Content for NMR-STAR saveframe, "chemical_shift_set_1"

    save_chemical_shift_set_1
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  chemical_shift_set_1
   _Assigned_chem_shift_list.Entry_ID                      6325
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Sample_condition_list_ID      1
   _Assigned_chem_shift_list.Sample_condition_list_label  $sample_cond_1
   _Assigned_chem_shift_list.Chem_shift_reference_ID       1
   _Assigned_chem_shift_list.Chem_shift_reference_label   $chemical_shift_reference
   _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 $sample_1 . 6325 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  1  1 PHE H    H 1 7.143 0.000 . . . . . . . . . . 6325 1 
        2 . 1 1  1  1 PHE HA   H 1 4.137 0.002 . . . . . . . . . . 6325 1 
        3 . 1 1  1  1 PHE HB2  H 1 3.231 0.001 . . . . . . . . . . 6325 1 
        4 . 1 1  1  1 PHE HB3  H 1 2.833 0.001 . . . . . . . . . . 6325 1 
        5 . 1 1  1  1 PHE HD1  H 1 7.334 0.001 . . . . . . . . . . 6325 1 
        6 . 1 1  1  1 PHE HE1  H 1 7.430 0.001 . . . . . . . . . . 6325 1 
        7 . 1 1  2  2 VAL H    H 1 9.053 0.001 . . . . . . . . . . 6325 1 
        8 . 1 1  2  2 VAL HA   H 1 2.272 0.001 . . . . . . . . . . 6325 1 
        9 . 1 1  2  2 VAL HB   H 1 1.658 0.001 . . . . . . . . . . 6325 1 
       10 . 1 1  2  2 VAL HG11 H 1 0.855 0.001 . . . . . . . . . . 6325 1 
       11 . 1 1  2  2 VAL HG12 H 1 0.855 0.001 . . . . . . . . . . 6325 1 
       12 . 1 1  2  2 VAL HG13 H 1 0.855 0.001 . . . . . . . . . . 6325 1 
       13 . 1 1  2  2 VAL HG21 H 1 0.709 0.002 . . . . . . . . . . 6325 1 
       14 . 1 1  2  2 VAL HG22 H 1 0.709 0.002 . . . . . . . . . . 6325 1 
       15 . 1 1  2  2 VAL HG23 H 1 0.709 0.002 . . . . . . . . . . 6325 1 
       16 . 1 1  3  3 SER H    H 1 7.202 0.001 . . . . . . . . . . 6325 1 
       17 . 1 1  3  3 SER HA   H 1 4.226 0.001 . . . . . . . . . . 6325 1 
       18 . 1 1  3  3 SER HB2  H 1 3.848 0.000 . . . . . . . . . . 6325 1 
       19 . 1 1  3  3 SER HB3  H 1 3.793 0.001 . . . . . . . . . . 6325 1 
       20 . 1 1  4  4 THR H    H 1 7.366 0.001 . . . . . . . . . . 6325 1 
       21 . 1 1  4  4 THR HA   H 1 4.525 0.001 . . . . . . . . . . 6325 1 
       22 . 1 1  4  4 THR HB   H 1 4.679 0.000 . . . . . . . . . . 6325 1 
       23 . 1 1  4  4 THR HG21 H 1 1.100 0.000 . . . . . . . . . . 6325 1 
       24 . 1 1  4  4 THR HG22 H 1 1.100 0.000 . . . . . . . . . . 6325 1 
       25 . 1 1  4  4 THR HG23 H 1 1.100 0.000 . . . . . . . . . . 6325 1 
       26 . 1 1  5  5 CYS H    H 1 7.286 0.002 . . . . . . . . . . 6325 1 
       27 . 1 1  5  5 CYS HA   H 1 4.069 0.001 . . . . . . . . . . 6325 1 
       28 . 1 1  5  5 CYS HB2  H 1 2.904 0.002 . . . . . . . . . . 6325 1 
       29 . 1 1  5  5 CYS HB3  H 1 2.675 0.003 . . . . . . . . . . 6325 1 
       30 . 1 1  6  6 TYR H    H 1 7.836 0.005 . . . . . . . . . . 6325 1 
       31 . 1 1  6  6 TYR HA   H 1 4.575 0.003 . . . . . . . . . . 6325 1 
