Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"

    save_assigned_chem_shift_list_1
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  assigned_chem_shift_list_1
   _Assigned_chem_shift_list.Entry_ID                      11580
   _Assigned_chem_shift_list.ID                            1
   _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    $chemical_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 TOCSY'   1   $sample_1   anisotropic   11580   1
      2   '2D 1H-1H NOESY'   1   $sample_1   anisotropic   11580   1
      3   '2D 1H-13C HSQC'   1   $sample_1   anisotropic   11580   1
   stop_

   loop_
      _Atom_chem_shift.ID
      _Atom_chem_shift.Assembly_atom_ID
      _Atom_chem_shift.Entity_assembly_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.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   2    2    TRP   CA     C   13   52.112   .   .   1   .   .   .   A   2    TRP   CA     .   11580   1
      2     .   1   1   2    2    TRP   H      H   1    8.468    .   .   1   .   .   .   A   2    TRP   H      .   11580   1
      3     .   1   1   2    2    TRP   HA     H   1    4.690    .   .   1   .   .   .   A   2    TRP   HA     .   11580   1
      4     .   1   1   2    2    TRP   HD1    H   1    7.323    .   .   1   .   .   .   A   2    TRP   HD1    .   11580   1
      5     .   1   1   2    2    TRP   HE1    H   1    10.503   .   .   1   .   .   .   A   2    TRP   HE1    .   11580   1
      6     .   1   1   2    2    TRP   HE3    H   1    7.547    .   .   1   .   .   .   A   2    TRP   HE3    .   11580   1
      7     .   1   1   2    2    TRP   HB2    H   1    3.239    .   .   2   .   .   .   A   2    TRP   HB2    .   11580   1
      8     .   1   1   2    2    TRP   HB3    H   1    3.239    .   .   2   .   .   .   A   2    TRP   HB3    .   11580   1
      9     .   1   1   3    3    LYS   CA     C   13   50.648   .   .   1   .   .   .   A   3    LYS   CA     .   11580   1
      10    .   1   1   3    3    LYS   H      H   1    8.153    .   .   1   .   .   .   A   3    LYS   H      .   11580   1
      11    .   1   1   3    3    LYS   HA     H   1    4.314    .   .   1   .   .   .   A   3    LYS   HA     .   11580   1
      12    .   1   1   3    3    LYS   HB2    H   1    1.738    .   .   2   .   .   .   A   3    LYS   HB2    .   11580   1
      13    .   1   1   3    3    LYS   HB3    H   1    1.636    .   .   2   .   .   .   A   3    LYS   HB3    .   11580   1
      14    .   1   1   3    3    LYS   HG2    H   1    1.295    .   .   2   .   .   .   A   3    LYS   HG2    .   11580   1
      15    .   1   1   3    3    LYS   HG3    H   1    1.295    .   .   2   .   .   .   A   3    LYS   HG3    .   11580   1
      16    .   1   1   4    4    THR   CA     C   13   63.744   .   .   1   .   .   .   A   4    THR   CA     .   11580   1
      17    .   1   1   4    4    THR   H      H   1    7.971    .   .   1   .   .   .   A   4    THR   H      .   11580   1
      18    .   1   1   4    4    THR   HA     H   1    4.138    .   .   1   .   .   .   A   4    THR   HA     .   11580   1
      19    .   1   1   4    4    THR   HB     H   1    3.666    .   .   1   .   .   .   A   4    THR   HB     .   11580   1
      20    .   1   1   4    4    THR   HG21   H   1    1.257    .   .   1   .   .   .   A   4    THR   HG21   .   11580   1
      21    .   1   1   4    4    THR   HG22   H   1    1.257    .   .   1   .   .   .   A   4    THR   HG22   .   11580   1
      22    .   1   1   4    4    THR   HG23   H   1    1.257    .   .   1   .   .   .   A   4    THR   HG23   .   11580   1
