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                      20126
   _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 NOESY' . . . 20126 1 
      2 '2D 1H-1H TOCSY' . . . 20126 1 
      3 '2D DQF-COSY'    . . . 20126 1 
      4 '2D 1H-15N HSQC' . . . 20126 1 
      5 '2D 1H-13C HSQC' . . . 20126 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 H    H  1   8.939 0.020 . 1 . . . .  1 GLY HN   . 20126 1 
        2 . 1 1  1  1 GLY HA2  H  1   3.915 0.020 . 2 . . . .  1 GLY HA1  . 20126 1 
        3 . 1 1  1  1 GLY HA3  H  1   3.915 0.020 . 2 . . . .  1 GLY HA2  . 20126 1 
        4 . 1 1  1  1 GLY CA   C 13  43.432 0.400 . 1 . . . .  1 GLY CA   . 20126 1 
        5 . 1 1  2  2 CYS H    H  1   8.939 0.020 . 1 . . . .  2 CYS HN   . 20126 1 
        6 . 1 1  2  2 CYS HA   H  1   4.539 0.020 . 1 . . . .  2 CYS HA   . 20126 1 
        7 . 1 1  2  2 CYS HB2  H  1   2.766 0.020 . 2 . . . .  2 CYS HB2  . 20126 1 
        8 . 1 1  2  2 CYS HB3  H  1   3.364 0.020 . 2 . . . .  2 CYS HB3  . 20126 1 
        9 . 1 1  2  2 CYS CA   C 13  58.540 0.400 . 1 . . . .  2 CYS CA   . 20126 1 
       10 . 1 1  2  2 CYS CB   C 13  42.614 0.400 . 1 . . . .  2 CYS CB   . 20126 1 
       11 . 1 1  2  2 CYS N    N 15 119.932 0.400 . 1 . . . .  2 CYS N    . 20126 1 
       12 . 1 1  3  3 CYS H    H  1   8.517 0.020 . 1 . . . .  3 CYS HN   . 20126 1 
       13 . 1 1  3  3 CYS HA   H  1   4.522 0.020 . 1 . . . .  3 CYS HA   . 20126 1 
       14 . 1 1  3  3 CYS HB2  H  1   2.796 0.020 . 2 . . . .  3 CYS HB2  . 20126 1 
       15 . 1 1  3  3 CYS HB3  H  1   3.393 0.020 . 2 . . . .  3 CYS HB3  . 20126 1 
       16 . 1 1  3  3 CYS CA   C 13  55.834 0.400 . 1 . . . .  3 CYS CA   . 20126 1 
       17 . 1 1  3  3 CYS CB   C 13  36.379 0.400 . 1 . . . .  3 CYS CB   . 20126 1 
       18 . 1 1  3  3 CYS N    N 15 111.772 0.400 . 1 . . . .  3 CYS N    . 20126 1 
       19 . 1 1  4  4 SER H    H  1   7.775 0.020 . 1 . . . .  4 SER HN   . 20126 1 
       20 . 1 1  4  4 SER HA   H  1   4.559 0.020 . 1 . . . .  4 SER HA   . 20126 1 
       21 . 1 1  4  4 SER HB2  H  1   3.926 0.020 . 2 . . . .  4 SER HB2  . 20126 1 
       22 . 1 1  4  4 SER HB3  H  1   4.021 0.020 . 2 . . . .  4 SER HB3  . 20126 1 
       23 . 1 1  4  4 SER CA   C 13  58.408 0.400 . 1 . . . .  4 SER CA   . 20126 1 
       24 . 1 1  4  4 SER CB   C 13  63.601 0.400 . 1 . . . .  4 SER CB   . 20126 1 
       25 . 1 1  4  4 SER N    N 15 113.042 0.400 . 1 . . . .  4 SER N    . 20126 1 
       26 . 1 1  5  5 ASN H    H  1   8.052 0.020 . 1 . . . .  5 ASN HN   . 20126 1 
       27 . 1 1  5  5 ASN HA   H  1   5.294 0.020 . 1 . . . .  5 ASN HA   . 20126 1 
