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                      11435
   _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-15N HSQC' . . . 11435 1 
      2 '2D 1H-13C HSQC' . . . 11435 1 
      3 '3D HNCACB'      . . . 11435 1 
      4 '3D HCCH-TOCSY'  . . . 11435 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 ASP HA   H  1   4.23 0.01 . 1 . . . .  1 ASP HA   . 11435 1 
        2 . 1 1  1  1 ASP HB2  H  1   2.72 0.01 . 2 . . . .  1 ASP HB2  . 11435 1 
        3 . 1 1  1  1 ASP HB3  H  1   2.84 0.01 . 2 . . . .  1 ASP HB3  . 11435 1 
        4 . 1 1  1  1 ASP CA   C 13  53.7  0.1  . 1 . . . .  1 ASP CA   . 11435 1 
        5 . 1 1  1  1 ASP CB   C 13  40.0  0.1  . 1 . . . .  1 ASP CB   . 11435 1 
        6 . 1 1  2  2 ALA H    H  1   8.79 0.01 . 1 . . . .  2 ALA H    . 11435 1 
        7 . 1 1  2  2 ALA HA   H  1   4.31 0.01 . 1 . . . .  2 ALA HA   . 11435 1 
        8 . 1 1  2  2 ALA HB1  H  1   1.37 0.01 . 1 . . . .  2 ALA MB   . 11435 1 
        9 . 1 1  2  2 ALA HB2  H  1   1.37 0.01 . 1 . . . .  2 ALA MB   . 11435 1 
       10 . 1 1  2  2 ALA HB3  H  1   1.37 0.01 . 1 . . . .  2 ALA MB   . 11435 1 
       11 . 1 1  2  2 ALA CA   C 13  52.7  0.1  . 1 . . . .  2 ALA CA   . 11435 1 
       12 . 1 1  2  2 ALA CB   C 13  19.1  0.1  . 1 . . . .  2 ALA CB   . 11435 1 
       13 . 1 1  2  2 ALA N    N 15 124.3  0.1  . 1 . . . .  2 ALA N    . 11435 1 
       14 . 1 1  3  3 GLU H    H  1   8.57 0.01 . 1 . . . .  3 GLU H    . 11435 1 
       15 . 1 1  3  3 GLU HA   H  1   4.18 0.01 . 1 . . . .  3 GLU HA   . 11435 1 
       16 . 1 1  3  3 GLU HB2  H  1   1.92 0.01 . 5 . . . .  3 GLU HB2  . 11435 1 
       17 . 1 1  3  3 GLU HB3  H  1   2.04 0.01 . 5 . . . .  3 GLU HB3  . 11435 1 
       18 . 1 1  3  3 GLU HG2  H  1   2.14 0.01 . 5 . . . .  3 GLU HG2  . 11435 1 
       19 . 1 1  3  3 GLU HG3  H  1   2.22 0.01 . 5 . . . .  3 GLU HG3  . 11435 1 
       20 . 1 1  3  3 GLU CA   C 13  56.6  0.1  . 1 . . . .  3 GLU CA   . 11435 1 
       21 . 1 1  3  3 GLU CB   C 13  30.2  0.1  . 1 . . . .  3 GLU CB   . 11435 1 
       22 . 1 1  3  3 GLU CG   C 13  36.2  0.1  . 5 . . . .  3 GLU CG   . 11435 1 
       23 . 1 1  3  3 GLU N    N 15 121.0  0.1  . 1 . . . .  3 GLU N    . 11435 1 
       24 . 1 1  4  4 PHE H    H  1   8.44 0.01 . 1 . . . .  4 PHE H    . 11435 1 
       25 . 1 1  4  4 PHE HA   H  1   4.59 0.01 . 1 . . . .  4 PHE HA   . 11435 1 
       26 . 1 1  4  4 PHE HB2  H  1   3.02 0.01 . 2 . . . .  4 PHE HB2  . 11435 1 
       27 . 1 1  4  4 PHE CA   C 13  57.6  0.1  . 1 . . . .  4 PHE CA   . 11435 1 
       28 . 1 1  4  4 PHE CB   C 13  39.5  0.1  . 1 . . . .  4 PHE CB   . 11435 1 
       29 . 1 1  4  4 PHE N    N 15 122.1  0.1  . 1 . . . .  4 PHE N    . 11435 1 
       30 . 1 1  5  5 ARG H    H  1   8.30 0.01 . 1 . . . .  5 ARG H    . 11435 1 
       31 . 1 1  5  5 ARG HA   H  1   4.24 0.01 . 1 . . . .  5 ARG HA   . 11435 1 
       32 . 1 1  5  5 ARG HB2  H  1   1.64 0.01 . 2 . . . .  5 ARG HB2  . 11435 1 
       33 . 1 1  5  5 ARG HB3  H  1   1.73 0.01 . 2 . . . .  5 ARG HB3  . 11435 1 
       34 . 1 1  5  5 ARG HG2  H  1   1.48 0.01 . 2 . . . .  5 ARG HG2  . 11435 1 
       35 . 1 1  5  5 ARG HD2  H  1   3.12 0.01 . 2 . . . .  5 ARG HD2  . 11435 1 
       36 . 1 1  5  5 ARG CA   C 13  55.7  0.1  . 1 . . . .  5 ARG CA   . 11435 1 
       37 . 1 1  5  5 ARG CB   C 13  31.0  0.1  . 1 . . . .  5 ARG CB   . 11435 1 
       38 . 1 1  5  5 ARG CG   C 13  27.0  0.1  . 1 . . . .  5 ARG CG   . 11435 1 
       39 . 1 1  5  5 ARG CD   C 13  43.2  0.1  . 1 . . . .  5 ARG CD   . 11435 1 
       40 . 1 1  5  5 ARG N    N 15 123.9  0.1  . 1 . . . .  5 ARG N    . 11435 1 
       41 . 1 1  6  6 HIS H    H  1   8.61 0.01 . 1 . . . .  6 HIS H    . 11435 1 
       42 . 1 1  6  6 HIS HA   H  1   4.59 0.01 . 1 . . . .  6 HIS HA   . 11435 1 
       43 . 1 1  6  6 HIS HB2  H  1   3.08 0.01 . 5 . . . .  6 HIS HB2  . 11435 1 
       44 . 1 1  6  6 HIS HB3  H  1   3.16 0.01 . 5 . . . .  6 HIS HB3  . 11435 1 