       32 . 1 1  6  6 TYR HB2  H 1 3.276 0.005 . . . . . . . . . . 6325 1 
       33 . 1 1  6  6 TYR HB3  H 1 3.193 0.003 . . . . . . . . . . 6325 1 
       34 . 1 1  6  6 TYR HD1  H 1 7.251 0.001 . . . . . . . . . . 6325 1 
       35 . 1 1  6  6 TYR HE1  H 1 6.854 0.000 . . . . . . . . . . 6325 1 
       36 . 1 1  7  7 LEU H    H 1 8.917 0.001 . . . . . . . . . . 6325 1 
       37 . 1 1  7  7 LEU HA   H 1 4.599 0.000 . . . . . . . . . . 6325 1 
       38 . 1 1  7  7 LEU HB2  H 1 2.099 0.003 . . . . . . . . . . 6325 1 
       39 . 1 1  7  7 LEU HB3  H 1 1.239 0.000 . . . . . . . . . . 6325 1 
       40 . 1 1  7  7 LEU HG   H 1 0.777 0.001 . . . . . . . . . . 6325 1 
       41 . 1 1  7  7 LEU HD11 H 1 0.651 0.001 . . . . . . . . . . 6325 1 
       42 . 1 1  7  7 LEU HD12 H 1 0.651 0.001 . . . . . . . . . . 6325 1 
       43 . 1 1  7  7 LEU HD13 H 1 0.651 0.001 . . . . . . . . . . 6325 1 
       44 . 1 1  7  7 LEU HD21 H 1 0.190 0.001 . . . . . . . . . . 6325 1 
       45 . 1 1  7  7 LEU HD22 H 1 0.190 0.001 . . . . . . . . . . 6325 1 
       46 . 1 1  7  7 LEU HD23 H 1 0.190 0.001 . . . . . . . . . . 6325 1 
       47 . 1 1  8  8 PRO HA   H 1 4.260 0.002 . . . . . . . . . . 6325 1 
       48 . 1 1  8  8 PRO HB2  H 1 2.348 0.001 . . . . . . . . . . 6325 1 
       49 . 1 1  8  8 PRO HB3  H 1 1.932 0.001 . . . . . . . . . . 6325 1 
       50 . 1 1  8  8 PRO HG2  H 1 2.076 0.002 . . . . . . . . . . 6325 1 
       51 . 1 1  8  8 PRO HD2  H 1 4.177 0.001 . . . . . . . . . . 6325 1 
       52 . 1 1  8  8 PRO HD3  H 1 3.899 0.000 . . . . . . . . . . 6325 1 
       53 . 1 1  9  9 LYS H    H 1 8.987 0.002 . . . . . . . . . . 6325 1 
       54 . 1 1  9  9 LYS HA   H 1 4.042 0.001 . . . . . . . . . . 6325 1 
       55 . 1 1  9  9 LYS HB2  H 1 1.865 0.000 . . . . . . . . . . 6325 1 
       56 . 1 1  9  9 LYS HB3  H 1 1.800 0.002 . . . . . . . . . . 6325 1 
       57 . 1 1  9  9 LYS HG2  H 1 1.511 0.001 . . . . . . . . . . 6325 1 
       58 . 1 1  9  9 LYS HG3  H 1 1.393 0.001 . . . . . . . . . . 6325 1 
       59 . 1 1  9  9 LYS HD2  H 1 1.648 0.001 . . . . . . . . . . 6325 1 
       60 . 1 1  9  9 LYS HE2  H 1 2.965 0.001 . . . . . . . . . . 6325 1 
       61 . 1 1 10 10 CYS H    H 1 7.244 0.001 . . . . . . . . . . 6325 1 
       62 . 1 1 10 10 CYS HA   H 1 4.091 0.000 . . . . . . . . . . 6325 1 
       63 . 1 1 10 10 CYS HB2  H 1 3.625 0.001 . . . . . . . . . . 6325 1 
       64 . 1 1 10 10 CYS HB3  H 1 2.873 0.002 . . . . . . . . . . 6325 1 
       65 . 1 1 11 11 ALA HA   H 1 4.235 0.003 . . . . . . . . . . 6325 1 
       66 . 1 1 11 11 ALA HB1  H 1 1.382 0.000 . . . . . . . . . . 6325 1 
       67 . 1 1 11 11 ALA HB2  H 1 1.382 0.000 . . . . . . . . . . 6325 1 
       68 . 1 1 11 11 ALA HB3  H 1 1.382 0.000 . . . . . . . . . . 6325 1 
       69 . 1 1 12 12 ALA H    H 1 8.005 0.000 . . . . . . . . . . 6325 1 
       70 . 1 1 12 12 ALA HA   H 1 4.046 0.000 . . . . . . . . . . 6325 1 
       71 . 1 1 12 12 ALA HB1  H 1 1.394 0.002 . . . . . . . . . . 6325 1 