      23    .   1   1   5    5    PRO   HB3    H   1    2.240    .   .   2   .   .   .   A   5    PRO   HB3    .   11580   1
      24    .   1   1   5    5    PRO   HB2    H   1    1.923    .   .   2   .   .   .   A   5    PRO   HB2    .   11580   1
      25    .   1   1   6    6    THR   CA     C   13   64.364   .   .   1   .   .   .   A   6    THR   CA     .   11580   1
      26    .   1   1   6    6    THR   H      H   1    7.920    .   .   1   .   .   .   A   6    THR   H      .   11580   1
      27    .   1   1   6    6    THR   HA     H   1    4.267    .   .   1   .   .   .   A   6    THR   HA     .   11580   1
      28    .   1   1   6    6    THR   HG21   H   1    1.230    .   .   1   .   .   .   A   6    THR   HG21   .   11580   1
      29    .   1   1   6    6    THR   HG22   H   1    1.230    .   .   1   .   .   .   A   6    THR   HG22   .   11580   1
      30    .   1   1   6    6    THR   HG23   H   1    1.230    .   .   1   .   .   .   A   6    THR   HG23   .   11580   1
      31    .   1   1   7    7    LEU   CA     C   13   57.068   .   .   1   .   .   .   A   7    LEU   CA     .   11580   1
      32    .   1   1   7    7    LEU   H      H   1    8.351    .   .   1   .   .   .   A   7    LEU   H      .   11580   1
      33    .   1   1   7    7    LEU   HA     H   1    4.312    .   .   1   .   .   .   A   7    LEU   HA     .   11580   1
      34    .   1   1   7    7    LEU   HG     H   1    1.643    .   .   1   .   .   .   A   7    LEU   HG     .   11580   1
      35    .   1   1   7    7    LEU   HB2    H   1    1.763    .   .   2   .   .   .   A   7    LEU   HB2    .   11580   1
      36    .   1   1   7    7    LEU   HB3    H   1    1.763    .   .   2   .   .   .   A   7    LEU   HB3    .   11580   1
      37    .   1   1   7    7    LEU   HD11   H   1    1.233    .   .   2   .   .   .   A   7    LEU   HD11   .   11580   1
      38    .   1   1   7    7    LEU   HD12   H   1    1.233    .   .   2   .   .   .   A   7    LEU   HD12   .   11580   1
      39    .   1   1   7    7    LEU   HD13   H   1    1.233    .   .   2   .   .   .   A   7    LEU   HD13   .   11580   1
      40    .   1   1   7    7    LEU   HD21   H   1    0.919    .   .   2   .   .   .   A   7    LEU   HD21   .   11580   1
      41    .   1   1   7    7    LEU   HD22   H   1    0.919    .   .   2   .   .   .   A   7    LEU   HD22   .   11580   1
      42    .   1   1   7    7    LEU   HD23   H   1    0.919    .   .   2   .   .   .   A   7    LEU   HD23   .   11580   1
      43    .   1   1   8    8    LYS   CA     C   13   52.648   .   .   1   .   .   .   A   8    LYS   CA     .   11580   1
      44    .   1   1   8    8    LYS   H      H   1    8.071    .   .   1   .   .   .   A   8    LYS   H      .   11580   1
      45    .   1   1   8    8    LYS   HA     H   1    4.075    .   .   1   .   .   .   A   8    LYS   HA     .   11580   1
      46    .   1   1   8    8    LYS   HB2    H   1    1.701    .   .   2   .   .   .   A   8    LYS   HB2    .   11580   1
      47    .   1   1   8    8    LYS   HB3    H   1    1.701    .   .   2   .   .   .   A   8    LYS   HB3    .   11580   1
      48    .   1   1   8    8    LYS   HG2    H   1    1.239    .   .   2   .   .   .   A   8    LYS   HG2    .   11580   1
      49    .   1   1   8    8    LYS   HG3    H   1    1.239    .   .   2   .   .   .   A   8    LYS   HG3    .   11580   1
      50    .   1   1   9    9    TYR   CA     C   13   50.633   .   .   1   .   .   .   A   9    TYR   CA     .   11580   1
