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                      16254
   _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 13C-13C DARR 40 ms, 100 ms & 200 ms' . . . 16254 1 
      3 '2D CM5RR 0.8 ms & 1.5 ms'               . . . 16254 1 
      5 '3D 15N-13C-13C NCACX'                   . . . 16254 1 
      6 '3D 15N-13C-13C NCOCX'                   . . . 16254 1 
      7 '2D 15N-13C NCX'                         . . . 16254 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 ALA C   C 13 172.700 . . 1 . . . .  1 A C   . 16254 1 
        2 . 1 1  1  1 ALA CA  C 13  51.200 . . 1 . . . .  1 A CA  . 16254 1 
        3 . 1 1  1  1 ALA CB  C 13  19.200 . . 1 . . . .  1 A CB  . 16254 1 
        4 . 1 1  1  1 ALA N   N 15  41.700 . . 1 . . . .  1 A N   . 16254 1 
        5 . 1 1  2  2 CYS C   C 13 173.100 . . 1 . . . .  2 C C   . 16254 1 
        6 . 1 1  2  2 CYS CA  C 13  54.900 . . 1 . . . .  2 C CA  . 16254 1 
        7 . 1 1  2  2 CYS CB  C 13  48.400 . . 1 . . . .  2 C CB  . 16254 1 
        8 . 1 1  2  2 CYS N   N 15 117.800 . . 1 . . . .  2 C N   . 16254 1 
        9 . 1 1  3  3 TYR C   C 13 174.300 . . 1 . . . .  3 Y C   . 16254 1 
       10 . 1 1  3  3 TYR CA  C 13  56.350 . . 1 . . . .  3 Y CA  . 16254 1 
       11 . 1 1  3  3 TYR CB  C 13  43.400 . . 1 . . . .  3 Y CB  . 16254 1 
       12 . 1 1  3  3 TYR N   N 15 117.600 . . 1 . . . .  3 Y N   . 16254 1 
       13 . 1 1  4  4 CYS C   C 13 173.100 . . 1 . . . .  4 C C   . 16254 1 
       14 . 1 1  4  4 CYS CA  C 13  54.350 . . 1 . . . .  4 C CA  . 16254 1 
       15 . 1 1  4  4 CYS CB  C 13  46.200 . . 1 . . . .  4 C CB  . 16254 1 
       16 . 1 1  4  4 CYS N   N 15 130.600 . . 1 . . . .  4 C N   . 16254 1 
       17 . 1 1  5  5 ARG C   C 13 175.350 . . 1 . . . .  5 R C   . 16254 1 
       18 . 1 1  5  5 ARG CA  C 13  55.800 . . 1 . . . .  5 R CA  . 16254 1 
       19 . 1 1  5  5 ARG CB  C 13  35.600 . . 1 . . . .  5 R CB  . 16254 1 
       20 . 1 1  5  5 ARG CD  C 13  43.150 . . 1 . . . .  5 R CD  . 16254 1 
       21 . 1 1  5  5 ARG CG  C 13  28.450 . . 1 . . . .  5 R CG  . 16254 1 
       22 . 1 1  5  5 ARG CZ  C 13 159.900 . . 1 . . . .  5 R CZ  . 16254 1 
       23 . 1 1  5  5 ARG N   N 15 123.100 . . 1 . . . .  5 R N   . 16254 1 
       24 . 1 1  6  6 ILE C   C 13 174.300 . . 1 . . . .  6 I C   . 16254 1 
       25 . 1 1  6  6 ILE CA  C 13  58.150 . . 1 . . . .  6 I CA  . 16254 1 
       26 . 1 1  6  6 ILE CB  C 13  42.850 . . 1 . . . .  6 I CB  . 16254 1 
       27 . 1 1  6  6 ILE CD1 C 13  11.800 . . 1 . . . .  6 I CD1 . 16254 1 
       28 . 1 1  6  6 ILE CG1 C 13  16.850 . . 1 . . . .  6 I CG1 . 16254 1 
       29 . 1 1  6  6 ILE CG2 C 13  29.900 . . 1 . . . .  6 I CG2 . 16254 1 
       30 . 1 1  6  6 ILE N   N 15 122.300 . . 1 . . . .  6 I N   . 16254 1 
       31 . 1 1  7  7 PRO C   C 13 174.350 . . 1 . . . .  7 P C   . 16254 1 
       32 . 1 1  7  7 PRO CA  C 13  63.950 . . 1 . . . .  7 P CA  . 16254 1 
