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                      50644
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Name                          cyclorasin-9A12-DMSO-298K
   _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'   .   .   .   50644   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   .   .   50644   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    .   1   .   1   1    1    TRP   H      H   1   8.4405    0.001   .   1   .   .   .   .   .   1    TRP   H      .   50644   1
      2    .   1   .   1   1    1    TRP   HA     H   1   4.7785    0.001   .   1   .   .   .   .   .   1    TRP   HA     .   50644   1
      3    .   1   .   1   1    1    TRP   HB2    H   1   3.0295    0.001   .   1   .   .   .   .   .   1    TRP   HB2    .   50644   1
      4    .   1   .   1   1    1    TRP   HB3    H   1   3.2375    0.002   .   1   .   .   .   .   .   1    TRP   HB3    .   50644   1
      5    .   1   .   1   1    1    TRP   HD1    H   1   7.1745    0.002   .   1   .   .   .   .   .   1    TRP   HD1    .   50644   1
      6    .   1   .   1   1    1    TRP   HE1    H   1   10.7695   0.000   .   1   .   .   .   .   .   1    TRP   HE1    .   50644   1
      7    .   1   .   1   1    1    TRP   HE3    H   1   7.5315    0.004   .   1   .   .   .   .   .   1    TRP   HE3    .   50644   1
      8    .   1   .   1   1    1    TRP   HZ2    H   1   7.3125    0.004   .   1   .   .   .   .   .   1    TRP   HZ2    .   50644   1
      9    .   1   .   1   1    1    TRP   HZ3    H   1   6.9695    0.002   .   1   .   .   .   .   .   1    TRP   HZ3    .   50644   1
      10   .   1   .   1   1    1    TRP   HH2    H   1   7.0445    0.005   .   1   .   .   .   .   .   1    TRP   HH2    .   50644   1
      11   .   1   .   1   2    2    THR   H      H   1   7.8165    0.004   .   1   .   .   .   .   .   2    THR   H      .   50644   1
      12   .   1   .   1   2    2    THR   HA     H   1   4.2015    0.005   .   1   .   .   .   .   .   2    THR   HA     .   50644   1
      13   .   1   .   1   2    2    THR   HB     H   1   3.9865    0.002   .   1   .   .   .   .   .   2    THR   HB     .   50644   1
      14   .   1   .   1   2    2    THR   HG1    H   1   5.2375    0.002   .   1   .   .   .   .   .   2    THR   HG1    .   50644   1
      15   .   1   .   1   2    2    THR   HG21   H   1   0.9955    0.003   .   1   .   .   .   .   .   2    THR   MG     .   50644   1
      16   .   1   .   1   2    2    THR   HG22   H   1   0.9955    0.003   .   1   .   .   .   .   .   2    THR   MG     .   50644   1
      17   .   1   .   1   2    2    THR   HG23   H   1   0.9955    0.003   .   1   .   .   .   .   .   2    THR   MG     .   50644   1
      18   .   1   .   1   3    3    DAL   H      H   1   8.2115    0.005   .   1   .   .   .   .   .   3    DAL   H      .   50644   1
      19   .   1   .   1   3    3    DAL   HA     H   1   4.2415    0.003   .   1   .   .   .   .   .   3    DAL   HA     .   50644   1
      20   .   1   .   1   3    3    DAL   MB     M   1   1.2395    0.002   .   1   .   .   .   .   .   3    DAL   MB     .   50644   1
      21   .   1   .   1   4    4    DAR   H      H   1   7.7805    0.008   .   1   .   .   .   .   .   4    DAR   H      .   50644   1
      22   .   1   .   1   4    4    DAR   HA     H   1   4.1495    0.003   .   1   .   .   .   .   .   4    DAR   HA     .   50644   1
      23   .   1   .   1   4    4    DAR   HB2    H   1   1.5595    0.001   .   1   .   .   .   .   .   4    DAR   HB2    .   50644   1
      24   .   1   .   1   4    4    DAR   HB3    H   1   1.7235    0.001   .   1   .   .   .   .   .   4    DAR   HB3    .   50644   1
      25   .   1   .   1   4    4    DAR   HG2    H   1   1.4595    0.003   .   2   .   .   .   .   .   4    DAR   HG2    .   50644   1
      26   .   1   .   1   4    4    DAR   HG3    H   1   1.5405    0.001   .   2   .   .   .   .   .   4    DAR   HG3    .   50644   1
      27   .   1   .   1   4    4    DAR   HD2    H   1   3.0675    0.001   .   2   .   .   .   .   .   4    DAR   HD2    .   50644   1
      28   .   1   .   1   4    4    DAR   HD3    H   1   3.0675    0.001   .   2   .   .   .   .   .   4    DAR   HD3    .   50644   1
      29   .   1   .   1   4    4    DAR   HE     H   1   7.5505    0.001   .   1   .   .   .   .   .   4    DAR   HE     .   50644   1
