2
      _Coupling_constant.Auth_seq_ID_2
      _Coupling_constant.Auth_comp_ID_2
      _Coupling_constant.Auth_atom_ID_2
      _Coupling_constant.Details
      _Coupling_constant.Entry_ID
      _Coupling_constant.Coupling_constant_list_ID

     1    3JHNHA   .   1   1   2    2    CYS   H   H   1   .   .   1   1   2    2    CYS   HA   H   1   .   4.94   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    
     2    3JHNHA   .   1   1   3    3    CYS   H   H   1   .   .   1   1   3    3    CYS   HA   H   1   .   4.85   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    
     3    3JHNHA   .   1   1   4    4    SER   H   H   1   .   .   1   1   4    4    SER   HA   H   1   .   7.95   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    
     4    3JHNHA   .   1   1   5    5    HIS   H   H   1   .   .   1   1   5    5    HIS   HA   H   1   .   9.45   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    
     5    3JHNHA   .   1   1   7    7    ALA   H   H   1   .   .   1   1   7    7    ALA   HA   H   1   .   6.40   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    
     6    3JHNHA   .   1   1   8    8    CYS   H   H   1   .   .   1   1   8    8    CYS   HA   H   1   .   7.31   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    
     7    3JHNHA   .   1   1   9    9    ALA   H   H   1   .   .   1   1   9    9    ALA   HA   H   1   .   4.84   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    
     8    3JHNHA   .   1   1   11   11   ASN   H   H   1   .   .   1   1   11   11   ASN   HA   H   1   .   9.65   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    
     9    3JHNHA   .   1   1   12   12   ASN   H   H   1   .   .   1   1   12   12   ASN   HA   H   1   .   8.31   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    
     10   3JHNHA   .   1   1   13   13   GLN   H   H   1   .   .   1   1   13   13   GLN   HA   H   1   .   5.17   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    
     11   3JHNHA   .   1   1   14   14   HIS   H   H   1   .   .   1   1   14   14   HIS   HA   H   1   .   6.44   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    
     12   3JHNHA   .   1   1   15   15   ILE   H   H   1   .   .   1   1   15   15   ILE   HA   H   1   .   8.01   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    
     13   3JHNHA   .   1   1   16   16   CYS   H   H   1   .   .   1   1   16   16   CYS   HA   H   1   .   7.85   .   .   0.01   .   .   .   .   .   .   .   .   .   .   .   .   .   5985   1    

   stop_

save_