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                      18723
   _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' . . . 18723 1 
      3 '2D 1H-13C HSQC' . . . 18723 1 
      6 '2D 1H-15N HSQC' . . . 18723 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 GLY HA2  H  1   3.593 0.010 . 1 . . . A  1 GLY HA2  . 18723 1 
        2 . 1 1  1  1 GLY HA3  H  1   4.127 0.010 . 1 . . . A  1 GLY HA3  . 18723 1 
        3 . 1 1  1  1 GLY H    H  1   8.599 0.010 . 1 . . . A  1 GLY H1   . 18723 1 
        4 . 1 1  1  1 GLY CA   C 13  45.328 0.010 . 1 . . . A  1 GLY CA   . 18723 1 
        5 . 1 1  1  1 GLY N    N 15 104.863 0.010 . 1 . . . A  1 GLY N    . 18723 1 
        6 . 1 1  2  2 PHE H    H  1   7.953 0.010 . 1 . . . A  2 PHE H    . 18723 1 
        7 . 1 1  2  2 PHE HA   H  1   4.898 0.010 . 1 . . . A  2 PHE HA   . 18723 1 
        8 . 1 1  2  2 PHE HB2  H  1   3.078 0.010 . 1 . . . A  2 PHE HB2  . 18723 1 
        9 . 1 1  2  2 PHE HB3  H  1   3.184 0.010 . 1 . . . A  2 PHE HB3  . 18723 1 
       10 . 1 1  2  2 PHE CA   C 13  56.864 0.010 . 1 . . . A  2 PHE CA   . 18723 1 
       11 . 1 1  2  2 PHE CB   C 13  40.850 0.010 . 1 . . . A  2 PHE CB   . 18723 1 
       12 . 1 1  2  2 PHE N    N 15 121.029 0.010 . 1 . . . A  2 PHE N    . 18723 1 
       13 . 1 1  3  3 CYS H    H  1   8.741 0.010 . 1 . . . A  3 CYS H    . 18723 1 
       14 . 1 1  3  3 CYS HA   H  1   5.374 0.010 . 1 . . . A  3 CYS HA   . 18723 1 
       15 . 1 1  3  3 CYS HB2  H  1   2.590 0.010 . 1 . . . A  3 CYS HB2  . 18723 1 
       16 . 1 1  3  3 CYS HB3  H  1   2.951 0.010 . 1 . . . A  3 CYS HB3  . 18723 1 
       17 . 1 1  3  3 CYS CA   C 13  55.415 0.010 . 1 . . . A  3 CYS CA   . 18723 1 
       18 . 1 1  3  3 CYS CB   C 13  47.259 0.010 . 1 . . . A  3 CYS CB   . 18723 1 
       19 . 1 1  3  3 CYS N    N 15 125.277 0.010 . 1 . . . A  3 CYS N    . 18723 1 
       20 . 1 1  4  4 ARG H    H  1   8.626 0.010 . 1 . . . A  4 ARG H    . 18723 1 
       21 . 1 1  4  4 ARG HA   H  1   4.606 0.010 . 1 . . . A  4 ARG HA   . 18723 1 
       22 . 1 1  4  4 ARG HB2  H  1   1.824 0.010 . 1 . . . A  4 ARG HB2  . 18723 1 
       23 . 1 1  4  4 ARG HB3  H  1   1.877 0.010 . 1 . . . A  4 ARG HB3  . 18723 1 
       24 . 1 1  4  4 ARG HD2  H  1   3.208 0.010 . 1 . . . A  4 ARG HD2  . 18723 1 
       25 . 1 1  4  4 ARG HD3  H  1   3.273 0.010 . 1 . . . A  4 ARG HD3  . 18723 1 
       26 . 1 1  4  4 ARG CA   C 13  55.042 0.010 . 1 . . . A  4 ARG CA   . 18723 1 
       27 . 1 1  4  4 ARG CB   C 13  32.493 0.010 . 1 . . . A  4 ARG CB   . 18723 1 
       28 . 1 1  4  4 ARG CD   C 13  43.357 0.010 . 1 . . . A  4 ARG CD   . 18723 1 