       45 . 1 1  6  6 HIS CA   C 13  55.9  0.1  . 1 . . . .  6 HIS CA   . 11435 1 
       46 . 1 1  6  6 HIS CB   C 13  30.0  0.1  . 1 . . . .  6 HIS CB   . 11435 1 
       47 . 1 1  6  6 HIS N    N 15 121.4  0.1  . 1 . . . .  6 HIS N    . 11435 1 
       48 . 1 1  7  7 ASP H    H  1   8.53 0.01 . 1 . . . .  7 ASP H    . 11435 1 
       49 . 1 1  7  7 ASP HA   H  1   4.65 0.01 . 1 . . . .  7 ASP HA   . 11435 1 
       50 . 1 1  7  7 ASP HB2  H  1   2.70 0.01 . 5 . . . .  7 ASP HB2  . 11435 1 
       51 . 1 1  7  7 ASP CA   C 13  54.1  0.1  . 1 . . . .  7 ASP CA   . 11435 1 
       52 . 1 1  7  7 ASP CB   C 13  41.2  0.1  . 1 . . . .  7 ASP CB   . 11435 1 
       53 . 1 1  7  7 ASP N    N 15 122.1  0.1  . 1 . . . .  7 ASP N    . 11435 1 
       54 . 1 1  8  8 SER H    H  1   8.60 0.01 . 1 . . . .  8 SER H    . 11435 1 
       55 . 1 1  8  8 SER HA   H  1   4.40 0.01 . 1 . . . .  8 SER HA   . 11435 1 
       56 . 1 1  8  8 SER HB2  H  1   3.90 0.01 . 5 . . . .  8 SER HB2  . 11435 1 
       57 . 1 1  8  8 SER CA   C 13  59.2  0.1  . 1 . . . .  8 SER CA   . 11435 1 
       58 . 1 1  8  8 SER CB   C 13  63.6  0.1  . 1 . . . .  8 SER CB   . 11435 1 
       59 . 1 1  8  8 SER N    N 15 117.1  0.1  . 1 . . . .  8 SER N    . 11435 1 
       60 . 1 1  9  9 GLY H    H  1   8.68 0.01 . 1 . . . .  9 GLY H    . 11435 1 
       61 . 1 1  9  9 GLY HA2  H  1   3.93 0.01 . 2 . . . .  9 GLY HA2  . 11435 1 
       62 . 1 1  9  9 GLY CA   C 13  45.4  0.1  . 1 . . . .  9 GLY CA   . 11435 1 
       63 . 1 1  9  9 GLY N    N 15 111.2  0.1  . 1 . . . .  9 GLY N    . 11435 1 
       64 . 1 1 10 10 TYR H    H  1   8.07 0.01 . 1 . . . . 10 TYR H    . 11435 1 
       65 . 1 1 10 10 TYR HA   H  1   4.51 0.01 . 1 . . . . 10 TYR HA   . 11435 1 
       66 . 1 1 10 10 TYR HB2  H  1   2.97 0.01 . 2 . . . . 10 TYR HB2  . 11435 1 
       67 . 1 1 10 10 TYR HB3  H  1   3.01 0.01 . 2 . . . . 10 TYR HB3  . 11435 1 
       68 . 1 1 10 10 TYR CA   C 13  58.4  0.1  . 1 . . . . 10 TYR CA   . 11435 1 
       69 . 1 1 10 10 TYR CB   C 13  38.8  0.1  . 1 . . . . 10 TYR CB   . 11435 1 
       70 . 1 1 10 10 TYR N    N 15 120.6  0.1  . 1 . . . . 10 TYR N    . 11435 1 
       71 . 1 1 11 11 GLU H    H  1   8.49 0.01 . 1 . . . . 11 GLU H    . 11435 1 
       72 . 1 1 11 11 GLU HA   H  1   4.21 0.01 . 1 . . . . 11 GLU HA   . 11435 1 
       73 . 1 1 11 11 GLU HB2  H  1   1.92 0.01 . 5 . . . . 11 GLU HB2  . 11435 1 
       74 . 1 1 11 11 GLU HB3  H  1   2.04 0.01 . 5 . . . . 11 GLU HB3  . 11435 1 
       75 . 1 1 11 11 GLU HG2  H  1   2.14 0.01 . 5 . . . . 11 GLU HG2  . 11435 1 
       76 . 1 1 11 11 GLU HG3  H  1   2.22 0.01 . 5 . . . . 11 GLU HG3  . 11435 1 
       77 . 1 1 11 11 GLU CA   C 13  56.5  0.1  . 1 . . . . 11 GLU CA   . 11435 1 
       78 . 1 1 11 11 GLU CB   C 13  30.3  0.1  . 1 . . . . 11 GLU CB   . 11435 1 
       79 . 1 1 11 11 GLU CG   C 13  36.2  0.1  . 5 . . . . 11 GLU CG   . 11435 1 
       80 . 1 1 11 11 GLU N    N 15 123.0  0.1  . 1 . . . . 11 GLU N    . 11435 1 
       81 . 1 1 12 12 VAL H    H  1   8.21 0.01 . 1 . . . . 12 VAL H    . 11435 1 
       82 . 1 1 12 12 VAL HA   H  1   3.93 0.01 . 1 . . . . 12 VAL HA   . 11435 1 
       83 . 1 1 12 12 VAL HB   H  1   1.93 0.01 . 1 . . . . 12 VAL HB   . 11435 1 
       84 . 1 1 12 12 VAL HG11 H  1   0.77 0.01 . 2 . . . . 12 VAL MG1  . 11435 1 
       85 . 1 1 12 12 VAL HG12 H  1   0.77 0.01 . 2 . . . . 12 VAL MG1  . 11435 1 
       86 . 1 1 12 12 VAL HG13 H  1   0.77 0.01 . 2 . . . . 12 VAL MG1  . 11435 1 
       87 . 1 1 12 12 VAL HG21 H  1   0.88 0.01 . 2 . . . . 12 VAL MG2  . 11435 1 
       88 . 1 1 12 12 VAL HG22 H  1   0.88 0.01 . 2 . . . . 12 VAL MG2  . 11435 1 
       89 . 1 1 12 12 VAL HG23 H  1   0.88 0.01 . 2 . . . . 12 VAL MG2  . 11435 1 
       90 . 1 1 12 12 VAL CA   C 13  62.8  0.1  . 1 . . . . 12 VAL CA   . 11435 1 
       91 . 1 1 12 12 VAL CB   C 13  32.5  0.1  . 1 . . . . 12 VAL CB   . 11435 1 
       92 . 1 1 12 12 VAL CG1  C 13  20.8  0.1  . 2 . . . . 12 VAL CG1  . 11435 1 