       33 . 1 1  7  7 PRO CB  C 13  34.600 . . 1 . . . .  7 P CB  . 16254 1 
       34 . 1 1  7  7 PRO CD  C 13  49.300 . . 1 . . . .  7 P CD  . 16254 1 
       35 . 1 1  7  7 PRO CG  C 13  24.850 . . 1 . . . .  7 P CG  . 16254 1 
       36 . 1 1  7  7 PRO N   N 15 134.400 . . 1 . . . .  7 P N   . 16254 1 
       37 . 1 1  8  8 ALA C   C 13 174.750 . . 1 . . . .  8 A C   . 16254 1 
       38 . 1 1  8  8 ALA CA  C 13  50.550 . . 1 . . . .  8 A CA  . 16254 1 
       39 . 1 1  8  8 ALA CB  C 13  22.200 . . 1 . . . .  8 A CB  . 16254 1 
       40 . 1 1  8  8 ALA N   N 15 122.600 . . 1 . . . .  8 A N   . 16254 1 
       41 . 1 1  9  9 CYS C   C 13 174.700 . . 1 . . . .  9 C C   . 16254 1 
       42 . 1 1  9  9 CYS CA  C 13  52.500 . . 1 . . . .  9 C CA  . 16254 1 
       43 . 1 1  9  9 CYS CB  C 13  35.200 . . 1 . . . .  9 C CB  . 16254 1 
       44 . 1 1  9  9 CYS N   N 15 115.600 . . 1 . . . .  9 C N   . 16254 1 
       45 . 1 1 10 10 ILE C   C 13 175.100 . . 1 . . . . 10 I C   . 16254 1 
       46 . 1 1 10 10 ILE CA  C 13  59.600 . . 1 . . . . 10 I CA  . 16254 1 
       47 . 1 1 10 10 ILE CB  C 13  39.200 . . 1 . . . . 10 I CB  . 16254 1 
       48 . 1 1 10 10 ILE CD1 C 13  13.850 . . 1 . . . . 10 I CD1 . 16254 1 
       49 . 1 1 10 10 ILE CG1 C 13  17.600 . . 1 . . . . 10 I CG1 . 16254 1 
       50 . 1 1 10 10 ILE CG2 C 13  25.500 . . 1 . . . . 10 I CG2 . 16254 1 
       51 . 1 1 10 10 ILE N   N 15 115.400 . . 1 . . . . 10 I N   . 16254 1 
       52 . 1 1 11 11 ALA C   C 13 177.050 . . 1 . . . . 11 A C   . 16254 1 
       53 . 1 1 11 11 ALA CA  C 13  53.500 . . 1 . . . . 11 A CA  . 16254 1 
       54 . 1 1 11 11 ALA CB  C 13  18.250 . . 1 . . . . 11 A CB  . 16254 1 
       55 . 1 1 11 11 ALA N   N 15 121.900 . . 1 . . . . 11 A N   . 16254 1 
       56 . 1 1 12 12 GLY C   C 13 174.500 . . 1 . . . . 12 G C   . 16254 1 
       57 . 1 1 12 12 GLY CA  C 13  44.250 . . 1 . . . . 12 G CA  . 16254 1 
       58 . 1 1 12 12 GLY N   N 15 109.600 . . 1 . . . . 12 G N   . 16254 1 
       59 . 1 1 13 13 GLU C   C 13 175.300 . . 1 . . . . 13 E C   . 16254 1 
       60 . 1 1 13 13 GLU CA  C 13  54.100 . . 1 . . . . 13 E CA  . 16254 1 
       61 . 1 1 13 13 GLU CB  C 13  33.100 . . 1 . . . . 13 E CB  . 16254 1 
       62 . 1 1 13 13 GLU CD  C 13 183.450 . . 1 . . . . 13 E CD  . 16254 1 
       63 . 1 1 13 13 GLU CG  C 13  36.100 . . 1 . . . . 13 E CG  . 16254 1 
       64 . 1 1 13 13 GLU N   N 15 121.300 . . 1 . . . . 13 E N   . 16254 1 
       65 . 1 1 14 14 ARG C   C 13 173.100 . . 1 . . . . 14 R C   . 16254 1 
       66 . 1 1 14 14 ARG CA  C 13  54.400 . . 1 . . . . 14 R CA  . 16254 1 
       67 . 1 1 14 14 ARG N   N 15 130.600 . . 1 . . . . 14 R N   . 16254 1 
       68 . 1 1 15 15 ARG C   C 13 177.000 . . 1 . . . . 15 R C   . 16254 1 
       69 . 1 1 15 15 ARG CA  C 13  56.300 . . 1 . . . . 15 R CA  . 16254 1 
       70 . 1 1 15 15 ARG CB  C 13  30.000 . . 1 . . . . 15 R CB  . 16254 1 