       72 . 1 1 12 12 ALA HB2  H 1 1.394 0.002 . . . . . . . . . . 6325 1 
       73 . 1 1 12 12 ALA HB3  H 1 1.394 0.002 . . . . . . . . . . 6325 1 
       74 . 1 1 13 13 ALA H    H 1 7.384 0.001 . . . . . . . . . . 6325 1 
       75 . 1 1 13 13 ALA HA   H 1 4.150 0.000 . . . . . . . . . . 6325 1 
       76 . 1 1 13 13 ALA HB1  H 1 1.545 0.001 . . . . . . . . . . 6325 1 
       77 . 1 1 13 13 ALA HB2  H 1 1.545 0.001 . . . . . . . . . . 6325 1 
       78 . 1 1 13 13 ALA HB3  H 1 1.545 0.001 . . . . . . . . . . 6325 1 
       79 . 1 1 14 14 ALA H    H 1 7.854 0.001 . . . . . . . . . . 6325 1 
       80 . 1 1 14 14 ALA HA   H 1 3.709 0.002 . . . . . . . . . . 6325 1 
       81 . 1 1 14 14 ALA HB1  H 1 1.359 0.002 . . . . . . . . . . 6325 1 
       82 . 1 1 14 14 ALA HB2  H 1 1.359 0.002 . . . . . . . . . . 6325 1 
       83 . 1 1 14 14 ALA HB3  H 1 1.359 0.002 . . . . . . . . . . 6325 1 
       84 . 1 1 15 15 ASN H    H 1 8.806 0.002 . . . . . . . . . . 6325 1 
       85 . 1 1 15 15 ASN HA   H 1 4.957 0.001 . . . . . . . . . . 6325 1 
       86 . 1 1 15 15 ASN HB2  H 1 3.036 0.001 . . . . . . . . . . 6325 1 
       87 . 1 1 15 15 ASN HB3  H 1 2.556 0.003 . . . . . . . . . . 6325 1 
       88 . 1 1 15 15 ASN HD21 H 1 7.838 0.003 . . . . . . . . . . 6325 1 
       89 . 1 1 15 15 ASN HD22 H 1 7.072 0.002 . . . . . . . . . . 6325 1 
       90 . 1 1 16 16 VAL H    H 1 8.960 0.002 . . . . . . . . . . 6325 1 
       91 . 1 1 16 16 VAL HA   H 1 3.486 0.002 . . . . . . . . . . 6325 1 
       92 . 1 1 16 16 VAL HB   H 1 2.066 0.002 . . . . . . . . . . 6325 1 
       93 . 1 1 16 16 VAL HG11 H 1 1.134 0.004 . . . . . . . . . . 6325 1 
       94 . 1 1 16 16 VAL HG12 H 1 1.134 0.004 . . . . . . . . . . 6325 1 
       95 . 1 1 16 16 VAL HG13 H 1 1.134 0.004 . . . . . . . . . . 6325 1 
       96 . 1 1 16 16 VAL HG21 H 1 1.063 0.001 . . . . . . . . . . 6325 1 
       97 . 1 1 16 16 VAL HG22 H 1 1.063 0.001 . . . . . . . . . . 6325 1 
       98 . 1 1 16 16 VAL HG23 H 1 1.063 0.001 . . . . . . . . . . 6325 1 
       99 . 1 1 17 17 ALA H    H 1 8.135 0.002 . . . . . . . . . . 6325 1 
      100 . 1 1 17 17 ALA HA   H 1 4.068 0.001 . . . . . . . . . . 6325 1 
      101 . 1 1 17 17 ALA HB1  H 1 1.438 0.002 . . . . . . . . . . 6325 1 
      102 . 1 1 17 17 ALA HB2  H 1 1.438 0.002 . . . . . . . . . . 6325 1 
      103 . 1 1 17 17 ALA HB3  H 1 1.438 0.002 . . . . . . . . . . 6325 1 
      104 . 1 1 18 18 ALA H    H 1 7.594 0.002 . . . . . . . . . . 6325 1 
      105 . 1 1 18 18 ALA HA   H 1 4.194 0.000 . . . . . . . . . . 6325 1 
      106 . 1 1 18 18 ALA HB1  H 1 1.458 0.003 . . . . . . . . . . 6325 1 
      107 . 1 1 18 18 ALA HB2  H 1 1.458 0.003 . . . . . . . . . . 6325 1 
      108 . 1 1 18 18 ALA HB3  H 1 1.458 0.003 . . . . . . . . . . 6325 1 
      109 . 1 1 19 19 HIS H    H 1 7.727 0.002 . . . . . . . . . . 6325 1 
      110 . 1 1 19 19 HIS HA   H 1 3.868 0.002 . . . . . . . . . . 6325 1 
      111 . 1 1 19 19 HIS HB2  H 1 3.064 0.001 . . . . . . . . . . 6325 1 