       93 . 1 1 12 12 VAL N    N 15 121.8  0.1  . 1 . . . . 12 VAL N    . 11435 1 
       94 . 1 1 13 13 HIS H    H  1   8.49 0.01 . 1 . . . . 13 HIS H    . 11435 1 
       95 . 1 1 13 13 HIS HA   H  1   4.66 0.01 . 1 . . . . 13 HIS HA   . 11435 1 
       96 . 1 1 13 13 HIS HB2  H  1   3.05 0.01 . 2 . . . . 13 HIS HB2  . 11435 1 
       97 . 1 1 13 13 HIS HB3  H  1   3.12 0.01 . 2 . . . . 13 HIS HB3  . 11435 1 
       98 . 1 1 13 13 HIS CA   C 13  55.7  0.1  . 1 . . . . 13 HIS CA   . 11435 1 
       99 . 1 1 13 13 HIS CB   C 13  29.9  0.1  . 1 . . . . 13 HIS CB   . 11435 1 
      100 . 1 1 13 13 HIS N    N 15 122.7  0.1  . 1 . . . . 13 HIS N    . 11435 1 
      101 . 1 1 14 14 HIS H    H  1   8.53 0.01 . 1 . . . . 14 HIS H    . 11435 1 
      102 . 1 1 14 14 HIS HA   H  1   4.60 0.01 . 1 . . . . 14 HIS HA   . 11435 1 
      103 . 1 1 14 14 HIS HB2  H  1   3.08 0.01 . 5 . . . . 14 HIS HB2  . 11435 1 
      104 . 1 1 14 14 HIS HB3  H  1   3.16 0.01 . 5 . . . . 14 HIS HB3  . 11435 1 
      105 . 1 1 14 14 HIS CA   C 13  55.9  0.1  . 1 . . . . 14 HIS CA   . 11435 1 
      106 . 1 1 14 14 HIS CB   C 13  29.9  0.1  . 1 . . . . 14 HIS CB   . 11435 1 
      107 . 1 1 14 14 HIS N    N 15 121.3  0.1  . 1 . . . . 14 HIS N    . 11435 1 
      108 . 1 1 15 15 GLN H    H  1   8.62 0.01 . 1 . . . . 15 GLN H    . 11435 1 
      109 . 1 1 15 15 GLN HA   H  1   4.29 0.01 . 1 . . . . 15 GLN HA   . 11435 1 
      110 . 1 1 15 15 GLN HB2  H  1   1.98 0.01 . 2 . . . . 15 GLN HB2  . 11435 1 
      111 . 1 1 15 15 GLN HB3  H  1   2.06 0.01 . 2 . . . . 15 GLN HB3  . 11435 1 
      112 . 1 1 15 15 GLN HG2  H  1   2.35 0.01 . 2 . . . . 15 GLN HG2  . 11435 1 
      113 . 1 1 15 15 GLN CA   C 13  55.9  0.1  . 1 . . . . 15 GLN CA   . 11435 1 
      114 . 1 1 15 15 GLN CB   C 13  29.5  0.1  . 1 . . . . 15 GLN CB   . 11435 1 
      115 . 1 1 15 15 GLN CG   C 13  33.7  0.1  . 1 . . . . 15 GLN CG   . 11435 1 
      116 . 1 1 15 15 GLN N    N 15 122.1  0.1  . 1 . . . . 15 GLN N    . 11435 1 
      117 . 1 1 16 16 LYS H    H  1   8.58 0.01 . 1 . . . . 16 LYS H    . 11435 1 
      118 . 1 1 16 16 LYS HA   H  1   4.29 0.01 . 1 . . . . 16 LYS HA   . 11435 1 
      119 . 1 1 16 16 LYS HB2  H  1   1.78 0.01 . 2 . . . . 16 LYS HB2  . 11435 1 
      120 . 1 1 16 16 LYS HG2  H  1   1.40 0.01 . 5 . . . . 16 LYS HG2  . 11435 1 
      121 . 1 1 16 16 LYS HG3  H  1   1.46 0.01 . 5 . . . . 16 LYS HG3  . 11435 1 
      122 . 1 1 16 16 LYS HD2  H  1   1.68 0.01 . 5 . . . . 16 LYS HD2  . 11435 1 
      123 . 1 1 16 16 LYS HD3  H  1   1.78 0.01 . 5 . . . . 16 LYS HD3  . 11435 1 
      124 . 1 1 16 16 LYS HE2  H  1   2.98 0.01 . 5 . . . . 16 LYS HE2  . 11435 1 
      125 . 1 1 16 16 LYS CA   C 13  56.4  0.1  . 1 . . . . 16 LYS CA   . 11435 1 
      126 . 1 1 16 16 LYS CB   C 13  33.0  0.1  . 1 . . . . 16 LYS CB   . 11435 1 
      127 . 1 1 16 16 LYS CG   C 13  24.8  0.1  . 5 . . . . 16 LYS CG   . 11435 1 
      128 . 1 1 16 16 LYS CD   C 13  29.1  0.1  . 5 . . . . 16 LYS CD   . 11435 1 
      129 . 1 1 16 16 LYS CE   C 13  42.0  0.1  . 5 . . . . 16 LYS CE   . 11435 1 
      130 . 1 1 16 16 LYS N    N 15 123.9  0.1  . 1 . . . . 16 LYS N    . 11435 1 
      131 . 1 1 17 17 LEU H    H  1   8.43 0.01 . 1 . . . . 17 LEU H    . 11435 1 
      132 . 1 1 17 17 LEU HA   H  1   4.34 0.01 . 1 . . . . 17 LEU HA   . 11435 1 
      133 . 1 1 17 17 LEU HB2  H  1   1.44 0.01 . 5 . . . . 17 LEU HB2  . 11435 1 
      134 . 1 1 17 17 LEU HG   H  1   1.60 0.01 . 5 . . . . 17 LEU HG   . 11435 1 
      135 . 1 1 17 17 LEU HD11 H  1   0.86 0.01 . 5 . . . . 17 LEU MD1  . 11435 1 
      136 . 1 1 17 17 LEU HD12 H  1   0.86 0.01 . 5 . . . . 17 LEU MD1  . 11435 1 
      137 . 1 1 17 17 LEU HD13 H  1   0.86 0.01 . 5 . . . . 17 LEU MD1  . 11435 1 
      138 . 1 1 17 17 LEU HD21 H  1   0.92 0.01 . 5 . . . . 17 LEU MD2  . 11435 1 
      139 . 1 1 17 17 LEU HD22 H  1   0.92 0.01 . 5 . . . . 17 LEU MD2  . 11435 1 
      140 . 1 1 17 17 LEU HD23 H  1   0.92 0.01 . 5 . . . . 17 LEU MD2  . 11435 1 
