Content for NMR-STAR saveframe, "S2_shift_set"

    save_S2_shift_set
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  S2_shift_set
   _Assigned_chem_shift_list.Entry_ID                      5376
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Sample_condition_list_ID      1
   _Assigned_chem_shift_list.Sample_condition_list_label  $Ex-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 '2D 1H-1H NOESY'                        . . . 5376 1 
      2 '2D 1H-1H TOCSY (15N separated)'        . . . 5376 1 
      3 '2D 1H-15N HSQC (w/o 1H decoupling)'    . . . 5376 1 
      4 '2D 1H-13C CT-HSQC (w/o 1H decoupling)' . . . 5376 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 ILE HA   H  1   3.86 . . 1 . . . . . . . . 5376 1 
        2 . 1 1  1  1 ILE HB   H  1   1.95 . . 1 . . . . . . . . 5376 1 
        3 . 1 1  1  1 ILE HG12 H  1   1.47 . . 2 . . . . . . . . 5376 1 
        4 . 1 1  1  1 ILE HG13 H  1   1.21 . . 2 . . . . . . . . 5376 1 
        5 . 1 1  1  1 ILE HG21 H  1   0.99 . . 1 . . . . . . . . 5376 1 
        6 . 1 1  1  1 ILE HG22 H  1   0.99 . . 1 . . . . . . . . 5376 1 
        7 . 1 1  1  1 ILE HG23 H  1   0.99 . . 1 . . . . . . . . 5376 1 
        8 . 1 1  1  1 ILE HD11 H  1   0.92 . . 1 . . . . . . . . 5376 1 
        9 . 1 1  1  1 ILE HD12 H  1   0.92 . . 1 . . . . . . . . 5376 1 
       10 . 1 1  1  1 ILE HD13 H  1   0.92 . . 1 . . . . . . . . 5376 1 
       11 . 1 1  1  1 ILE CA   C 13  60.5  . . 1 . . . . . . . . 5376 1 
       12 . 1 1  1  1 ILE CB   C 13  39.3  . . 1 . . . . . . . . 5376 1 
       13 . 1 1  1  1 ILE CG1  C 13  26.7  . . 1 . . . . . . . . 5376 1 
       14 . 1 1  1  1 ILE CG2  C 13  16.9  . . 1 . . . . . . . . 5376 1 
       15 . 1 1  1  1 ILE CD1  C 13  13.3  . . 1 . . . . . . . . 5376 1 
       16 . 1 1  2  2 ARG HA   H  1   4.32 . . 1 . . . . . . . . 5376 1 
       17 . 1 1  2  2 ARG HB2  H  1   1.86 . . 2 . . . . . . . . 5376 1 
       18 . 1 1  2  2 ARG HB3  H  1   1.79 . . 2 . . . . . . . . 5376 1 
       19 . 1 1  2  2 ARG HG2  H  1   1.63 . . 1 . . . . . . . . 5376 1 
       20 . 1 1  2  2 ARG HG3  H  1   1.63 . . 1 . . . . . . . . 5376 1 
       21 . 1 1  2  2 ARG HD2  H  1   3.20 . . 1 . . . . . . . . 5376 1 
       22 . 1 1  2  2 ARG HD3  H  1   3.20 . . 1 . . . . . . . . 5376 1 
       23 . 1 1  2  2 ARG CA   C 13  56.4  . . 1 . . . . . . . . 5376 1 
       24 . 1 1  2  2 ARG CB   C 13  30.4  . . 1 . . . . . . . . 5376 1 
       25 . 1 1  2  2 ARG CG   C 13  27.2  . . 1 . . . . . . . . 5376 1 