       29 . 1 1  4  4 ARG N    N 15 122.866 0.010 . 1 . . . A  4 ARG N    . 18723 1 
       30 . 1 1  5  5 CYS H    H  1   9.070 0.010 . 1 . . . A  5 CYS H    . 18723 1 
       31 . 1 1  5  5 CYS HA   H  1   5.489 0.010 . 1 . . . A  5 CYS HA   . 18723 1 
       32 . 1 1  5  5 CYS HB2  H  1   2.635 0.010 . 1 . . . A  5 CYS HB2  . 18723 1 
       33 . 1 1  5  5 CYS HB3  H  1   3.065 0.010 . 1 . . . A  5 CYS HB3  . 18723 1 
       34 . 1 1  5  5 CYS CA   C 13  55.359 0.010 . 1 . . . A  5 CYS CA   . 18723 1 
       35 . 1 1  5  5 CYS CB   C 13  48.035 0.010 . 1 . . . A  5 CYS CB   . 18723 1 
       36 . 1 1  6  6 LEU H    H  1   8.696 0.010 . 1 . . . A  6 LEU H    . 18723 1 
       37 . 1 1  6  6 LEU HA   H  1   4.718 0.010 . 1 . . . A  6 LEU HA   . 18723 1 
       38 . 1 1  6  6 LEU HB2  H  1   1.814 0.010 . 1 . . . A  6 LEU HB2  . 18723 1 
       39 . 1 1  6  6 LEU HB3  H  1   1.735 0.010 . 1 . . . A  6 LEU HB3  . 18723 1 
       40 . 1 1  6  6 LEU HG   H  1   1.553 0.010 . 1 . . . A  6 LEU HG   . 18723 1 
       41 . 1 1  6  6 LEU HD11 H  1   0.930 0.010 . 1 . . . A  6 LEU HD11 . 18723 1 
       42 . 1 1  6  6 LEU HD12 H  1   0.930 0.010 . 1 . . . A  6 LEU HD12 . 18723 1 
       43 . 1 1  6  6 LEU HD13 H  1   0.930 0.010 . 1 . . . A  6 LEU HD13 . 18723 1 
       44 . 1 1  6  6 LEU HD21 H  1   0.930 0.010 . 1 . . . A  6 LEU HD21 . 18723 1 
       45 . 1 1  6  6 LEU HD22 H  1   0.930 0.010 . 1 . . . A  6 LEU HD22 . 18723 1 
       46 . 1 1  6  6 LEU HD23 H  1   0.930 0.010 . 1 . . . A  6 LEU HD23 . 18723 1 
       47 . 1 1  6  6 LEU CA   C 13  54.396 0.010 . 1 . . . A  6 LEU CA   . 18723 1 
       48 . 1 1  6  6 LEU CB   C 13  44.460 0.010 . 1 . . . A  6 LEU CB   . 18723 1 
       49 . 1 1  6  6 LEU N    N 15 123.254 0.010 . 1 . . . A  6 LEU N    . 18723 1 
       50 . 1 1  7  7 CYS H    H  1   9.111 0.010 . 1 . . . A  7 CYS H    . 18723 1 
       51 . 1 1  7  7 CYS HA   H  1   5.571 0.010 . 1 . . . A  7 CYS HA   . 18723 1 
       52 . 1 1  7  7 CYS HB2  H  1   2.895 0.010 . 1 . . . A  7 CYS HB2  . 18723 1 
       53 . 1 1  7  7 CYS HB3  H  1   2.870 0.010 . 1 . . . A  7 CYS HB3  . 18723 1 
       54 . 1 1  7  7 CYS CA   C 13  55.437 0.010 . 1 . . . A  7 CYS CA   . 18723 1 
       55 . 1 1  7  7 CYS CB   C 13  48.035 0.010 . 1 . . . A  7 CYS CB   . 18723 1 
       56 . 1 1  8  8 ARG H    H  1   8.686 0.010 . 1 . . . A  8 ARG H    . 18723 1 
       57 . 1 1  8  8 ARG HA   H  1   4.522 0.010 . 1 . . . A  8 ARG HA   . 18723 1 
       58 . 1 1  8  8 ARG HB2  H  1   1.814 0.010 . 1 . . . A  8 ARG HB2  . 18723 1 
       59 . 1 1  8  8 ARG HB3  H  1   1.865 0.010 . 1 . . . A  8 ARG HB3  . 18723 1 
       60 . 1 1  8  8 ARG HD2  H  1   3.232 0.010 . 1 . . . A  8 ARG HD2  . 18723 1 