      141 . 1 1 17 17 LEU CA   C 13  55.1  0.1  . 1 . . . . 17 LEU CA   . 11435 1 
      142 . 1 1 17 17 LEU CB   C 13  42.3  0.1  . 1 . . . . 17 LEU CB   . 11435 1 
      143 . 1 1 17 17 LEU CG   C 13  26.9  0.1  . 1 . . . . 17 LEU CG   . 11435 1 
      144 . 1 1 17 17 LEU CD1  C 13  23.6  0.1  . 5 . . . . 17 LEU CD1  . 11435 1 
      145 . 1 1 17 17 LEU CD2  C 13  24.8  0.1  . 5 . . . . 17 LEU CD2  . 11435 1 
      146 . 1 1 17 17 LEU N    N 15 124.6  0.1  . 1 . . . . 17 LEU N    . 11435 1 
      147 . 1 1 18 18 VAL H    H  1   8.16 0.01 . 1 . . . . 18 VAL H    . 11435 1 
      148 . 1 1 18 18 VAL HA   H  1   4.04 0.01 . 1 . . . . 18 VAL HA   . 11435 1 
      149 . 1 1 18 18 VAL HB   H  1   1.90 0.01 . 1 . . . . 18 VAL HB   . 11435 1 
      150 . 1 1 18 18 VAL HG11 H  1   0.75 0.01 . 2 . . . . 18 VAL MG1  . 11435 1 
      151 . 1 1 18 18 VAL HG12 H  1   0.75 0.01 . 2 . . . . 18 VAL MG1  . 11435 1 
      152 . 1 1 18 18 VAL HG13 H  1   0.75 0.01 . 2 . . . . 18 VAL MG1  . 11435 1 
      153 . 1 1 18 18 VAL HG21 H  1   0.84 0.01 . 2 . . . . 18 VAL MG2  . 11435 1 
      154 . 1 1 18 18 VAL HG22 H  1   0.84 0.01 . 2 . . . . 18 VAL MG2  . 11435 1 
      155 . 1 1 18 18 VAL HG23 H  1   0.84 0.01 . 2 . . . . 18 VAL MG2  . 11435 1 
      156 . 1 1 18 18 VAL CA   C 13  62.0  0.1  . 1 . . . . 18 VAL CA   . 11435 1 
      157 . 1 1 18 18 VAL CB   C 13  33.1  0.1  . 1 . . . . 18 VAL CB   . 11435 1 
      158 . 1 1 18 18 VAL CG1  C 13  21.2  0.1  . 2 . . . . 18 VAL CG1  . 11435 1 
      159 . 1 1 18 18 VAL CG2  C 13  20.6  0.1  . 2 . . . . 18 VAL CG2  . 11435 1 
      160 . 1 1 18 18 VAL N    N 15 122.1  0.1  . 1 . . . . 18 VAL N    . 11435 1 
      161 . 1 1 19 19 PHE H    H  1   8.42 0.01 . 1 . . . . 19 PHE H    . 11435 1 
      162 . 1 1 19 19 PHE HA   H  1   4.60 0.01 . 1 . . . . 19 PHE HA   . 11435 1 
      163 . 1 1 19 19 PHE HB2  H  1   2.92 0.01 . 5 . . . . 19 PHE HB2  . 11435 1 
      164 . 1 1 19 19 PHE HB3  H  1   3.07 0.01 . 5 . . . . 19 PHE HB3  . 11435 1 
      165 . 1 1 19 19 PHE CA   C 13  57.5  0.1  . 1 . . . . 19 PHE CA   . 11435 1 
      166 . 1 1 19 19 PHE CB   C 13  40.2  0.1  . 1 . . . . 19 PHE CB   . 11435 1 
      167 . 1 1 19 19 PHE N    N 15 125.0  0.1  . 1 . . . . 19 PHE N    . 11435 1 
      168 . 1 1 20 20 PHE H    H  1   8.36 0.01 . 1 . . . . 20 PHE H    . 11435 1 
      169 . 1 1 20 20 PHE HA   H  1   4.58 0.01 . 1 . . . . 20 PHE HA   . 11435 1 
      170 . 1 1 20 20 PHE HB2  H  1   2.92 0.01 . 5 . . . . 20 PHE HB2  . 11435 1 
      171 . 1 1 20 20 PHE HB3  H  1   3.07 0.01 . 5 . . . . 20 PHE HB3  . 11435 1 
      172 . 1 1 20 20 PHE CA   C 13  57.4  0.1  . 1 . . . . 20 PHE CA   . 11435 1 
      173 . 1 1 20 20 PHE CB   C 13  40.1  0.1  . 1 . . . . 20 PHE CB   . 11435 1 
      174 . 1 1 20 20 PHE N    N 15 123.5  0.1  . 1 . . . . 20 PHE N    . 11435 1 
      175 . 1 1 21 21 ALA H    H  1   8.38 0.01 . 1 . . . . 21 ALA H    . 11435 1 
      176 . 1 1 21 21 ALA HA   H  1   4.23 0.01 . 1 . . . . 21 ALA HA   . 11435 1 
      177 . 1 1 21 21 ALA HB1  H  1   1.37 0.01 . 1 . . . . 21 ALA MB   . 11435 1 
      178 . 1 1 21 21 ALA HB2  H  1   1.37 0.01 . 1 . . . . 21 ALA MB   . 11435 1 
      179 . 1 1 21 21 ALA HB3  H  1   1.37 0.01 . 1 . . . . 21 ALA MB   . 11435 1 
      180 . 1 1 21 21 ALA CA   C 13  52.4  0.1  . 1 . . . . 21 ALA CA   . 11435 1 
      181 . 1 1 21 21 ALA CB   C 13  19.4  0.1  . 1 . . . . 21 ALA CB   . 11435 1 
      182 . 1 1 21 21 ALA N    N 15 126.7  0.1  . 1 . . . . 21 ALA N    . 11435 1 
      183 . 1 1 22 22 GLU H    H  1   8.50 0.01 . 1 . . . . 22 GLU H    . 11435 1 
      184 . 1 1 22 22 GLU HA   H  1   4.21 0.01 . 1 . . . . 22 GLU HA   . 11435 1 
      185 . 1 1 22 22 GLU HB2  H  1   1.92 0.01 . 5 . . . . 22 GLU HB2  . 11435 1 
      186 . 1 1 22 22 GLU HB3  H  1   2.04 0.01 . 5 . . . . 22 GLU HB3  . 11435 1 
      187 . 1 1 22 22 GLU HG2  H  1   2.14 0.01 . 5 . . . . 22 GLU HG2  . 11435 1 
      188 . 1 1 22 22 GLU HG3  H  1   2.22 0.01 . 5 . . . . 22 GLU HG3  . 11435 1 