      51    .   1   1   9    9    TYR   H      H   1    7.716    .   .   1   .   .   .   A   9    TYR   H      .   11580   1
      52    .   1   1   9    9    TYR   HA     H   1    4.285    .   .   1   .   .   .   A   9    TYR   HA     .   11580   1
      53    .   1   1   9    9    TYR   HB2    H   1    2.787    .   .   2   .   .   .   A   9    TYR   HB2    .   11580   1
      54    .   1   1   9    9    TYR   HB3    H   1    2.787    .   .   2   .   .   .   A   9    TYR   HB3    .   11580   1
      55    .   1   1   9    9    TYR   HD2    H   1    6.780    .   .   1   .   .   .   A   9    TYR   HD2    .   11580   1
      56    .   1   1   9    9    TYR   HD1    H   1    6.780    .   .   1   .   .   .   A   9    TYR   HD1    .   11580   1
      57    .   1   1   9    9    TYR   HE2    H   1    6.718    .   .   1   .   .   .   A   9    TYR   HE2    .   11580   1
      58    .   1   1   9    9    TYR   HE1    H   1    6.718    .   .   1   .   .   .   A   9    TYR   HE1    .   11580   1
      59    .   1   1   10   10   PHE   CA     C   13   53.095   .   .   1   .   .   .   A   10   PHE   CA     .   11580   1
      60    .   1   1   10   10   PHE   H      H   1    7.812    .   .   1   .   .   .   A   10   PHE   H      .   11580   1
      61    .   1   1   10   10   PHE   HA     H   1    4.480    .   .   1   .   .   .   A   10   PHE   HA     .   11580   1
      62    .   1   1   10   10   PHE   HB2    H   1    3.353    .   .   2   .   .   .   A   10   PHE   HB2    .   11580   1
      63    .   1   1   10   10   PHE   HB3    H   1    3.039    .   .   2   .   .   .   A   10   PHE   HB3    .   11580   1
      64    .   1   1   10   10   PHE   HD2    H   1    7.261    .   .   1   .   .   .   A   10   PHE   HD2    .   11580   1
      65    .   1   1   10   10   PHE   HD1    H   1    7.261    .   .   1   .   .   .   A   10   PHE   HD1    .   11580   1
      66    .   1   1   10   10   PHE   HE2    H   1    7.217    .   .   1   .   .   .   A   10   PHE   HE2    .   11580   1
      67    .   1   1   10   10   PHE   HE1    H   1    7.217    .   .   1   .   .   .   A   10   PHE   HE1    .   11580   1
      68    .   1   1   11   11   GLY   CA     C   13   40.972   .   .   1   .   .   .   A   11   GLY   CA     .   11580   1
      69    .   1   1   11   11   GLY   H      H   1    7.923    .   .   1   .   .   .   A   11   GLY   H      .   11580   1
      70    .   1   1   11   11   GLY   HA2    H   1    3.903    .   .   2   .   .   .   A   11   GLY   HA2    .   11580   1
      71    .   1   1   11   11   GLY   HA3    H   1    3.903    .   .   2   .   .   .   A   11   GLY   HA3    .   11580   1
      72    .   1   1   12   12   GLY   CA     C   13   39.805   .   .   1   .   .   .   A   12   GLY   CA     .   11580   1
      73    .   1   1   12   12   GLY   H      H   1    8.083    .   .   1   .   .   .   A   12   GLY   H      .   11580   1
      74    .   1   1   12   12   GLY   HA2    H   1    3.937    .   .   2   .   .   .   A   12   GLY   HA2    .   11580   1
      75    .   1   1   12   12   GLY   HA3    H   1    3.782    .   .   2   .   .   .   A   12   GLY   HA3    .   11580   1
      76    .   1   1   13   13   PHE   CA     C   13   52.307   .   .   1   .   .   .   A   13   PHE   CA     .   11580   1
      77    .   1   1   13   13   PHE   H      H   1    7.653    .   .   1   .   .   .   A   13   PHE   H      .   11580   1
      78    .   1   1   13   13   PHE   HA     H   1    4.423    .   .   1   .   .   .   A   13   PHE   HA     .   11580   1
      79    .   1   1   13   13   PHE   HB2    H   1    2.870    .   .   2   .   .   .   A   13   PHE   HB2    .   11580   1