       61 . 1 1  8  8 ARG HD3  H  1   3.228 0.010 . 1 . . . A  8 ARG HD3  . 18723 1 
       62 . 1 1  8  8 ARG CA   C 13  55.655 0.010 . 1 . . . A  8 ARG CA   . 18723 1 
       63 . 1 1  8  8 ARG CB   C 13  32.469 0.010 . 1 . . . A  8 ARG CB   . 18723 1 
       64 . 1 1  8  8 ARG CD   C 13  43.321 0.010 . 1 . . . A  8 ARG CD   . 18723 1 
       65 . 1 1  8  8 ARG N    N 15 123.295 0.010 . 1 . . . A  8 ARG N    . 18723 1 
       66 . 1 1  9  9 ARG H    H  1   9.570 0.010 . 1 . . . A  9 ARG H    . 18723 1 
       67 . 1 1  9  9 ARG HA   H  1   3.925 0.010 . 1 . . . A  9 ARG HA   . 18723 1 
       68 . 1 1  9  9 ARG HB2  H  1   1.848 0.010 . 1 . . . A  9 ARG HB2  . 18723 1 
       69 . 1 1  9  9 ARG HB3  H  1   2.098 0.010 . 1 . . . A  9 ARG HB3  . 18723 1 
       70 . 1 1  9  9 ARG HD2  H  1   3.239 0.010 . 1 . . . A  9 ARG HD2  . 18723 1 
       71 . 1 1  9  9 ARG HD3  H  1   3.237 0.010 . 1 . . . A  9 ARG HD3  . 18723 1 
       72 . 1 1  9  9 ARG CA   C 13  57.049 0.010 . 1 . . . A  9 ARG CA   . 18723 1 
       73 . 1 1  9  9 ARG CB   C 13  28.131 0.010 . 1 . . . A  9 ARG CB   . 18723 1 
       74 . 1 1  9  9 ARG CD   C 13  43.163 0.010 . 1 . . . A  9 ARG CD   . 18723 1 
       75 . 1 1  9  9 ARG N    N 15 125.074 0.010 . 1 . . . A  9 ARG N    . 18723 1 
       76 . 1 1 10 10 GLY H    H  1   8.682 0.010 . 1 . . . A 10 GLY H    . 18723 1 
       77 . 1 1 10 10 GLY HA2  H  1   3.609 0.010 . 1 . . . A 10 GLY HA2  . 18723 1 
       78 . 1 1 10 10 GLY HA3  H  1   4.180 0.010 . 1 . . . A 10 GLY HA3  . 18723 1 
       79 . 1 1 10 10 GLY CA   C 13  45.318 0.010 . 1 . . . A 10 GLY CA   . 18723 1 
       80 . 1 1 10 10 GLY N    N 15 104.449 0.010 . 1 . . . A 10 GLY N    . 18723 1 
       81 . 1 1 11 11 VAL H    H  1   7.807 0.010 . 1 . . . A 11 VAL H    . 18723 1 
       82 . 1 1 11 11 VAL HA   H  1   4.301 0.010 . 1 . . . A 11 VAL HA   . 18723 1 
       83 . 1 1 11 11 VAL HB   H  1   2.139 0.010 . 1 . . . A 11 VAL HB   . 18723 1 
       84 . 1 1 11 11 VAL HG11 H  1   0.945 0.010 . 1 . . . A 11 VAL HG11 . 18723 1 
       85 . 1 1 11 11 VAL HG12 H  1   0.945 0.010 . 1 . . . A 11 VAL HG12 . 18723 1 
       86 . 1 1 11 11 VAL HG13 H  1   0.945 0.010 . 1 . . . A 11 VAL HG13 . 18723 1 
       87 . 1 1 11 11 VAL HG21 H  1   0.945 0.010 . 1 . . . A 11 VAL HG21 . 18723 1 
       88 . 1 1 11 11 VAL HG22 H  1   0.945 0.010 . 1 . . . A 11 VAL HG22 . 18723 1 
       89 . 1 1 11 11 VAL HG23 H  1   0.945 0.010 . 1 . . . A 11 VAL HG23 . 18723 1 
       90 . 1 1 11 11 VAL CA   C 13  61.766 0.010 . 1 . . . A 11 VAL CA   . 18723 1 
       91 . 1 1 11 11 VAL CB   C 13  33.509 0.010 . 1 . . . A 11 VAL CB   . 18723 1 