      189 . 1 1 22 22 GLU CA   C 13  56.6  0.1  . 1 . . . . 22 GLU CA   . 11435 1 
      190 . 1 1 22 22 GLU CB   C 13  30.3  0.1  . 1 . . . . 22 GLU CB   . 11435 1 
      191 . 1 1 22 22 GLU CG   C 13  36.2  0.1  . 5 . . . . 22 GLU CG   . 11435 1 
      192 . 1 1 22 22 GLU N    N 15 120.4  0.1  . 1 . . . . 22 GLU N    . 11435 1 
      193 . 1 1 23 23 ASP H    H  1   8.56 0.01 . 1 . . . . 23 ASP H    . 11435 1 
      194 . 1 1 23 23 ASP HA   H  1   4.66 0.01 . 1 . . . . 23 ASP HA   . 11435 1 
      195 . 1 1 23 23 ASP HB2  H  1   2.70 0.01 . 5 . . . . 23 ASP HB2  . 11435 1 
      196 . 1 1 23 23 ASP CA   C 13  54.2  0.1  . 1 . . . . 23 ASP CA   . 11435 1 
      197 . 1 1 23 23 ASP CB   C 13  41.1  0.1  . 1 . . . . 23 ASP CB   . 11435 1 
      198 . 1 1 23 23 ASP N    N 15 122.2  0.1  . 1 . . . . 23 ASP N    . 11435 1 
      199 . 1 1 24 24 VAL H    H  1   8.30 0.01 . 1 . . . . 24 VAL H    . 11435 1 
      200 . 1 1 24 24 VAL HA   H  1   4.15 0.01 . 1 . . . . 24 VAL HA   . 11435 1 
      201 . 1 1 24 24 VAL HB   H  1   2.19 0.01 . 1 . . . . 24 VAL HB   . 11435 1 
      202 . 1 1 24 24 VAL HG11 H  1   0.95 0.01 . 5 . . . . 24 VAL MG1  . 11435 1 
      203 . 1 1 24 24 VAL HG12 H  1   0.95 0.01 . 5 . . . . 24 VAL MG1  . 11435 1 
      204 . 1 1 24 24 VAL HG13 H  1   0.95 0.01 . 5 . . . . 24 VAL MG1  . 11435 1 
      205 . 1 1 24 24 VAL CA   C 13  62.8  0.1  . 1 . . . . 24 VAL CA   . 11435 1 
      206 . 1 1 24 24 VAL CB   C 13  32.3  0.1  . 1 . . . . 24 VAL CB   . 11435 1 
      207 . 1 1 24 24 VAL CG1  C 13  20.8  0.1  . 5 . . . . 24 VAL CG1  . 11435 1 
      208 . 1 1 24 24 VAL N    N 15 121.1  0.1  . 1 . . . . 24 VAL N    . 11435 1 
      209 . 1 1 25 25 GLY H    H  1   8.68 0.01 . 1 . . . . 25 GLY H    . 11435 1 
      210 . 1 1 25 25 GLY HA2  H  1   3.99 0.01 . 2 . . . . 25 GLY HA2  . 11435 1 
      211 . 1 1 25 25 GLY CA   C 13  45.5  0.1  . 1 . . . . 25 GLY CA   . 11435 1 
      212 . 1 1 25 25 GLY N    N 15 112.3  0.1  . 1 . . . . 25 GLY N    . 11435 1 
      213 . 1 1 26 26 SER H    H  1   8.30 0.01 . 1 . . . . 26 SER H    . 11435 1 
      214 . 1 1 26 26 SER HA   H  1   4.43 0.01 . 1 . . . . 26 SER HA   . 11435 1 
      215 . 1 1 26 26 SER HB2  H  1   3.90 0.01 . 5 . . . . 26 SER HB2  . 11435 1 
      216 . 1 1 26 26 SER CA   C 13  58.6  0.1  . 1 . . . . 26 SER CA   . 11435 1 
      217 . 1 1 26 26 SER CB   C 13  63.7  0.1  . 1 . . . . 26 SER CB   . 11435 1 
      218 . 1 1 26 26 SER N    N 15 116.0  0.1  . 1 . . . . 26 SER N    . 11435 1 
      219 . 1 1 27 27 ASN H    H  1   8.62 0.01 . 1 . . . . 27 ASN H    . 11435 1 
      220 . 1 1 27 27 ASN HA   H  1   4.75 0.01 . 1 . . . . 27 ASN HA   . 11435 1 
      221 . 1 1 27 27 ASN HB2  H  1   2.81 0.01 . 2 . . . . 27 ASN HB2  . 11435 1 
      222 . 1 1 27 27 ASN HB3  H  1   2.87 0.01 . 2 . . . . 27 ASN HB3  . 11435 1 
      223 . 1 1 27 27 ASN CA   C 13  53.3  0.1  . 1 . . . . 27 ASN CA   . 11435 1 
      224 . 1 1 27 27 ASN CB   C 13  38.5  0.1  . 1 . . . . 27 ASN CB   . 11435 1 
      225 . 1 1 27 27 ASN N    N 15 121.0  0.1  . 1 . . . . 27 ASN N    . 11435 1 
      226 . 1 1 28 28 LYS H    H  1   8.49 0.01 . 1 . . . . 28 LYS H    . 11435 1 
      227 . 1 1 28 28 LYS HA   H  1   4.28 0.01 . 1 . . . . 28 LYS HA   . 11435 1 
      228 . 1 1 28 28 LYS HB2  H  1   1.89 0.01 . 2 . . . . 28 LYS HB2  . 11435 1 
      229 . 1 1 28 28 LYS HG2  H  1   1.40 0.01 . 5 . . . . 28 LYS HG2  . 11435 1 
      230 . 1 1 28 28 LYS HG3  H  1   1.46 0.01 . 5 . . . . 28 LYS HG3  . 11435 1 
      231 . 1 1 28 28 LYS HD2  H  1   1.68 0.01 . 5 . . . . 28 LYS HD2  . 11435 1 
      232 . 1 1 28 28 LYS HD3  H  1   1.78 0.01 . 5 . . . . 28 LYS HD3  . 11435 1 
      233 . 1 1 28 28 LYS HE2  H  1   2.98 0.01 . 5 . . . . 28 LYS HE2  . 11435 1 
      234 . 1 1 28 28 LYS CA   C 13  56.8  0.1  . 1 . . . . 28 LYS CA   . 11435 1 
      235 . 1 1 28 28 LYS CB   C 13  32.5  0.1  . 1 . . . . 28 LYS CB   . 11435 1 
      236 . 1 1 28 28 LYS CG   C 13  24.8  0.1  . 5 . . . . 28 LYS CG   . 11435 1 