       71 . 1 1 15 15 ARG CD  C 13  44.150 . . 1 . . . . 15 R CD  . 16254 1 
       72 . 1 1 15 15 ARG CG  C 13  28.650 . . 1 . . . . 15 R CG  . 16254 1 
       73 . 1 1 15 15 ARG CZ  C 13 158.800 . . 1 . . . . 15 R CZ  . 16254 1 
       74 . 1 1 15 15 ARG N   N 15 122.800 . . 1 . . . . 15 R N   . 16254 1 
       75 . 1 1 16 16 TYR C   C 13 175.200 . . 1 . . . . 16 Y C   . 16254 1 
       76 . 1 1 16 16 TYR CA  C 13  58.000 . . 1 . . . . 16 Y CA  . 16254 1 
       77 . 1 1 16 16 TYR CB  C 13  40.200 . . 1 . . . . 16 Y CB  . 16254 1 
       78 . 1 1 16 16 TYR CG  C 13 133.200 . . 1 . . . . 16 Y CG  . 16254 1 
       79 . 1 1 16 16 TYR N   N 15 128.100 . . 1 . . . . 16 Y N   . 16254 1 
       80 . 1 1 17 17 GLY C   C 13 173.750 . . 1 . . . . 17 G C   . 16254 1 
       81 . 1 1 17 17 GLY CA  C 13  46.700 . . 1 . . . . 17 G CA  . 16254 1 
       82 . 1 1 17 17 GLY N   N 15 107.300 . . 1 . . . . 17 G N   . 16254 1 
       83 . 1 1 18 18 THR C   C 13 173.400 . . 1 . . . . 18 T C   . 16254 1 
       84 . 1 1 18 18 THR CA  C 13  61.100 . . 1 . . . . 18 T CA  . 16254 1 
       85 . 1 1 18 18 THR CB  C 13  71.300 . . 1 . . . . 18 T CB  . 16254 1 
       86 . 1 1 18 18 THR CG2 C 13  23.400 . .  . . . . . 18 T CG  . 16254 1 
       87 . 1 1 18 18 THR N   N 15 124.200 . . 1 . . . . 18 T N   . 16254 1 
       88 . 1 1 19 19 CYS C   C 13 173.400 . . 1 . . . . 19 C C   . 16254 1 
       89 . 1 1 19 19 CYS CA  C 13  53.250 . . 1 . . . . 19 C CA  . 16254 1 
       90 . 1 1 19 19 CYS CB  C 13  44.750 . . 1 . . . . 19 C CB  . 16254 1 
       91 . 1 1 19 19 CYS N   N 15 122.300 . . 1 . . . . 19 C N   . 16254 1 
       92 . 1 1 20 20 ILE C   C 13 175.200 . . 1 . . . . 20 I C   . 16254 1 
       93 . 1 1 20 20 ILE CA  C 13  61.350 . . 1 . . . . 20 I CA  . 16254 1 
       94 . 1 1 20 20 ILE CB  C 13  37.600 . . 1 . . . . 20 I CB  . 16254 1 
       95 . 1 1 20 20 ILE CD1 C 13  13.100 . . 1 . . . . 20 I CD1 . 16254 1 
       96 . 1 1 20 20 ILE CG1 C 13  17.800 . . 1 . . . . 20 I CG1 . 16254 1 
       97 . 1 1 20 20 ILE CG2 C 13  26.150 . . 1 . . . . 20 I CG2 . 16254 1 
       98 . 1 1 20 20 ILE N   N 15 123.600 . . 1 . . . . 20 I N   . 16254 1 
       99 . 1 1 21 21 TYR C   C 13 174.300 . . 1 . . . . 21 Y C   . 16254 1 
      100 . 1 1 21 21 TYR CA  C 13  56.700 . . 1 . . . . 21 Y CA  . 16254 1 
      101 . 1 1 21 21 TYR CB  C 13  39.450 . . 1 . . . . 21 Y CB  . 16254 1 
      102 . 1 1 21 21 TYR CG  C 13 128.500 . . 1 . . . . 21 Y CG  . 16254 1 
      103 . 1 1 21 21 TYR N   N 15 125.500 . . 1 . . . . 21 Y N   . 16254 1 
      104 . 1 1 22 22 GLN C   C 13 175.450 . . 1 . . . . 22 Q C   . 16254 1 
      105 . 1 1 22 22 GLN CA  C 13  55.850 . . 1 . . . . 22 Q CA  . 16254 1 
      106 . 1 1 22 22 GLN CB  C 13  25.550 . . 1 . . . . 22 Q CB  . 16254 1 
      107 . 1 1 22 22 GLN CD  C 13 178.200 . . 1 . . . . 22 Q CD  . 16254 1 