       92 . 1 1 11 11 VAL N    N 15 121.730 0.010 . 1 . . . A 11 VAL N    . 18723 1 
       93 . 1 1 12 12 CYS H    H  1   9.082 0.010 . 1 . . . A 12 CYS H    . 18723 1 
       94 . 1 1 12 12 CYS HA   H  1   5.467 0.010 . 1 . . . A 12 CYS HA   . 18723 1 
       95 . 1 1 12 12 CYS HB2  H  1   3.040 0.010 . 1 . . . A 12 CYS HB2  . 18723 1 
       96 . 1 1 12 12 CYS HB3  H  1   2.765 0.010 . 1 . . . A 12 CYS HB3  . 18723 1 
       97 . 1 1 12 12 CYS CA   C 13  55.302 0.010 . 1 . . . A 12 CYS CA   . 18723 1 
       98 . 1 1 12 12 CYS CB   C 13  48.215 0.010 . 1 . . . A 12 CYS CB   . 18723 1 
       99 . 1 1 13 13 ARG H    H  1   8.676 0.010 . 1 . . . A 13 ARG H    . 18723 1 
      100 . 1 1 13 13 ARG HA   H  1   4.691 0.010 . 1 . . . A 13 ARG HA   . 18723 1 
      101 . 1 1 13 13 ARG HB2  H  1   1.648 0.010 . 1 . . . A 13 ARG HB2  . 18723 1 
      102 . 1 1 13 13 ARG HB3  H  1   1.731 0.010 . 1 . . . A 13 ARG HB3  . 18723 1 
      103 . 1 1 13 13 ARG HD2  H  1   3.235 0.010 . 1 . . . A 13 ARG HD2  . 18723 1 
      104 . 1 1 13 13 ARG HD3  H  1   3.234 0.010 . 1 . . . A 13 ARG HD3  . 18723 1 
      105 . 1 1 13 13 ARG CA   C 13  55.059 0.010 . 1 . . . A 13 ARG CA   . 18723 1 
      106 . 1 1 13 13 ARG CB   C 13  32.909 0.010 . 1 . . . A 13 ARG CB   . 18723 1 
      107 . 1 1 13 13 ARG CD   C 13  43.177 0.010 . 1 . . . A 13 ARG CD   . 18723 1 
      108 . 1 1 13 13 ARG N    N 15 123.309 0.010 . 1 . . . A 13 ARG N    . 18723 1 
      109 . 1 1 14 14 CYS H    H  1   9.111 0.010 . 1 . . . A 14 CYS H    . 18723 1 
      110 . 1 1 14 14 CYS HA   H  1   5.528 0.010 . 1 . . . A 14 CYS HA   . 18723 1 
      111 . 1 1 14 14 CYS HB2  H  1   2.600 0.010 . 1 . . . A 14 CYS HB2  . 18723 1 
      112 . 1 1 14 14 CYS HB3  H  1   3.067 0.010 . 1 . . . A 14 CYS HB3  . 18723 1 
      113 . 1 1 14 14 CYS CA   C 13  55.606 0.010 . 1 . . . A 14 CYS CA   . 18723 1 
      114 . 1 1 14 14 CYS CB   C 13  48.219 0.010 . 1 . . . A 14 CYS CB   . 18723 1 
      115 . 1 1 15 15 ILE H    H  1   8.782 0.010 . 1 . . . A 15 ILE H    . 18723 1 
      116 . 1 1 15 15 ILE HA   H  1   4.409 0.010 . 1 . . . A 15 ILE HA   . 18723 1 
      117 . 1 1 15 15 ILE HB   H  1   1.831 0.010 . 1 . . . A 15 ILE HB   . 18723 1 
      118 . 1 1 15 15 ILE HG12 H  1   1.169 0.010 . 1 . . . A 15 ILE HG12 . 18723 1 
      119 . 1 1 15 15 ILE HG13 H  1   1.169 0.010 . 1 . . . A 15 ILE HG13 . 18723 1 
      120 . 1 1 15 15 ILE HG21 H  1   0.920 0.010 . 1 . . . A 15 ILE HG21 . 18723 1 
      121 . 1 1 15 15 ILE HG22 H  1   0.920 0.010 . 1 . . . A 15 ILE HG22 . 18723 1 
      122 . 1 1 15 15 ILE HG23 H  1   0.920 0.010 . 1 . . . A 15 ILE HG23 . 18723 1 
      123 . 1 1 15 15 ILE HD11 H  1   0.920 0.010 . 1 . . . A 15 ILE HD11 . 18723 1 