      237 . 1 1 28 28 LYS CD   C 13  32.8  0.1  . 5 . . . . 28 LYS CD   . 11435 1 
      238 . 1 1 28 28 LYS CE   C 13  42.0  0.1  . 5 . . . . 28 LYS CE   . 11435 1 
      239 . 1 1 28 28 LYS N    N 15 122.2  0.1  . 1 . . . . 28 LYS N    . 11435 1 
      240 . 1 1 29 29 GLY H    H  1   8.56 0.01 . 1 . . . . 29 GLY H    . 11435 1 
      241 . 1 1 29 29 GLY HA2  H  1   3.94 0.01 . 2 . . . . 29 GLY HA2  . 11435 1 
      242 . 1 1 29 29 GLY CA   C 13  45.2  0.1  . 1 . . . . 29 GLY CA   . 11435 1 
      243 . 1 1 29 29 GLY N    N 15 110.0  0.1  . 1 . . . . 29 GLY N    . 11435 1 
      244 . 1 1 30 30 ALA H    H  1   8.16 0.01 . 1 . . . . 30 ALA H    . 11435 1 
      245 . 1 1 30 30 ALA HA   H  1   4.32 0.01 . 1 . . . . 30 ALA HA   . 11435 1 
      246 . 1 1 30 30 ALA HB1  H  1   1.36 0.01 . 1 . . . . 30 ALA MB   . 11435 1 
      247 . 1 1 30 30 ALA HB2  H  1   1.36 0.01 . 1 . . . . 30 ALA MB   . 11435 1 
      248 . 1 1 30 30 ALA HB3  H  1   1.36 0.01 . 1 . . . . 30 ALA MB   . 11435 1 
      249 . 1 1 30 30 ALA CA   C 13  52.5  0.1  . 1 . . . . 30 ALA CA   . 11435 1 
      250 . 1 1 30 30 ALA CB   C 13  19.3  0.1  . 1 . . . . 30 ALA CB   . 11435 1 
      251 . 1 1 30 30 ALA N    N 15 124.0  0.1  . 1 . . . . 30 ALA N    . 11435 1 
      252 . 1 1 31 31 ILE H    H  1   8.33 0.01 . 1 . . . . 31 ILE H    . 11435 1 
      253 . 1 1 31 31 ILE HA   H  1   4.16 0.01 . 1 . . . . 31 ILE HA   . 11435 1 
      254 . 1 1 31 31 ILE HB   H  1   1.86 0.01 . 5 . . . . 31 ILE HB   . 11435 1 
      255 . 1 1 31 31 ILE HG12 H  1   1.20 0.01 . 5 . . . . 31 ILE HG12 . 11435 1 
      256 . 1 1 31 31 ILE HG13 H  1   1.51 0.01 . 5 . . . . 31 ILE HG13 . 11435 1 
      257 . 1 1 31 31 ILE HG21 H  1   0.92 0.01 . 5 . . . . 31 ILE MG   . 11435 1 
      258 . 1 1 31 31 ILE HG22 H  1   0.92 0.01 . 5 . . . . 31 ILE MG   . 11435 1 
      259 . 1 1 31 31 ILE HG23 H  1   0.92 0.01 . 5 . . . . 31 ILE MG   . 11435 1 
      260 . 1 1 31 31 ILE HD11 H  1   0.87 0.01 . 5 . . . . 31 ILE MD   . 11435 1 
      261 . 1 1 31 31 ILE HD12 H  1   0.87 0.01 . 5 . . . . 31 ILE MD   . 11435 1 
      262 . 1 1 31 31 ILE HD13 H  1   0.87 0.01 . 5 . . . . 31 ILE MD   . 11435 1 
      263 . 1 1 31 31 ILE CA   C 13  61.1  0.1  . 1 . . . . 31 ILE CA   . 11435 1 
      264 . 1 1 31 31 ILE CB   C 13  38.4  0.1  . 1 . . . . 31 ILE CB   . 11435 1 
      265 . 1 1 31 31 ILE CG1  C 13  27.3  0.1  . 5 . . . . 31 ILE CG1  . 11435 1 
      266 . 1 1 31 31 ILE CG2  C 13  17.4  0.1  . 5 . . . . 31 ILE CG2  . 11435 1 
      267 . 1 1 31 31 ILE CD1  C 13  12.6  0.1  . 5 . . . . 31 ILE CD1  . 11435 1 
      268 . 1 1 31 31 ILE N    N 15 121.3  0.1  . 1 . . . . 31 ILE N    . 11435 1 
      269 . 1 1 32 32 ILE H    H  1   8.43 0.01 . 1 . . . . 32 ILE H    . 11435 1 
      270 . 1 1 32 32 ILE HA   H  1   4.17 0.01 . 1 . . . . 32 ILE HA   . 11435 1 
      271 . 1 1 32 32 ILE HB   H  1   1.86 0.01 . 5 . . . . 32 ILE HB   . 11435 1 
      272 . 1 1 32 32 ILE HG12 H  1   1.20 0.01 . 5 . . . . 32 ILE HG12 . 11435 1 
      273 . 1 1 32 32 ILE HG13 H  1   1.51 0.01 . 5 . . . . 32 ILE HG13 . 11435 1 
      274 . 1 1 32 32 ILE HG21 H  1   0.92 0.01 . 5 . . . . 32 ILE MG   . 11435 1 
      275 . 1 1 32 32 ILE HG22 H  1   0.92 0.01 . 5 . . . . 32 ILE MG   . 11435 1 
      276 . 1 1 32 32 ILE HG23 H  1   0.92 0.01 . 5 . . . . 32 ILE MG   . 11435 1 
      277 . 1 1 32 32 ILE HD11 H  1   0.87 0.01 . 5 . . . . 32 ILE MD   . 11435 1 
      278 . 1 1 32 32 ILE HD12 H  1   0.87 0.01 . 5 . . . . 32 ILE MD   . 11435 1 
      279 . 1 1 32 32 ILE HD13 H  1   0.87 0.01 . 5 . . . . 32 ILE MD   . 11435 1 
      280 . 1 1 32 32 ILE CA   C 13  61.2  0.1  . 1 . . . . 32 ILE CA   . 11435 1 
      281 . 1 1 32 32 ILE CB   C 13  38.4  0.1  . 1 . . . . 32 ILE CB   . 11435 1 
      282 . 1 1 32 32 ILE CG1  C 13  27.3  0.1  . 5 . . . . 32 ILE CG1  . 11435 1 
      283 . 1 1 32 32 ILE CG2  C 13  17.4  0.1  . 5 . . . . 32 ILE CG2  . 11435 1 
      284 . 1 1 32 32 ILE CD1  C 13  12.6  0.1  . 5 . . . . 32 ILE CD1  . 11435 1 