      80    .   1   1   13   13   PHE   HB3    H   1    2.720    .   .   2   .   .   .   A   13   PHE   HB3    .   11580   1
      81    .   1   1   13   13   PHE   HD1    H   1    7.031    .   .   1   .   .   .   A   13   PHE   HD1    .   11580   1
      82    .   1   1   13   13   PHE   HD2    H   1    7.031    .   .   1   .   .   .   A   13   PHE   HD2    .   11580   1
      83    .   1   1   13   13   PHE   HE1    H   1    7.077    .   .   1   .   .   .   A   13   PHE   HE1    .   11580   1
      84    .   1   1   13   13   PHE   HE2    H   1    7.077    .   .   1   .   .   .   A   13   PHE   HE2    .   11580   1
      85    .   1   1   14   14   ASN   CA     C   13   46.689   .   .   1   .   .   .   A   14   ASN   CA     .   11580   1
      86    .   1   1   14   14   ASN   H      H   1    8.247    .   .   1   .   .   .   A   14   ASN   H      .   11580   1
      87    .   1   1   14   14   ASN   HA     H   1    4.753    .   .   1   .   .   .   A   14   ASN   HA     .   11580   1
      88    .   1   1   14   14   ASN   HB2    H   1    2.879    .   .   2   .   .   .   A   14   ASN   HB2    .   11580   1
      89    .   1   1   14   14   ASN   HB3    H   1    2.686    .   .   2   .   .   .   A   14   ASN   HB3    .   11580   1
      90    .   1   1   14   14   ASN   HD22   H   1    7.563    .   .   2   .   .   .   A   14   ASN   HD22   .   11580   1
      91    .   1   1   14   14   ASN   HD21   H   1    6.859    .   .   2   .   .   .   A   14   ASN   HD21   .   11580   1
      92    .   1   1   15   15   PHE   CA     C   13   54.171   .   .   1   .   .   .   A   15   PHE   CA     .   11580   1
      93    .   1   1   15   15   PHE   H      H   1    8.556    .   .   1   .   .   .   A   15   PHE   H      .   11580   1
      94    .   1   1   15   15   PHE   HA     H   1    4.256    .   .   1   .   .   .   A   15   PHE   HA     .   11580   1
      95    .   1   1   15   15   PHE   HB2    H   1    3.109    .   .   2   .   .   .   A   15   PHE   HB2    .   11580   1
      96    .   1   1   15   15   PHE   HB3    H   1    3.109    .   .   2   .   .   .   A   15   PHE   HB3    .   11580   1
      97    .   1   1   15   15   PHE   HD1    H   1    7.270    .   .   1   .   .   .   A   15   PHE   HD1    .   11580   1
      98    .   1   1   15   15   PHE   HD2    H   1    7.270    .   .   1   .   .   .   A   15   PHE   HD2    .   11580   1
      99    .   1   1   15   15   PHE   HE1    H   1    7.080    .   .   1   .   .   .   A   15   PHE   HE1    .   11580   1
      100   .   1   1   15   15   PHE   HE2    H   1    7.080    .   .   1   .   .   .   A   15   PHE   HE2    .   11580   1
      101   .   1   1   16   16   SER   CA     C   13   56.216   .   .   1   .   .   .   A   16   SER   CA     .   11580   1
      102   .   1   1   16   16   SER   H      H   1    8.527    .   .   1   .   .   .   A   16   SER   H      .   11580   1
      103   .   1   1   16   16   SER   HA     H   1    4.116    .   .   1   .   .   .   A   16   SER   HA     .   11580   1
      104   .   1   1   16   16   SER   HB2    H   1    3.936    .   .   2   .   .   .   A   16   SER   HB2    .   11580   1
      105   .   1   1   16   16   SER   HB3    H   1    3.936    .   .   2   .   .   .   A   16   SER   HB3    .   11580   1
      106   .   1   1   17   17   GLN   CA     C   13   52.022   .   .   1   .   .   .   A   17   GLN   CA     .   11580   1
      107   .   1   1   17   17   GLN   H      H   1    7.769    .   .   1   .   .   .   A   17   GLN   H      .   11580   1
      108   .   1   1   17   17   GLN   HA     H   1    4.170    .   .   1   .   .   .   A   17   GLN   HA     .   11580   1