       26 . 1 1  2  2 ARG CD   C 13  43.3  . . 1 . . . . . . . . 5376 1 
       27 . 1 1  3  3 GLU H    H  1   8.76 . . 1 . . . . . . . . 5376 1 
       28 . 1 1  3  3 GLU HA   H  1   4.23 . . 1 . . . . . . . . 5376 1 
       29 . 1 1  3  3 GLU HB2  H  1   2.00 . . 2 . . . . . . . . 5376 1 
       30 . 1 1  3  3 GLU HB3  H  1   1.92 . . 2 . . . . . . . . 5376 1 
       31 . 1 1  3  3 GLU HG2  H  1   2.26 . . 1 . . . . . . . . 5376 1 
       32 . 1 1  3  3 GLU HG3  H  1   2.26 . . 1 . . . . . . . . 5376 1 
       33 . 1 1  3  3 GLU CA   C 13  56.9  . . 1 . . . . . . . . 5376 1 
       34 . 1 1  3  3 GLU CB   C 13  30.4  . . 1 . . . . . . . . 5376 1 
       35 . 1 1  3  3 GLU CG   C 13  36.3  . . 1 . . . . . . . . 5376 1 
       36 . 1 1  3  3 GLU N    N 15 123.4  . . 1 . . . . . . . . 5376 1 
       37 . 1 1  4  4 ASN H    H  1   8.65 . . 1 . . . . . . . . 5376 1 
       38 . 1 1  4  4 ASN HA   H  1   4.67 . . 1 . . . . . . . . 5376 1 
       39 . 1 1  4  4 ASN HB2  H  1   2.85 . . 2 . . . . . . . . 5376 1 
       40 . 1 1  4  4 ASN HB3  H  1   2.75 . . 2 . . . . . . . . 5376 1 
       41 . 1 1  4  4 ASN HD21 H  1   7.68 . . 2 . . . . . . . . 5376 1 
       42 . 1 1  4  4 ASN HD22 H  1   6.97 . . 2 . . . . . . . . 5376 1 
       43 . 1 1  4  4 ASN CA   C 13  53.1  . . 1 . . . . . . . . 5376 1 
       44 . 1 1  4  4 ASN CB   C 13  38.6  . . 1 . . . . . . . . 5376 1 
       45 . 1 1  4  4 ASN N    N 15 119.7  . . 1 . . . . . . . . 5376 1 
       46 . 1 1  4  4 ASN ND2  N 15 113.2  . . 1 . . . . . . . . 5376 1 
       47 . 1 1  5  5 LEU H    H  1   8.35 . . 1 . . . . . . . . 5376 1 
       48 . 1 1  5  5 LEU HA   H  1   4.31 . . 1 . . . . . . . . 5376 1 
       49 . 1 1  5  5 LEU HB2  H  1   1.65 . . 2 . . . . . . . . 5376 1 
       50 . 1 1  5  5 LEU HB3  H  1   1.59 . . 2 . . . . . . . . 5376 1 
       51 . 1 1  5  5 LEU HG   H  1   1.60 . . 1 . . . . . . . . 5376 1 
       52 . 1 1  5  5 LEU HD11 H  1   0.92 . . 1 . . . . . . . . 5376 1 
       53 . 1 1  5  5 LEU HD12 H  1   0.92 . . 1 . . . . . . . . 5376 1 
       54 . 1 1  5  5 LEU HD13 H  1   0.92 . . 1 . . . . . . . . 5376 1 
       55 . 1 1  5  5 LEU HD21 H  1   0.86 . . 1 . . . . . . . . 5376 1 
       56 . 1 1  5  5 LEU HD22 H  1   0.86 . . 1 . . . . . . . . 5376 1 
       57 . 1 1  5  5 LEU HD23 H  1   0.86 . . 1 . . . . . . . . 5376 1 
       58 . 1 1  5  5 LEU CA   C 13  55.4  . . 1 . . . . . . . . 5376 1 
       59 . 1 1  5  5 LEU CB   C 13  42.2  . . 1 . . . . . . . . 5376 1 