      124 . 1 1 15 15 ILE HD12 H  1   0.920 0.010 . 1 . . . A 15 ILE HD12 . 18723 1 
      125 . 1 1 15 15 ILE HD13 H  1   0.920 0.010 . 1 . . . A 15 ILE HD13 . 18723 1 
      126 . 1 1 15 15 ILE CA   C 13  60.358 0.010 . 1 . . . A 15 ILE CA   . 18723 1 
      127 . 1 1 15 15 ILE CB   C 13  40.460 0.010 . 1 . . . A 15 ILE CB   . 18723 1 
      128 . 1 1 15 15 ILE CG1  C 13  27.431 0.010 . 1 . . . A 15 ILE CG1  . 18723 1 
      129 . 1 1 15 15 ILE N    N 15 123.850 0.010 . 1 . . . A 15 ILE N    . 18723 1 
      130 . 1 1 16 16 CYS H    H  1   9.138 0.010 . 1 . . . A 16 CYS H    . 18723 1 
      131 . 1 1 16 16 CYS HA   H  1   5.598 0.010 . 1 . . . A 16 CYS HA   . 18723 1 
      132 . 1 1 16 16 CYS HB2  H  1   2.716 0.010 . 1 . . . A 16 CYS HB2  . 18723 1 
      133 . 1 1 16 16 CYS HB3  H  1   3.109 0.010 . 1 . . . A 16 CYS HB3  . 18723 1 
      134 . 1 1 16 16 CYS CA   C 13  55.471 0.010 . 1 . . . A 16 CYS CA   . 18723 1 
      135 . 1 1 16 16 CYS CB   C 13  47.821 0.010 . 1 . . . A 16 CYS CB   . 18723 1 
      136 . 1 1 17 17 THR H    H  1   8.804 0.010 . 1 . . . A 17 THR H    . 18723 1 
      137 . 1 1 17 17 THR HA   H  1   4.486 0.010 . 1 . . . A 17 THR HA   . 18723 1 
      138 . 1 1 17 17 THR HB   H  1   4.155 0.010 . 1 . . . A 17 THR HB   . 18723 1 
      139 . 1 1 17 17 THR HG21 H  1   1.231 0.010 . 1 . . . A 17 THR HG21 . 18723 1 
      140 . 1 1 17 17 THR HG22 H  1   1.231 0.010 . 1 . . . A 17 THR HG22 . 18723 1 
      141 . 1 1 17 17 THR HG23 H  1   1.231 0.010 . 1 . . . A 17 THR HG23 . 18723 1 
      142 . 1 1 17 17 THR CA   C 13  61.120 0.010 . 1 . . . A 17 THR CA   . 18723 1 
      143 . 1 1 17 17 THR CB   C 13  70.385 0.010 . 1 . . . A 17 THR CB   . 18723 1 
      144 . 1 1 17 17 THR CG2  C 13  21.086 0.010 . 1 . . . A 17 THR CG2  . 18723 1 
      145 . 1 1 17 17 THR N    N 15 118.568 0.010 . 1 . . . A 17 THR N    . 18723 1 
      146 . 1 1 18 18 ARG H    H  1   9.404 0.010 . 1 . . . A 18 ARG H    . 18723 1 
      147 . 1 1 18 18 ARG HA   H  1   3.937 0.010 . 1 . . . A 18 ARG HA   . 18723 1 
      148 . 1 1 18 18 ARG HB2  H  1   1.944 0.010 . 1 . . . A 18 ARG HB2  . 18723 1 
      149 . 1 1 18 18 ARG HB3  H  1   2.106 0.010 . 1 . . . A 18 ARG HB3  . 18723 1 
      150 . 1 1 18 18 ARG HD2  H  1   3.286 0.010 . 1 . . . A 18 ARG HD2  . 18723 1 
      151 . 1 1 18 18 ARG HD3  H  1   3.282 0.010 . 1 . . . A 18 ARG HD3  . 18723 1 
      152 . 1 1 18 18 ARG CA   C 13  57.366 0.010 . 1 . . . A 18 ARG CA   . 18723 1 
      153 . 1 1 18 18 ARG CB   C 13  28.321 0.010 . 1 . . . A 18 ARG CB   . 18723 1 
      154 . 1 1 18 18 ARG CD   C 13  43.338 0.010 . 1 . . . A 18 ARG CD   . 18723 1 

   stop_

save_