      108 . 1 1 22 22 GLN CG  C 13  33.600 . . 1 . . . . 22 Q CG  . 16254 1 
      109 . 1 1 22 22 GLN N   N 15 129.000 . . 1 . . . . 22 Q N   . 16254 1 
      110 . 1 1 23 23 GLY C   C 13 172.000 . . 1 . . . . 23 G C   . 16254 1 
      111 . 1 1 23 23 GLY CA  C 13  45.700 . . 1 . . . . 23 G CA  . 16254 1 
      112 . 1 1 23 23 GLY N   N 15 103.400 . . 1 . . . . 23 G N   . 16254 1 
      113 . 1 1 24 24 ARG C   C 13 173.700 . . 1 . . . . 24 R C   . 16254 1 
      114 . 1 1 24 24 ARG CA  C 13  53.400 . . 1 . . . . 24 R CA  . 16254 1 
      115 . 1 1 24 24 ARG CB  C 13  34.100 . . 1 . . . . 24 R CB  . 16254 1 
      116 . 1 1 24 24 ARG CD  C 13  42.900 . . 1 . . . . 24 R CD  . 16254 1 
      117 . 1 1 24 24 ARG CG  C 13  27.200 . . 1 . . . . 24 R CG  . 16254 1 
      118 . 1 1 24 24 ARG N   N 15 118.400 . . 1 . . . . 24 R N   . 16254 1 
      119 . 1 1 25 25 LEU C   C 13 176.100 . . 1 . . . . 25 L C   . 16254 1 
      120 . 1 1 25 25 LEU CA  C 13  53.350 . . 1 . . . . 25 L CA  . 16254 1 
      121 . 1 1 25 25 LEU CB  C 13  42.900 . . 1 . . . . 25 L CB  . 16254 1 
      122 . 1 1 25 25 LEU CD1 C 13  25.000 . . 2 . . . . 25 L CD1 . 16254 1 
      123 . 1 1 25 25 LEU CD2 C 13  24.100 . . 2 . . . . 25 L CD2 . 16254 1 
      124 . 1 1 25 25 LEU CG  C 13  27.100 . . 1 . . . . 25 L CG  . 16254 1 
      125 . 1 1 25 25 LEU N   N 15 120.200 . . 1 . . . . 25 L N   . 16254 1 
      126 . 1 1 26 26 TRP C   C 13 177.000 . . 1 . . . . 26 W C   . 16254 1 
      127 . 1 1 26 26 TRP CA  C 13  53.750 . . 1 . . . . 26 W CA  . 16254 1 
      128 . 1 1 26 26 TRP CB  C 13  30.700 . . 1 . . . . 26 W CB  . 16254 1 
      129 . 1 1 26 26 TRP N   N 15 120.700 . . 1 . . . . 26 W N   . 16254 1 
      130 . 1 1 27 27 ALA C   C 13 174.700 . . 1 . . . . 27 A C   . 16254 1 
      131 . 1 1 27 27 ALA CA  C 13  52.850 . . 1 . . . . 27 A CA  . 16254 1 
      132 . 1 1 27 27 ALA CB  C 13  18.600 . . 1 . . . . 27 A CB  . 16254 1 
      133 . 1 1 27 27 ALA N   N 15 127.100 . . 1 . . . . 27 A N   . 16254 1 
      134 . 1 1 28 28 PHE CA  C 13  58.350 . . 1 . . . . 28 F CA  . 16254 1 
      135 . 1 1 28 28 PHE CB  C 13  41.550 . . 1 . . . . 28 F CB  . 16254 1 
      136 . 1 1 28 28 PHE CG  C 13 130.900 . . 1 . . . . 28 F CG  . 16254 1 
      137 . 1 1 28 28 PHE N   N 15 123.800 . . 1 . . . . 28 F N   . 16254 1 
      138 . 1 1 29 29 CYS C   C 13 174.400 . . 1 . . . . 29 C C   . 16254 1 
      139 . 1 1 29 29 CYS CA  C 13  54.650 . . 1 . . . . 29 C CA  . 16254 1 
      140 . 1 1 29 29 CYS CB  C 13  40.450 . . 1 . . . . 29 C CB  . 16254 1 
      141 . 1 1 29 29 CYS N   N 15 121.900 . . 1 . . . . 29 C N   . 16254 1 
      142 . 1 1 30 30 CYS C   C 13 179.200 . . 1 . . . . 30 C C   . 16254 1 
      143 . 1 1 30 30 CYS CA  C 13  57.000 . . 1 . . . . 30 C CA  . 16254 1 
      144 . 1 1 30 30 CYS CB  C 13  48.600 . . 1 . . . . 30 C CB  . 16254 1 
      145 . 1 1 30 30 CYS N   N 15 121.100 . . 1 . . . . 30 C N   . 16254 1 

   stop_

save_