      285 . 1 1 32 32 ILE N    N 15 126.8  0.1  . 1 . . . . 32 ILE N    . 11435 1 
      286 . 1 1 33 33 GLY H    H  1   8.62 0.01 . 1 . . . . 33 GLY H    . 11435 1 
      287 . 1 1 33 33 GLY HA2  H  1   3.95 0.01 . 2 . . . . 33 GLY HA2  . 11435 1 
      288 . 1 1 33 33 GLY CA   C 13  45.2  0.1  . 1 . . . . 33 GLY CA   . 11435 1 
      289 . 1 1 33 33 GLY N    N 15 113.6  0.1  . 1 . . . . 33 GLY N    . 11435 1 
      290 . 1 1 34 34 LEU H    H  1   8.19 0.01 . 1 . . . . 34 LEU H    . 11435 1 
      291 . 1 1 34 34 LEU HA   H  1   4.35 0.01 . 1 . . . . 34 LEU HA   . 11435 1 
      292 . 1 1 34 34 LEU HB2  H  1   1.44 0.01 . 5 . . . . 34 LEU HB2  . 11435 1 
      293 . 1 1 34 34 LEU HG   H  1   1.60 0.01 . 5 . . . . 34 LEU HG   . 11435 1 
      294 . 1 1 34 34 LEU HD11 H  1   0.86 0.01 . 5 . . . . 34 LEU MD1  . 11435 1 
      295 . 1 1 34 34 LEU HD12 H  1   0.86 0.01 . 5 . . . . 34 LEU MD1  . 11435 1 
      296 . 1 1 34 34 LEU HD13 H  1   0.86 0.01 . 5 . . . . 34 LEU MD1  . 11435 1 
      297 . 1 1 34 34 LEU HD21 H  1   0.92 0.01 . 5 . . . . 34 LEU MD2  . 11435 1 
      298 . 1 1 34 34 LEU HD22 H  1   0.92 0.01 . 5 . . . . 34 LEU MD2  . 11435 1 
      299 . 1 1 34 34 LEU HD23 H  1   0.92 0.01 . 5 . . . . 34 LEU MD2  . 11435 1 
      300 . 1 1 34 34 LEU CA   C 13  55.2  0.1  . 1 . . . . 34 LEU CA   . 11435 1 
      301 . 1 1 34 34 LEU CB   C 13  42.5  0.1  . 1 . . . . 34 LEU CB   . 11435 1 
      302 . 1 1 34 34 LEU CG   C 13  26.9  0.1  . 1 . . . . 34 LEU CG   . 11435 1 
      303 . 1 1 34 34 LEU CD1  C 13  23.6  0.1  . 5 . . . . 34 LEU CD1  . 11435 1 
      304 . 1 1 34 34 LEU CD2  C 13  24.8  0.1  . 5 . . . . 34 LEU CD2  . 11435 1 
      305 . 1 1 34 34 LEU N    N 15 122.1  0.1  . 1 . . . . 34 LEU N    . 11435 1 
      306 . 1 1 35 35 MET H    H  1   8.59 0.01 . 1 . . . . 35 MET H    . 11435 1 
      307 . 1 1 35 35 MET HA   H  1   4.54 0.01 . 1 . . . . 35 MET HA   . 11435 1 
      308 . 1 1 35 35 MET HB2  H  1   2.03 0.01 . 2 . . . . 35 MET HB2  . 11435 1 
      309 . 1 1 35 35 MET HG2  H  1   2.51 0.01 . 2 . . . . 35 MET HG2  . 11435 1 
      310 . 1 1 35 35 MET HG3  H  1   2.59 0.01 . 2 . . . . 35 MET HG3  . 11435 1 
      311 . 1 1 35 35 MET CA   C 13  55.3  0.1  . 1 . . . . 35 MET CA   . 11435 1 
      312 . 1 1 35 35 MET CB   C 13  32.6  0.1  . 1 . . . . 35 MET CB   . 11435 1 
      313 . 1 1 35 35 MET CG   C 13  31.9  0.1  . 1 . . . . 35 MET CG   . 11435 1 
      314 . 1 1 35 35 MET N    N 15 122.4  0.1  . 1 . . . . 35 MET N    . 11435 1 
      315 . 1 1 36 36 VAL H    H  1   8.39 0.01 . 1 . . . . 36 VAL H    . 11435 1 
      316 . 1 1 36 36 VAL HA   H  1   4.13 0.01 . 1 . . . . 36 VAL HA   . 11435 1 
      317 . 1 1 36 36 VAL HB   H  1   2.08 0.01 . 1 . . . . 36 VAL HB   . 11435 1 
      318 . 1 1 36 36 VAL HG11 H  1   0.95 0.01 . 5 . . . . 36 VAL MG1  . 11435 1 
      319 . 1 1 36 36 VAL HG12 H  1   0.95 0.01 . 5 . . . . 36 VAL MG1  . 11435 1 
      320 . 1 1 36 36 VAL HG13 H  1   0.95 0.01 . 5 . . . . 36 VAL MG1  . 11435 1 
      321 . 1 1 36 36 VAL CA   C 13  62.7  0.1  . 1 . . . . 36 VAL CA   . 11435 1 
      322 . 1 1 36 36 VAL CB   C 13  32.7  0.1  . 1 . . . . 36 VAL CB   . 11435 1 
      323 . 1 1 36 36 VAL CG1  C 13  20.8  0.1  . 5 . . . . 36 VAL CG1  . 11435 1 
      324 . 1 1 36 36 VAL N    N 15 123.0  0.1  . 1 . . . . 36 VAL N    . 11435 1 
      325 . 1 1 37 37 GLY H    H  1   8.75 0.01 . 1 . . . . 37 GLY H    . 11435 1 
      326 . 1 1 37 37 GLY HA2  H  1   4.00 0.01 . 2 . . . . 37 GLY HA2  . 11435 1 
      327 . 1 1 37 37 GLY CA   C 13  45.2  0.1  . 1 . . . . 37 GLY CA   . 11435 1 
      328 . 1 1 37 37 GLY N    N 15 113.7  0.1  . 1 . . . . 37 GLY N    . 11435 1 
      329 . 1 1 38 38 GLY H    H  1   8.39 0.01 . 1 . . . . 38 GLY H    . 11435 1 
      330 . 1 1 38 38 GLY HA2  H  1   3.98 0.01 . 2 . . . . 38 GLY HA2  . 11435 1 
      331 . 1 1 38 38 GLY CA   C 13  45.1  0.1  . 1 . . . . 38 GLY CA   . 11435 1 
      332 . 1 1 38 38 GLY N    N 15 109.1  0.1  . 1 . . . . 38 GLY N    . 11435 1 