       28 . 1 1  5  5 ASN HB2  H  1   2.852 0.020 . 2 . . . .  5 ASN HB2  . 20126 1 
       29 . 1 1  5  5 ASN HB3  H  1   3.201 0.020 . 2 . . . .  5 ASN HB3  . 20126 1 
       30 . 1 1  5  5 ASN HD21 H  1   7.740 0.020 . 2 . . . .  5 ASN HD21 . 20126 1 
       31 . 1 1  5  5 ASN HD22 H  1   7.094 0.020 . 2 . . . .  5 ASN HD22 . 20126 1 
       32 . 1 1  5  5 ASN CA   C 13  50.001 0.400 . 1 . . . .  5 ASN CA   . 20126 1 
       33 . 1 1  5  5 ASN CB   C 13  40.556 0.400 . 1 . . . .  5 ASN CB   . 20126 1 
       34 . 1 1  5  5 ASN N    N 15 122.784 0.400 . 1 . . . .  5 ASN N    . 20126 1 
       35 . 1 1  5  5 ASN ND2  N 15 112.788 0.400 . 1 . . . .  5 ASN ND2  . 20126 1 
       36 . 1 1  6  6 PRO HA   H  1   4.253 0.020 . 1 . . . .  6 PRO HA   . 20126 1 
       37 . 1 1  6  6 PRO HB2  H  1   2.008 0.020 . 2 . . . .  6 PRO HB2  . 20126 1 
       38 . 1 1  6  6 PRO HB3  H  1   2.415 0.020 . 2 . . . .  6 PRO HB3  . 20126 1 
       39 . 1 1  6  6 PRO HD2  H  1   3.919 0.020 . 2 . . . .  6 PRO HD2  . 20126 1 
       40 . 1 1  6  6 PRO HD3  H  1   4.073 0.020 . 2 . . . .  6 PRO HD3  . 20126 1 
       41 . 1 1  6  6 PRO HG2  H  1   2.019 0.020 . 2 . . . .  6 PRO HG2  . 20126 1 
       42 . 1 1  6  6 PRO HG3  H  1   2.167 0.020 . 2 . . . .  6 PRO HG3  . 20126 1 
       43 . 1 1  6  6 PRO CA   C 13  66.057 0.400 . 1 . . . .  6 PRO CA   . 20126 1 
       44 . 1 1  6  6 PRO CB   C 13  32.296 0.400 . 1 . . . .  6 PRO CB   . 20126 1 
       45 . 1 1  6  6 PRO CD   C 13  51.134 0.400 . 1 . . . .  6 PRO CD   . 20126 1 
       46 . 1 1  6  6 PRO CG   C 13  27.380 0.400 . 1 . . . .  6 PRO CG   . 20126 1 
       47 . 1 1  7  7 ALA H    H  1   7.720 0.020 . 1 . . . .  7 ALA HN   . 20126 1 
       48 . 1 1  7  7 ALA HA   H  1   4.166 0.020 . 1 . . . .  7 ALA HA   . 20126 1 
       49 . 1 1  7  7 ALA HB1  H  1   1.388 0.020 . 1 . . . .  7 ALA HB   . 20126 1 
       50 . 1 1  7  7 ALA HB2  H  1   1.388 0.020 . 1 . . . .  7 ALA HB   . 20126 1 
       51 . 1 1  7  7 ALA HB3  H  1   1.388 0.020 . 1 . . . .  7 ALA HB   . 20126 1 
       52 . 1 1  7  7 ALA CA   C 13  54.376 0.400 . 1 . . . .  7 ALA CA   . 20126 1 
       53 . 1 1  7  7 ALA CB   C 13  18.359 0.400 . 1 . . . .  7 ALA CB   . 20126 1 
       54 . 1 1  7  7 ALA N    N 15 117.342 0.400 . 1 . . . .  7 ALA N    . 20126 1 
       55 . 1 1  8  8 CYS H    H  1   7.551 0.020 . 1 . . . .  8 CYS HN   . 20126 1 
       56 . 1 1  8  8 CYS HA   H  1   4.331 0.020 . 1 . . . .  8 CYS HA   . 20126 1 
       57 . 1 1  8  8 CYS HB2  H  1   3.305 0.020 . 2 . . . .  8 CYS HB2  . 20126 1 
       58 . 1 1  8  8 CYS HB3  H  1   4.128 0.020 . 2 . . . .  8 CYS HB3  . 20126 1 