      30   .   1   .   1   5    5    ARG   H      H   1   7.7975    0.001   .   1   .   .   .   .   .   5    ARG   H      .   50644   1
      31   .   1   .   1   5    5    ARG   HA     H   1   4.2495    0.002   .   1   .   .   .   .   .   5    ARG   HA     .   50644   1
      32   .   1   .   1   5    5    ARG   HB2    H   1   1.5135    0.004   .   1   .   .   .   .   .   5    ARG   HB2    .   50644   1
      33   .   1   .   1   5    5    ARG   HB3    H   1   1.7445    0.002   .   1   .   .   .   .   .   5    ARG   HB3    .   50644   1
      34   .   1   .   1   5    5    ARG   HG2    H   1   1.4635    0.001   .   2   .   .   .   .   .   5    ARG   HG2    .   50644   1
      35   .   1   .   1   5    5    ARG   HG3    H   1   1.4635    0.001   .   2   .   .   .   .   .   5    ARG   HG3    .   50644   1
      36   .   1   .   1   5    5    ARG   HD2    H   1   3.0915    0.001   .   2   .   .   .   .   .   5    ARG   HD2    .   50644   1
      37   .   1   .   1   5    5    ARG   HD3    H   1   3.0915    0.001   .   2   .   .   .   .   .   5    ARG   HD3    .   50644   1
      38   .   1   .   1   5    5    ARG   HE     H   1   7.5175    0.001   .   1   .   .   .   .   .   5    ARG   HE     .   50644   1
      39   .   1   .   1   6    6    ARG   H      H   1   8.0025    0.003   .   1   .   .   .   .   .   6    ARG   H      .   50644   1
      40   .   1   .   1   6    6    ARG   HA     H   1   4.3345    0.001   .   1   .   .   .   .   .   6    ARG   HA     .   50644   1
      41   .   1   .   1   6    6    ARG   HB2    H   1   1.4245    0.005   .   1   .   .   .   .   .   6    ARG   HB2    .   50644   1
      42   .   1   .   1   6    6    ARG   HB3    H   1   1.5665    0.003   .   1   .   .   .   .   .   6    ARG   HB3    .   50644   1
      43   .   1   .   1   6    6    ARG   HG2    H   1   1.2925    0.003   .   2   .   .   .   .   .   6    ARG   HG2    .   50644   1
      44   .   1   .   1   6    6    ARG   HG3    H   1   1.3585    0.003   .   2   .   .   .   .   .   6    ARG   HG3    .   50644   1
      45   .   1   .   1   6    6    ARG   HD2    H   1   2.9155    0.002   .   2   .   .   .   .   .   6    ARG   HD2    .   50644   1
      46   .   1   .   1   6    6    ARG   HD3    H   1   2.9155    0.002   .   2   .   .   .   .   .   6    ARG   HD3    .   50644   1
      47   .   1   .   1   6    6    ARG   HE     H   1   7.4395    0.001   .   1   .   .   .   .   .   6    ARG   HE     .   50644   1
      48   .   1   .   1   7    7    4J2   H      H   1   7.9155    0.003   .   1   .   .   .   .   .   7    4J2   H      .   50644   1
      49   .   1   .   1   7    7    4J2   HA     H   1   4.7185    0.001   .   1   .   .   .   .   .   7    4J2   HA     .   50644   1
      50   .   1   .   1   7    7    4J2   HB1    H   1   3.1685    0.002   .   1   .   .   .   .   .   7    4J2   HB1    .   50644   1
      51   .   1   .   1   7    7    4J2   HB2    H   1   3.0085    0.003   .   1   .   .   .   .   .   7    4J2   HB2    .   50644   1
      52   .   1   .   1   7    7    4J2   HD1    H   1   7.3185    0.002   .   1   .   .   .   .   .   7    4J2   HD1    .   50644   1
      53   .   1   .   1   7    7    4J2   HD2    H   1   7.6075    0.000   .   1   .   .   .   .   .   7    4J2   HD2    .   50644   1
      54   .   1   .   1   7    7    4J2   HE1    H   1   7.7745    0.001   .   1   .   .   .   .   .   7    4J2   HE1    .   50644   1
      55   .   1   .   1   7    7    4J2   HE3    H   1   7.8075    0.000   .   1   .   .   .   .   .   7    4J2   HE3    .   50644   1
      56   .   1   .   1   7    7    4J2   HE4    H   1   7.4665    0.000   .   1   .   .   .   .   .   7    4J2   HE4    .   50644   1
      57   .   1   .   1   8    8    ARG   H      H   1   8.3795    0.003   .   1   .   .   .   .   .   8    ARG   H      .   50644   1
      58   .   1   .   1   8    8    ARG   HA     H   1   4.2015    0.003   .   1   .   .   .   .   .   8    ARG   HA     .   50644   1
      59   .   1   .   1   8    8    ARG   HB2    H   1   1.3485    0.005   .   1   .   .   .   .   .   8    ARG   HB2    .   50644   1
      60   .   1   .   1   8    8    ARG   HB3    H   1   1.4985    0.003   .   1   .   .   .   .   .   8    ARG   HB3    .   50644   1