      333 . 1 1 39 39 VAL H    H  1   8.22 0.01 . 1 . . . . 39 VAL H    . 11435 1 
      334 . 1 1 39 39 VAL HA   H  1   4.19 0.01 . 1 . . . . 39 VAL HA   . 11435 1 
      335 . 1 1 39 39 VAL HB   H  1   2.09 0.01 . 1 . . . . 39 VAL HB   . 11435 1 
      336 . 1 1 39 39 VAL HG11 H  1   0.94 0.01 . 2 . . . . 39 VAL MG1  . 11435 1 
      337 . 1 1 39 39 VAL HG12 H  1   0.94 0.01 . 2 . . . . 39 VAL MG1  . 11435 1 
      338 . 1 1 39 39 VAL HG13 H  1   0.94 0.01 . 2 . . . . 39 VAL MG1  . 11435 1 
      339 . 1 1 39 39 VAL CA   C 13  62.5  0.1  . 1 . . . . 39 VAL CA   . 11435 1 
      340 . 1 1 39 39 VAL CB   C 13  32.9  0.1  . 1 . . . . 39 VAL CB   . 11435 1 
      341 . 1 1 39 39 VAL CG1  C 13  20.9  0.1  . 2 . . . . 39 VAL CG1  . 11435 1 
      342 . 1 1 39 39 VAL N    N 15 120.3  0.1  . 1 . . . . 39 VAL N    . 11435 1 
      343 . 1 1 40 40 VAL H    H  1   7.97 0.01 . 1 . . . . 40 VAL H    . 11435 1 
      344 . 1 1 40 40 VAL HB   H  1   2.05 0.01 . 1 . . . . 40 VAL HB   . 11435 1 
      345 . 1 1 40 40 VAL HG11 H  1   0.90 0.01 . 2 . . . . 40 VAL MG1  . 11435 1 
      346 . 1 1 40 40 VAL HG12 H  1   0.90 0.01 . 2 . . . . 40 VAL MG1  . 11435 1 
      347 . 1 1 40 40 VAL HG13 H  1   0.90 0.01 . 2 . . . . 40 VAL MG1  . 11435 1 
      348 . 1 1 40 40 VAL CA   C 13  63.8  0.1  . 1 . . . . 40 VAL CA   . 11435 1 
      349 . 1 1 40 40 VAL CB   C 13  33.2  0.1  . 1 . . . . 40 VAL CB   . 11435 1 
      350 . 1 1 40 40 VAL CG1  C 13  21.6  0.1  . 2 . . . . 40 VAL CG1  . 11435 1 
      351 . 1 1 40 40 VAL CG2  C 13  20.2  0.1  . 2 . . . . 40 VAL CG2  . 11435 1 
      352 . 1 1 40 40 VAL N    N 15 128.9  0.1  . 1 . . . . 40 VAL N    . 11435 1 

   stop_

   loop_
      _Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID
      _Ambiguous_atom_chem_shift.Atom_chem_shift_ID
      _Ambiguous_atom_chem_shift.Entry_ID
      _Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID

       1  16 11435 1 
       1  17 11435 1 
       1  73 11435 1 
       1  74 11435 1 
       1 185 11435 1 
       1 186 11435 1 
       2  18 11435 1 
       2  19 11435 1 
       2  75 11435 1 
       2  76 11435 1 
       2 187 11435 1 
       2 188 11435 1 
       3  22 11435 1 
       3  79 11435 1 
       3 191 11435 1 
       4  43 11435 1 
       4  44 11435 1 
       4 103 11435 1 
       4 104 11435 1 
       5  50 11435 1 
       5 195 11435 1 
       6  56 11435 1 
       6 215 11435 1 
       7 120 11435 1 
       7 121 11435 1 
       7 229 11435 1 
       7 230 11435 1 
       8 122 11435 1 
       8 123 11435 1 
       8 231 11435 1 
       8 232 11435 1 
       9 124 11435 1 
       9 233 11435 1 
      10 127 11435 1 
      10 236 11435 1 
      11 128 11435 1 
      11 237 11435 1 
      12 129 11435 1 
      12 238 11435 1 
      13 133 11435 1 
      13 292 11435 1 
      14 134 11435 1 
      14 293 11435 1 
      15 135 11435 1 
      15 136 11435 1 
      15 137 11435 1 
      15 294 11435 1 
      15 295 11435 1 
      15 296 11435 1 
      16 138 11435 1 
      16 139 11435 1 
      16 140 11435 1 
      16 297 11435 1 
      16 298 11435 1 
      16 299 11435 1 
      17 144 11435 1 
      17 303 11435 1 
      18 145 11435 1 
      18 304 11435 1 
      19 163 11435 1 
      19 164 11435 1 
      19 170 11435 1 
      19 171 11435 1 
      21 202 11435 1 
      21 203 11435 1 
      21 204 11435 1 
      21 318 11435 1 
      21 319 11435 1 
      21 320 11435 1 
      22 207 11435 1 
      22 323 11435 1 
      23 254 11435 1 
      23 271 11435 1 
      24 255 11435 1 
      24 256 11435 1 
      24 272 11435 1 
      24 273 11435 1 
      25 257 11435 1 
      25 258 11435 1 
      25 259 11435 1 
      25 274 11435 1 
      25 275 11435 1 
      25 276 11435 1 
      26 260 11435 1 
      26 261 11435 1 
      26 262 11435 1 
      26 277 11435 1 
      26 278 11435 1 
      26 279 11435 1 
      27 265 11435 1 
      27 282 11435 1 
      28 266 11435 1 
      28 283 11435 1 
      29 267 11435 1 
      29 284 11435 1 

   stop_

save_