       59 . 1 1  8  8 CYS CA   C 13  59.845 0.400 . 1 . . . .  8 CYS CA   . 20126 1 
       60 . 1 1  8  8 CYS CB   C 13  42.250 0.400 . 1 . . . .  8 CYS CB   . 20126 1 
       61 . 1 1  8  8 CYS N    N 15 118.198 0.400 . 1 . . . .  8 CYS N    . 20126 1 
       62 . 1 1  9  9 MET H    H  1   8.574 0.020 . 1 . . . .  9 MET HN   . 20126 1 
       63 . 1 1  9  9 MET HA   H  1   4.071 0.020 . 1 . . . .  9 MET HA   . 20126 1 
       64 . 1 1  9  9 MET HB2  H  1   2.168 0.020 . 2 . . . .  9 MET HB2  . 20126 1 
       65 . 1 1  9  9 MET HB3  H  1   2.217 0.020 . 2 . . . .  9 MET HB3  . 20126 1 
       66 . 1 1  9  9 MET HG2  H  1   2.493 0.020 . 2 . . . .  9 MET HG2  . 20126 1 
       67 . 1 1  9  9 MET HG3  H  1   2.633 0.020 . 2 . . . .  9 MET HG3  . 20126 1 
       68 . 1 1  9  9 MET CA   C 13  59.338 0.400 . 1 . . . .  9 MET CA   . 20126 1 
       69 . 1 1  9  9 MET CB   C 13  33.054 0.400 . 1 . . . .  9 MET CB   . 20126 1 
       70 . 1 1  9  9 MET CG   C 13  31.876 0.400 . 1 . . . .  9 MET CG   . 20126 1 
       71 . 1 1  9  9 MET N    N 15 121.266 0.400 . 1 . . . .  9 MET N    . 20126 1 
       72 . 1 1 10 10 VAL H    H  1   7.514 0.020 . 1 . . . . 10 VAL HN   . 20126 1 
       73 . 1 1 10 10 VAL HA   H  1   3.874 0.020 . 1 . . . . 10 VAL HA   . 20126 1 
       74 . 1 1 10 10 VAL HB   H  1   2.149 0.020 . 1 . . . . 10 VAL HB   . 20126 1 
       75 . 1 1 10 10 VAL HG11 H  1   0.972 0.020 . 2 . . . . 10 VAL HG1  . 20126 1 
       76 . 1 1 10 10 VAL HG12 H  1   0.972 0.020 . 2 . . . . 10 VAL HG1  . 20126 1 
       77 . 1 1 10 10 VAL HG13 H  1   0.972 0.020 . 2 . . . . 10 VAL HG1  . 20126 1 
       78 . 1 1 10 10 VAL HG21 H  1   1.025 0.020 . 2 . . . . 10 VAL HG2  . 20126 1 
       79 . 1 1 10 10 VAL HG22 H  1   1.025 0.020 . 2 . . . . 10 VAL HG2  . 20126 1 
       80 . 1 1 10 10 VAL HG23 H  1   1.025 0.020 . 2 . . . . 10 VAL HG2  . 20126 1 
       81 . 1 1 10 10 VAL CA   C 13  64.494 0.400 . 1 . . . . 10 VAL CA   . 20126 1 
       82 . 1 1 10 10 VAL CB   C 13  31.876 0.400 . 1 . . . . 10 VAL CB   . 20126 1 
       83 . 1 1 10 10 VAL CG1  C 13  20.781 0.400 . 1 . . . . 10 VAL CG1  . 20126 1 
       84 . 1 1 10 10 VAL CG2  C 13  21.211 0.400 . 1 . . . . 10 VAL CG2  . 20126 1 
       85 . 1 1 10 10 VAL N    N 15 115.796 0.400 . 1 . . . . 10 VAL N    . 20126 1 
       86 . 1 1 11 11 ASN H    H  1   7.341 0.020 . 1 . . . . 11 ASN HN   . 20126 1 
       87 . 1 1 11 11 ASN HA   H  1   4.795 0.020 . 1 . . . . 11 ASN HA   . 20126 1 
       88 . 1 1 11 11 ASN HB2  H  1   2.756 0.020 . 2 . . . . 11 ASN HB2  . 20126 1 
       89 . 1 1 11 11 ASN HB3  H  1   2.942 0.020 . 2 . . . . 11 ASN HB3  . 20126 1 
       90 . 1 1 11 11 ASN HD21 H  1   7.576 0.020 . 2 . . . . 11 ASN HD21 . 20126 1 
