Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"

    save_assigned_chemical_shifts_1
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  assigned_chemical_shifts_1
   _Assigned_chem_shift_list.Entry_ID                      50855
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Name                          PpcEF6L_chemical_shifts_assigned
   _Assigned_chem_shift_list.Sample_condition_list_ID      1
   _Assigned_chem_shift_list.Sample_condition_list_label   $sample_conditions_1
   _Assigned_chem_shift_list.Chem_shift_reference_ID       1
   _Assigned_chem_shift_list.Chem_shift_reference_label    $chem_shift_reference_1
   _Assigned_chem_shift_list.Chem_shift_1H_err             .
   _Assigned_chem_shift_list.Chem_shift_13C_err            .
   _Assigned_chem_shift_list.Chem_shift_15N_err            .
   _Assigned_chem_shift_list.Chem_shift_31P_err            .
   _Assigned_chem_shift_list.Chem_shift_2H_err             .
   _Assigned_chem_shift_list.Chem_shift_19F_err            .
   _Assigned_chem_shift_list.Error_derivation_method       .
   _Assigned_chem_shift_list.Details                       .
   _Assigned_chem_shift_list.Text_data_format              .
   _Assigned_chem_shift_list.Text_data                     .

   loop_
      _Chem_shift_experiment.Experiment_ID
      _Chem_shift_experiment.Experiment_name
      _Chem_shift_experiment.Sample_ID
      _Chem_shift_experiment.Sample_label
      _Chem_shift_experiment.Sample_state
      _Chem_shift_experiment.Entry_ID
      _Chem_shift_experiment.Assigned_chem_shift_list_ID

      1   '2D 1H-1H NOESY'   .   .   .   50855   1
   stop_

   loop_
      _Chem_shift_software.Software_ID
      _Chem_shift_software.Software_label
      _Chem_shift_software.Method_ID
      _Chem_shift_software.Method_label
      _Chem_shift_software.Entry_ID
      _Chem_shift_software.Assigned_chem_shift_list_ID

      1   $software_1   .   .   50855   1
      2   $software_2   .   .   50855   1
   stop_

   loop_
      _Atom_chem_shift.ID
      _Atom_chem_shift.Assembly_atom_ID
      _Atom_chem_shift.Entity_assembly_ID
      _Atom_chem_shift.Entity_assembly_asym_ID
      _Atom_chem_shift.Entity_ID
      _Atom_chem_shift.Comp_index_ID
      _Atom_chem_shift.Seq_ID
      _Atom_chem_shift.Comp_ID
      _Atom_chem_shift.Atom_ID
      _Atom_chem_shift.Atom_type
      _Atom_chem_shift.Atom_isotope_number
      _Atom_chem_shift.Val
      _Atom_chem_shift.Val_err
      _Atom_chem_shift.Assign_fig_of_merit
      _Atom_chem_shift.Ambiguity_code
      _Atom_chem_shift.Ambiguity_set_ID
      _Atom_chem_shift.Occupancy
      _Atom_chem_shift.Resonance_ID
      _Atom_chem_shift.Auth_entity_assembly_ID
      _Atom_chem_shift.Auth_asym_ID
      _Atom_chem_shift.Auth_seq_ID
      _Atom_chem_shift.Auth_comp_ID
      _Atom_chem_shift.Auth_atom_ID
      _Atom_chem_shift.Details
      _Atom_chem_shift.Entry_ID
      _Atom_chem_shift.Assigned_chem_shift_list_ID