      112 . 1 1 19 19 HIS HB3  H 1 2.934 0.002 . . . . . . . . . . 6325 1 
      113 . 1 1 19 19 HIS HD2  H 1 6.710 0.002 . . . . . . . . . . 6325 1 
      114 . 1 1 19 19 HIS HE1  H 1 7.736 0.002 . . . . . . . . . . 6325 1 
      115 . 1 1 20 20 ILE H    H 1 8.042 0.001 . . . . . . . . . . 6325 1 
      116 . 1 1 20 20 ILE HA   H 1 3.814 0.001 . . . . . . . . . . 6325 1 
      117 . 1 1 20 20 ILE HB   H 1 1.988 0.000 . . . . . . . . . . 6325 1 
      118 . 1 1 20 20 ILE HG13 H 1 0.969 0.003 . . . . . . . . . . 6325 1 
      119 . 1 1 20 20 ILE HG12 H 1 1.411 0.002 . . . . . . . . . . 6325 1 
      120 . 1 1 20 20 ILE HD11 H 1 0.864 0.002 . . . . . . . . . . 6325 1 
      121 . 1 1 20 20 ILE HD12 H 1 0.864 0.002 . . . . . . . . . . 6325 1 
      122 . 1 1 20 20 ILE HD13 H 1 0.864 0.002 . . . . . . . . . . 6325 1 
      123 . 1 1 21 21 THR H    H 1 6.876 0.001 . . . . . . . . . . 6325 1 
      124 . 1 1 21 21 THR HA   H 1 4.067 0.001 . . . . . . . . . . 6325 1 
      125 . 1 1 21 21 THR HB   H 1 4.269 0.000 . . . . . . . . . . 6325 1 
      126 . 1 1 21 21 THR HG21 H 1 1.321 0.001 . . . . . . . . . . 6325 1 
      127 . 1 1 21 21 THR HG22 H 1 1.321 0.001 . . . . . . . . . . 6325 1 
      128 . 1 1 21 21 THR HG23 H 1 1.321 0.001 . . . . . . . . . . 6325 1 
      129 . 1 1 22 22 HIS H    H 1 7.341 0.001 . . . . . . . . . . 6325 1 
      130 . 1 1 22 22 HIS HA   H 1 4.923 0.002 . . . . . . . . . . 6325 1 
      131 . 1 1 22 22 HIS HB2  H 1 3.584 0.002 . . . . . . . . . . 6325 1 
      132 . 1 1 22 22 HIS HB3  H 1 2.760 0.002 . . . . . . . . . . 6325 1 
      133 . 1 1 22 22 HIS HD2  H 1 6.451 0.001 . . . . . . . . . . 6325 1 
      134 . 1 1 22 22 HIS HE1  H 1 7.889 0.001 . . . . . . . . . . 6325 1 
      135 . 1 1 23 23 CYS H    H 1 6.927 0.001 . . . . . . . . . . 6325 1 
      136 . 1 1 23 23 CYS HA   H 1 4.013 0.001 . . . . . . . . . . 6325 1 
      137 . 1 1 23 23 CYS HB2  H 1 2.188 0.001 . . . . . . . . . . 6325 1 
      138 . 1 1 23 23 CYS HB3  H 1 2.092 0.001 . . . . . . . . . . 6325 1 
      139 . 1 1 24 24 TYR H    H 1 8.123 0.007 . . . . . . . . . . 6325 1 
      140 . 1 1 24 24 TYR HA   H 1 4.712 0.002 . . . . . . . . . . 6325 1 
      141 . 1 1 24 24 TYR HB2  H 1 3.169 0.002 . . . . . . . . . . 6325 1 
      142 . 1 1 24 24 TYR HB3  H 1 2.958 0.003 . . . . . . . . . . 6325 1 
      143 . 1 1 24 24 TYR HD1  H 1 7.139 0.002 . . . . . . . . . . 6325 1 
      144 . 1 1 24 24 TYR HE1  H 1 6.795 0.004 . . . . . . . . . . 6325 1 
      145 . 1 1 25 25 LYS H    H 1 8.137 0.000 . . . . . . . . . . 6325 1 
      146 . 1 1 25 25 LYS HA   H 1 4.091 0.001 . . . . . . . . . . 6325 1 
      147 . 1 1 25 25 LYS HB2  H 1 1.446 0.001 . . . . . . . . . . 6325 1 
      148 . 1 1 25 25 LYS HG2  H 1 1.143 0.000 . . . . . . . . . . 6325 1 
      149 . 1 1 25 25 LYS HD2  H 1 1.535 0.001 . . . . . . . . . . 6325 1 
      150 . 1 1 25 25 LYS HE2  H 1 2.901 0.000 . . . . . . . . . . 6325 1 

   stop_

save_