       91 . 1 1 11 11 ASN HD22 H  1   6.904 0.020 . 2 . . . . 11 ASN HD22 . 20126 1 
       92 . 1 1 11 11 ASN CB   C 13  39.816 0.400 . 1 . . . . 11 ASN CB   . 20126 1 
       93 . 1 1 11 11 ASN N    N 15 116.695 0.400 . 1 . . . . 11 ASN N    . 20126 1 
       94 . 1 1 11 11 ASN ND2  N 15 113.208 0.400 . 1 . . . . 11 ASN ND2  . 20126 1 
       95 . 1 1 12 12 ASN H    H  1   7.637 0.020 . 1 . . . . 12 ASN HN   . 20126 1 
       96 . 1 1 12 12 ASN HA   H  1   5.367 0.020 . 1 . . . . 12 ASN HA   . 20126 1 
       97 . 1 1 12 12 ASN HB2  H  1   2.631 0.020 . 2 . . . . 12 ASN HB2  . 20126 1 
       98 . 1 1 12 12 ASN HB3  H  1   2.722 0.020 . 2 . . . . 12 ASN HB3  . 20126 1 
       99 . 1 1 12 12 ASN HD21 H  1   7.735 0.020 . 2 . . . . 12 ASN HD21 . 20126 1 
      100 . 1 1 12 12 ASN HD22 H  1   7.260 0.020 . 2 . . . . 12 ASN HD22 . 20126 1 
      101 . 1 1 12 12 ASN CA   C 13  52.150 0.400 . 1 . . . . 12 ASN CA   . 20126 1 
      102 . 1 1 12 12 ASN CB   C 13  40.502 0.400 . 1 . . . . 12 ASN CB   . 20126 1 
      103 . 1 1 12 12 ASN N    N 15 117.552 0.400 . 1 . . . . 12 ASN N    . 20126 1 
      104 . 1 1 12 12 ASN ND2  N 15 117.808 0.400 . 1 . . . . 12 ASN ND2  . 20126 1 
      105 . 1 1 13 13 PRO HA   H  1   4.438 0.020 . 1 . . . . 13 PRO HA   . 20126 1 
      106 . 1 1 13 13 PRO HB2  H  1   2.005 0.020 . 2 . . . . 13 PRO HB2  . 20126 1 
      107 . 1 1 13 13 PRO HB3  H  1   2.309 0.020 . 2 . . . . 13 PRO HB3  . 20126 1 
      108 . 1 1 13 13 PRO HD2  H  1   3.490 0.020 . 2 . . . . 13 PRO HD2  . 20126 1 
      109 . 1 1 13 13 PRO HD3  H  1   3.724 0.020 . 2 . . . . 13 PRO HD3  . 20126 1 
      110 . 1 1 13 13 PRO HG2  H  1   2.093 0.020 . 2 . . . . 13 PRO HG2  . 20126 1 
      111 . 1 1 13 13 PRO HG3  H  1   2.093 0.020 . 2 . . . . 13 PRO HG3  . 20126 1 
      112 . 1 1 13 13 PRO CA   C 13  65.158 0.400 . 1 . . . . 13 PRO CA   . 20126 1 
      113 . 1 1 13 13 PRO CB   C 13  31.527 0.400 . 1 . . . . 13 PRO CB   . 20126 1 
      114 . 1 1 13 13 PRO CD   C 13  50.665 0.400 . 1 . . . . 13 PRO CD   . 20126 1 
      115 . 1 1 13 13 PRO CG   C 13  27.422 0.400 . 1 . . . . 13 PRO CG   . 20126 1 
      116 . 1 1 14 14 GLN H    H  1   8.835 0.020 . 1 . . . . 14 GLN HN   . 20126 1 
      117 . 1 1 14 14 GLN HA   H  1   4.241 0.020 . 1 . . . . 14 GLN HA   . 20126 1 
      118 . 1 1 14 14 GLN HB2  H  1   2.125 0.020 . 2 . . . . 14 GLN HB2  . 20126 1 
      119 . 1 1 14 14 GLN HB3  H  1   2.125 0.020 . 2 . . . . 14 GLN HB3  . 20126 1 
      120 . 1 1 14 14 GLN HE21 H  1   7.628 0.020 . 2 . . . . 14 GLN HE21 . 20126 1 
      121 . 1 1 14 14 GLN HE22 H  1   7.118 0.020 . 2 . . . . 14 GLN HE22 . 20126 1 