      61   .   1   .   1   8    8    ARG   HG2    H   1   1.2495    0.001   .   2   .   .   .   .   .   8    ARG   HG2    .   50644   1
      62   .   1   .   1   8    8    ARG   HG3    H   1   1.2685    0.006   .   2   .   .   .   .   .   8    ARG   HG3    .   50644   1
      63   .   1   .   1   8    8    ARG   HD2    H   1   2.9195    0.005   .   2   .   .   .   .   .   8    ARG   HD2    .   50644   1
      64   .   1   .   1   8    8    ARG   HD3    H   1   2.9195    0.005   .   2   .   .   .   .   .   8    ARG   HD3    .   50644   1
      65   .   1   .   1   8    8    ARG   HE     H   1   7.3785    0.000   .   1   .   .   .   .   .   8    ARG   HE     .   50644   1
      66   .   1   .   1   9    9    PHE   H      H   1   8.3015    0.003   .   1   .   .   .   .   .   9    PHE   H      .   50644   1
      67   .   1   .   1   9    9    PHE   HA     H   1   4.4685    0.002   .   1   .   .   .   .   .   9    PHE   HA     .   50644   1
      68   .   1   .   1   9    9    PHE   HB2    H   1   2.7985    0.002   .   1   .   .   .   .   .   9    PHE   HB2    .   50644   1
      69   .   1   .   1   9    9    PHE   HB3    H   1   2.9965    0.002   .   1   .   .   .   .   .   9    PHE   HB3    .   50644   1
      70   .   1   .   1   9    9    PHE   HD1    H   1   7.1795    0.002   .   3   .   .   .   .   .   9    PHE   HD1    .   50644   1
      71   .   1   .   1   9    9    PHE   HD2    H   1   7.1795    0.002   .   3   .   .   .   .   .   9    PHE   HD2    .   50644   1
      72   .   1   .   1   9    9    PHE   HE1    H   1   7.2205    0.005   .   3   .   .   .   .   .   9    PHE   HE1    .   50644   1
      73   .   1   .   1   9    9    PHE   HE2    H   1   7.2205    0.005   .   3   .   .   .   .   .   9    PHE   HE2    .   50644   1
      74   .   1   .   1   10   10   DNE   H      H   1   8.1475    0.004   .   1   .   .   .   .   .   10   DNE   H      .   50644   1
      75   .   1   .   1   10   10   DNE   HA     H   1   4.0785    0.003   .   1   .   .   .   .   .   10   DNE   HA     .   50644   1
      76   .   1   .   1   10   10   DNE   HB2    H   1   1.3905    0.007   .   1   .   .   .   .   .   10   DNE   HB2    .   50644   1
      77   .   1   .   1   10   10   DNE   HB3    H   1   1.3905    0.007   .   1   .   .   .   .   .   10   DNE   HB3    .   50644   1
      78   .   1   .   1   10   10   DNE   HG2    H   1   0.9705    0.005   .   1   .   .   .   .   .   10   DNE   HG2    .   50644   1
      79   .   1   .   1   10   10   DNE   HG3    H   1   1.5515    0.003   .   1   .   .   .   .   .   10   DNE   HG3    .   50644   1
      80   .   1   .   1   10   10   DNE   HD2    H   1   1.1415    0.003   .   1   .   .   .   .   .   10   DNE   HD2    .   50644   1
      81   .   1   .   1   10   10   DNE   HD3    H   1   1.1415    0.003   .   1   .   .   .   .   .   10   DNE   HD3    .   50644   1
      82   .   1   .   1   10   10   DNE   HE1    H   1   0.7785    0.005   .   1   .   .   .   .   .   10   DNE   HE1    .   50644   1
      83   .   1   .   1   10   10   DNE   HE2    H   1   0.7785    0.005   .   1   .   .   .   .   .   10   DNE   HE2    .   50644   1
      84   .   1   .   1   10   10   DNE   HE3    H   1   0.7785    0.005   .   1   .   .   .   .   .   10   DNE   HE3    .   50644   1
      85   .   1   .   1   11   11   GLN   H      H   1   8.1675    0.007   .   1   .   .   .   .   .   11   GLN   H      .   50644   1
      86   .   1   .   1   11   11   GLN   HA     H   1   4.3615    0.003   .   1   .   .   .   .   .   11   GLN   HA     .   50644   1
      87   .   1   .   1   11   11   GLN   HB2    H   1   1.7395    0.003   .   2   .   .   .   .   .   11   GLN   HB2    .   50644   1
      88   .   1   .   1   11   11   GLN   HB3    H   1   1.7395    0.003   .   2   .   .   .   .   .   11   GLN   HB3    .   50644   1
      89   .   1   .   1   11   11   GLN   HG2    H   1   1.9145    0.002   .   2   .   .   .   .   .   11   GLN   HG2    .   50644   1
      90   .   1   .   1   11   11   GLN   HG3    H   1   2.0805    0.002   .   2   .   .   .   .   .   11   GLN   HG3    .   50644   1
      91   .   1   .   1   11   11   GLN   HE21   H   1   7.4285    0.000   .   2   .   .   .   .   .   11   GLN   HE21   .   50644   1
      92   .   1   .   1   11   11   GLN   HE22   H   1   6.9095    0.000   .   2   .   .   .   .   .   11   GLN   HE22   .   50644   1
   stop_
save_