      1    .   2   .   2   1   1   HEM   HAB   H   1   6.171    0.001   .   .   .   .   .   .   .   30   CYS   HAB   .   50855   1
      2    .   2   .   2   1   1   HEM   HAC   H   1   6.351    0.000   .   .   .   .   .   .   .   30   CYS   HAC   .   50855   1
      3    .   2   .   2   1   1   HEM   HBB   H   1   2.279    0.000   .   .   .   .   .   .   .   30   CYS   HBB   .   50855   1
      4    .   2   .   2   1   1   HEM   HBC   H   1   2.037    0.001   .   .   .   .   .   .   .   30   CYS   HBC   .   50855   1
      5    .   2   .   2   1   1   HEM   HHA   H   1   9.274    0.000   .   .   .   .   .   .   .   30   CYS   HHA   .   50855   1
      6    .   2   .   2   1   1   HEM   HHB   H   1   9.426    0.001   .   .   .   .   .   .   .   30   CYS   HHB   .   50855   1
      7    .   2   .   2   1   1   HEM   HHC   H   1   9.437    0.002   .   .   .   .   .   .   .   30   CYS   HHC   .   50855   1
      8    .   2   .   2   1   1   HEM   HHD   H   1   9.236    0.003   .   .   .   .   .   .   .   30   CYS   HHD   .   50855   1
      9    .   2   .   2   1   1   HEM   HMA   H   1   3.297    0.001   .   .   .   .   .   .   .   30   CYS   HMA   .   50855   1
      10   .   2   .   2   1   1   HEM   HMB   H   1   3.610    0.001   .   .   .   .   .   .   .   30   CYS   HMB   .   50855   1
      11   .   2   .   2   1   1   HEM   HMC   H   1   3.454    0.001   .   .   .   .   .   .   .   30   CYS   HMC   .   50855   1
      12   .   2   .   2   1   1   HEM   HMD   H   1   3.066    0.002   .   .   .   .   .   .   .   30   CYS   HMD   .   50855   1
      13   .   3   .   2   1   1   HEM   HAB   H   1   6.684    0.001   .   .   .   .   .   .   .   53   HIS   HAB   .   50855   1
      14   .   3   .   2   1   1   HEM   HAC   H   1   6.441    0.001   .   .   .   .   .   .   .   53   HIS   HAC   .   50855   1
      15   .   3   .   2   1   1   HEM   HBB   H   1   2.399    0.000   .   .   .   .   .   .   .   53   HIS   HBB   .   50855   1
      16   .   3   .   2   1   1   HEM   HBC   H   1   3.032    0.003   .   .   .   .   .   .   .   53   HIS   HBC   .   50855   1
      17   .   3   .   2   1   1   HEM   HHA   H   1   9.528    0.000   .   .   .   .   .   .   .   53   HIS   HHA   .   50855   1
      18   .   3   .   2   1   1   HEM   HHB   H   1   10.194   0.002   .   .   .   .   .   .   .   53   HIS   HHB   .   50855   1
      19   .   3   .   2   1   1   HEM   HHC   H   1   9.834    0.002   .   .   .   .   .   .   .   53   HIS   HHC   .   50855   1
      20   .   3   .   2   1   1   HEM   HHD   H   1   9.727    0.002   .   .   .   .   .   .   .   53   HIS   HHD   .   50855   1
      21   .   3   .   2   1   1   HEM   HMA   H   1   4.003    0.001   .   .   .   .   .   .   .   53   HIS   HMA   .   50855   1
      22   .   3   .   2   1   1   HEM   HMB   H   1   4.280    0.002   .   .   .   .   .   .   .   53   HIS   HMB   .   50855   1
      23   .   3   .   2   1   1   HEM   HMC   H   1   4.053    0.001   .   .   .   .   .   .   .   53   HIS   HMC   .   50855   1
      24   .   3   .   2   1   1   HEM   HMD   H   1   3.165    0.000   .   .   .   .   .   .   .   53   HIS   HMD   .   50855   1
      25   .   4   .   2   1   1   HEM   HAB   H   1   5.869    0.000   .   .   .   .   .   .   .   67   HIS   HAB   .   50855   1
      26   .   4   .   2   1   1   HEM   HAC   H   1   6.211    0.000   .   .   .   .   .   .   .   67   HIS   HAC   .   50855   1
      27   .   4   .   2   1   1   HEM   HBB   H   1   2.149    0.002   .   .   .   .   .   .   .   67   HIS   HBB   .   50855   1
      28   .   4   .   2   1   1   HEM   HBC   H   1   1.340    0.001   .   .   .   .   .   .   .   67   HIS   HBC   .   50855   1
      29   .   4   .   2   1   1   HEM   HHA   H   1   9.697    0.000   .   .   .   .   .   .   .   67   HIS   HHA   .   50855   1
      30   .   4   .   2   1   1   HEM   HHB   H   1   9.561    0.003   .   .   .   .   .   .   .   67   HIS   HHB   .   50855   1
      31   .   4   .   2   1   1   HEM   HHC   H   1   8.985    0.001   .   .   .   .   .   .   .   67   HIS   HHC   .   50855   1
      32   .   4   .   2   1   1   HEM   HHD   H   1   9.306    0.002   .   .   .   .   .   .   .   67   HIS   HHD   .   50855   1
      33   .   4   .   2   1   1   HEM   HMA   H   1   3.464    0.001   .   .   .   .   .   .   .   67   HIS   HMA   .   50855   1
      34   .   4   .   2   1   1   HEM   HMB   H   1   3.712    0.001   .   .   .   .   .   .   .   67   HIS   HMB   .   50855   1
      35   .   4   .   2   1   1   HEM   HMC   H   1   2.985    0.001   .   .   .   .   .   .   .   67   HIS   HMC   .   50855   1
      36   .   4   .   2   1   1   HEM   HMD   H   1   3.880    0.002   .   .   .   .   .   .   .   67   HIS   HMD   .   50855   1
   stop_
save_