      122 . 1 1 14 14 GLN HG2  H  1   2.398 0.020 . 2 . . . . 14 GLN HG2  . 20126 1 
      123 . 1 1 14 14 GLN HG3  H  1   2.521 0.020 . 2 . . . . 14 GLN HG3  . 20126 1 
      124 . 1 1 14 14 GLN CA   C 13  58.009 0.400 . 1 . . . . 14 GLN CA   . 20126 1 
      125 . 1 1 14 14 GLN CB   C 13  27.735 0.400 . 1 . . . . 14 GLN CB   . 20126 1 
      126 . 1 1 14 14 GLN CG   C 13  33.961 0.400 . 1 . . . . 14 GLN CG   . 20126 1 
      127 . 1 1 14 14 GLN N    N 15 118.414 0.400 . 1 . . . . 14 GLN N    . 20126 1 
      128 . 1 1 14 14 GLN NE2  N 15 112.476 0.400 . 1 . . . . 14 GLN NE2  . 20126 1 
      129 . 1 1 15 15 ILE H    H  1   7.349 0.020 . 1 . . . . 15 ILE HN   . 20126 1 
      130 . 1 1 15 15 ILE HA   H  1   4.253 0.020 . 1 . . . . 15 ILE HA   . 20126 1 
      131 . 1 1 15 15 ILE HB   H  1   1.925 0.020 . 1 . . . . 15 ILE HB   . 20126 1 
      132 . 1 1 15 15 ILE HD11 H  1   0.844 0.020 . 1 . . . . 15 ILE HD1  . 20126 1 
      133 . 1 1 15 15 ILE HD12 H  1   0.844 0.020 . 1 . . . . 15 ILE HD1  . 20126 1 
      134 . 1 1 15 15 ILE HD13 H  1   0.844 0.020 . 1 . . . . 15 ILE HD1  . 20126 1 
      135 . 1 1 15 15 ILE HG12 H  1   1.175 0.020 . 2 . . . . 15 ILE HG12 . 20126 1 
      136 . 1 1 15 15 ILE HG13 H  1   1.601 0.020 . 2 . . . . 15 ILE HG13 . 20126 1 
      137 . 1 1 15 15 ILE HG21 H  1   0.919 0.020 . 1 . . . . 15 ILE HG2  . 20126 1 
      138 . 1 1 15 15 ILE HG22 H  1   0.919 0.020 . 1 . . . . 15 ILE HG2  . 20126 1 
      139 . 1 1 15 15 ILE HG23 H  1   0.919 0.020 . 1 . . . . 15 ILE HG2  . 20126 1 
      140 . 1 1 15 15 ILE CA   C 13  62.385 0.400 . 1 . . . . 15 ILE CA   . 20126 1 
      141 . 1 1 15 15 ILE CB   C 13  38.985 0.400 . 1 . . . . 15 ILE CB   . 20126 1 
      142 . 1 1 15 15 ILE CD1  C 13  12.695 0.400 . 1 . . . . 15 ILE CD1  . 20126 1 
      143 . 1 1 15 15 ILE CG1  C 13  27.657 0.400 . 1 . . . . 15 ILE CG1  . 20126 1 
      144 . 1 1 15 15 ILE CG2  C 13  17.773 0.400 . 1 . . . . 15 ILE CG2  . 20126 1 
      145 . 1 1 15 15 ILE N    N 15 115.855 0.400 . 1 . . . . 15 ILE N    . 20126 1 
      146 . 1 1 16 16 CYS H    H  1   7.883 0.020 . 1 . . . . 16 CYS HN   . 20126 1 
      147 . 1 1 16 16 CYS HA   H  1   4.884 0.020 . 1 . . . . 16 CYS HA   . 20126 1 
      148 . 1 1 16 16 CYS HB2  H  1   2.724 0.020 . 2 . . . . 16 CYS HB2  . 20126 1 
      149 . 1 1 16 16 CYS HB3  H  1   3.331 0.020 . 2 . . . . 16 CYS HB3  . 20126 1 
      150 . 1 1 16 16 CYS CA   C 13  53.634 0.400 . 1 . . . . 16 CYS CA   . 20126 1 
      151 . 1 1 16 16 CYS CB   C 13  38.994 0.400 . 1 . . . . 16 CYS CB   . 20126 1 
      152 . 1 1 16 16 CYS N    N 15 118.403 0.400 . 1 . . . . 16 CYS N    . 20126 1 

   stop_

save_