      109   .   1   1   17   17   GLN   HB2    H   1    2.338    .   .   2   .   .   .   A   17   GLN   HB2    .   11580   1
      110   .   1   1   17   17   GLN   HB3    H   1    2.067    .   .   2   .   .   .   A   17   GLN   HB3    .   11580   1
      111   .   1   1   17   17   GLN   HE22   H   1    7.428    .   .   2   .   .   .   A   17   GLN   HE22   .   11580   1
      112   .   1   1   17   17   GLN   HE21   H   1    6.755    .   .   2   .   .   .   A   17   GLN   HE21   .   11580   1
      113   .   1   1   18   18   ILE   CA     C   13   57.518   .   .   1   .   .   .   A   18   ILE   CA     .   11580   1
      114   .   1   1   18   18   ILE   H      H   1    7.559    .   .   1   .   .   .   A   18   ILE   H      .   11580   1
      115   .   1   1   18   18   ILE   HA     H   1    4.012    .   .   1   .   .   .   A   18   ILE   HA     .   11580   1
      116   .   1   1   18   18   ILE   HB     H   1    1.909    .   .   1   .   .   .   A   18   ILE   HB     .   11580   1
      117   .   1   1   18   18   ILE   HG12   H   1    1.633    .   .   2   .   .   .   A   18   ILE   HG12   .   11580   1
      118   .   1   1   18   18   ILE   HG13   H   1    1.273    .   .   2   .   .   .   A   18   ILE   HG13   .   11580   1
      119   .   1   1   18   18   ILE   HD11   H   1    0.888    .   .   1   .   .   .   A   18   ILE   HD11   .   11580   1
      120   .   1   1   18   18   ILE   HD12   H   1    0.888    .   .   1   .   .   .   A   18   ILE   HD12   .   11580   1
      121   .   1   1   18   18   ILE   HD13   H   1    0.888    .   .   1   .   .   .   A   18   ILE   HD13   .   11580   1
      122   .   1   1   18   18   ILE   HG21   H   1    0.937    .   .   1   .   .   .   A   18   ILE   HG21   .   11580   1
      123   .   1   1   18   18   ILE   HG22   H   1    0.937    .   .   1   .   .   .   A   18   ILE   HG22   .   11580   1
      124   .   1   1   18   18   ILE   HG23   H   1    0.937    .   .   1   .   .   .   A   18   ILE   HG23   .   11580   1
      125   .   1   1   19   19   LEU   CA     C   13   55.413   .   .   1   .   .   .   A   19   LEU   CA     .   11580   1
      126   .   1   1   19   19   LEU   H      H   1    7.557    .   .   1   .   .   .   A   19   LEU   H      .   11580   1
      127   .   1   1   19   19   LEU   HA     H   1    4.248    .   .   1   .   .   .   A   19   LEU   HA     .   11580   1
      128   .   1   1   19   19   LEU   HG     H   1    1.607    .   .   1   .   .   .   A   19   LEU   HG     .   11580   1
      129   .   1   1   19   19   LEU   HB2    H   1    1.700    .   .   2   .   .   .   A   19   LEU   HB2    .   11580   1
      130   .   1   1   19   19   LEU   HB3    H   1    1.700    .   .   2   .   .   .   A   19   LEU   HB3    .   11580   1
      131   .   1   1   19   19   LEU   HD11   H   1    0.873    .   .   2   .   .   .   A   19   LEU   HD11   .   11580   1
      132   .   1   1   19   19   LEU   HD12   H   1    0.873    .   .   2   .   .   .   A   19   LEU   HD12   .   11580   1
      133   .   1   1   19   19   LEU   HD13   H   1    0.873    .   .   2   .   .   .   A   19   LEU   HD13   .   11580   1
      134   .   1   1   19   19   LEU   HD21   H   1    0.873    .   .   2   .   .   .   A   19   LEU   HD21   .   11580   1
      135   .   1   1   19   19   LEU   HD22   H   1    0.873    .   .   2   .   .   .   A   19   LEU   HD22   .   11580   1
      136   .   1   1   19   19   LEU   HD23   H   1    0.873    .   .   2   .   .   .   A   19   LEU   HD23   .   11580   1
   stop_
save_