       60 . 1 1  5  5 LEU CG   C 13  27.0  . . 1 . . . . . . . . 5376 1 
       61 . 1 1  5  5 LEU CD1  C 13  25.0  . . 1 . . . . . . . . 5376 1 
       62 . 1 1  5  5 LEU CD2  C 13  23.2  . . 1 . . . . . . . . 5376 1 
       63 . 1 1  5  5 LEU N    N 15 122.9  . . 1 . . . . . . . . 5376 1 
       64 . 1 1  6  6 LYS H    H  1   8.36 . . 1 . . . . . . . . 5376 1 
       65 . 1 1  6  6 LYS HA   H  1   4.27 . . 1 . . . . . . . . 5376 1 
       66 . 1 1  6  6 LYS HB2  H  1   1.82 . . 2 . . . . . . . . 5376 1 
       67 . 1 1  6  6 LYS HB3  H  1   1.78 . . 2 . . . . . . . . 5376 1 
       68 . 1 1  6  6 LYS HG2  H  1   1.43 . . 2 . . . . . . . . 5376 1 
       69 . 1 1  6  6 LYS HG3  H  1   1.39 . . 2 . . . . . . . . 5376 1 
       70 . 1 1  6  6 LYS HD2  H  1   1.66 . . 1 . . . . . . . . 5376 1 
       71 . 1 1  6  6 LYS HD3  H  1   1.66 . . 1 . . . . . . . . 5376 1 
       72 . 1 1  6  6 LYS HE2  H  1   2.97 . . 1 . . . . . . . . 5376 1 
       73 . 1 1  6  6 LYS HE3  H  1   2.97 . . 1 . . . . . . . . 5376 1 
       74 . 1 1  6  6 LYS CA   C 13  56.7  . . 1 . . . . . . . . 5376 1 
       75 . 1 1  6  6 LYS CB   C 13  32.9  . . 1 . . . . . . . . 5376 1 
       76 . 1 1  6  6 LYS CG   C 13  24.7  . . 1 . . . . . . . . 5376 1 
       77 . 1 1  6  6 LYS CD   C 13  29.1  . . 1 . . . . . . . . 5376 1 
       78 . 1 1  6  6 LYS CE   C 13  42.1  . . 1 . . . . . . . . 5376 1 
       79 . 1 1  6  6 LYS N    N 15 121.8  . . 1 . . . . . . . . 5376 1 
       80 . 1 1  7  7 ASP H    H  1   8.36 . . 1 . . . . . . . . 5376 1 
       81 . 1 1  7  7 ASP HA   H  1   4.61 . . 1 . . . . . . . . 5376 1 
       82 . 1 1  7  7 ASP HB2  H  1   2.75 . . 2 . . . . . . . . 5376 1 
       83 . 1 1  7  7 ASP HB3  H  1   2.66 . . 2 . . . . . . . . 5376 1 
       84 . 1 1  7  7 ASP CA   C 13  54.5  . . 1 . . . . . . . . 5376 1 
       85 . 1 1  7  7 ASP CB   C 13  41.1  . . 1 . . . . . . . . 5376 1 
       86 . 1 1  7  7 ASP N    N 15 121.4  . . 1 . . . . . . . . 5376 1 
       87 . 1 1  8  8 SER H    H  1   8.31 . . 1 . . . . . . . . 5376 1 
       88 . 1 1  8  8 SER HA   H  1   4.37 . . 1 . . . . . . . . 5376 1 
       89 . 1 1  8  8 SER HB2  H  1   3.93 . . 2 . . . . . . . . 5376 1 
       90 . 1 1  8  8 SER HB3  H  1   3.89 . . 2 . . . . . . . . 5376 1 
       91 . 1 1  8  8 SER CA   C 13  58.9  . . 1 . . . . . . . . 5376 1 
       92 . 1 1  8  8 SER CB   C 13  63.8  . . 1 . . . . . . . . 5376 1 
       93 . 1 1  8  8 SER N    N 15 116.3  . . 1 . . . . . . . . 5376 1 
       94 . 1 1  9  9 GLY H    H  1   8.53 . . 1 . . . . . . . . 5376 1 
       95 . 1 1  9  9 GLY HA2  H  1   3.93 . . 1 . . . . . . . . 5376 1 
       96 . 1 1  9  9 GLY HA3  H  1   3.93 . . 1 . . . . . . . . 5376 1 
       97 . 1 1  9  9 GLY CA   C 13  45.4  . . 1 . . . . . . . . 5376 1 
       98 . 1 1  9  9 GLY N    N 15 110.8  . . 1 . . . . . . . . 5376 1 
       99 . 1 1 10 10 LEU H    H  1   7.94 . . 1 . . . . . . . . 5376 1 
      100 . 1 1 10 10 LEU HA   H  1   4.30 . . 1 . . . . . . . . 5376 1 
      101 . 1 1 10 10 LEU HB2  H  1   1.50 . . 2 . . . . . . . . 5376 1 
      102 . 1 1 10 10 LEU HB3  H  1   1.44 . . 2 . . . . . . . . 5376 1 
      103 . 1 1 10 10 LEU HG   H  1   1.50 . . 1 . . . . . . . . 5376 1 
      104 . 1 1 10 10 LEU HD11 H  1   0.88 . . 1 . . . . . . . . 5376 1 
      105 . 1 1 10 10 LEU HD12 H  1   0.88 . . 1 . . . . . . . . 5376 1 
      106 . 1 1 10 10 LEU HD13 H  1   0.88 . . 1 . . . . . . . . 5376 1 
      107 . 1 1 10 10 LEU HD21 H  1   0.81 . . 1 . . . . . . . . 5376 1 
      108 . 1 1 10 10 LEU HD22 H  1   0.81 . . 1 . . . . . . . . 5376 1 
      109 . 1 1 10 10 LEU HD23 H  1   0.81 . . 1 . . . . . . . . 5376 1 
      110 . 1 1 10 10 LEU CA   C 13  55.0  . . 1 . . . . . . . . 5376 1 
      111 . 1 1 10 10 LEU CB   C 13  42.4  . . 1 . . . . . . . . 5376 1 
      112 . 1 1 10 10 LEU CG   C 13  26.8  . . 1 . . . . . . . . 5376 1 
      113 . 1 1 10 10 LEU CD1  C 13  25.0  . . 1 . . . . . . . . 5376 1 
      114 . 1 1 10 10 LEU CD2  C 13  23.1  . . 1 . . . . . . . . 5376 1 
      115 . 1 1 10 10 LEU N    N 15 121.4  . . 1 . . . . . . . . 5376 1 
      116 . 1 1 11 11 PHE H    H  1   7.71 . . 1 . . . . . . . . 5376 1 
      117 . 1 1 11 11 PHE HA   H  1   4.43 . . 1 . . . . . . . . 5376 1 
      118 . 1 1 11 11 PHE HB2  H  1   3.17 . . 2 . . . . . . . . 5376 1 
      119 . 1 1 11 11 PHE HB3  H  1   2.94 . . 2 . . . . . . . . 5376 1 
      120 . 1 1 11 11 PHE HD1  H  1   7.22 . . 1 . . . . . . . . 5376 1 
      121 . 1 1 11 11 PHE HD2  H  1   7.22 . . 1 . . . . . . . . 5376 1 
      122 . 1 1 11 11 PHE HE1  H  1   7.33 . . 1 . . . . . . . . 5376 1 
      123 . 1 1 11 11 PHE HE2  H  1   7.33 . . 1 . . . . . . . . 5376 1 
      124 . 1 1 11 11 PHE HZ   H  1   7.27 . . 1 . . . . . . . . 5376 1 
      125 . 1 1 11 11 PHE CA   C 13  58.9  . . 1 . . . . . . . . 5376 1 
      126 . 1 1 11 11 PHE CB   C 13  40.4  . . 1 . . . . . . . . 5376 1 
      127 . 1 1 11 11 PHE N    N 15 124.9  . . 1 . . . . . . . . 5376 1 

   stop_

save_