Content for NMR-STAR saveframe, "assigned_chem_shift_list"

    save_assigned_chem_shift_list
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  assigned_chem_shift_list
   _Assigned_chem_shift_list.Entry_ID                      19911
   _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                      'Origin nmrStar file /ebi/msd/pdb_root/Processing/prepare/4cz3/ebi/HP24wtNmrStar_5.csh'
   _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 NOESY 1 $sample_1 solution 19911 1 
      2 TOCSY 1 $sample_1 solution 19911 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 ACE H1   H  1   2.081  .    . 1 .  27 . . 52 ACE H1   . 19911 1 
        2 . 1 1  1  1 ACE H2   H  1   2.081  .    . 1 .  27 . . 52 ACE H2   . 19911 1 
        3 . 1 1  1  1 ACE H3   H  1   2.081  .    . 1 .  27 . . 52 ACE H3   . 19911 1 
        4 . 1 1  1  1 ACE CH3  C 13  24.541  .    . 1 .  28 . . 52 ACE CH3  . 19911 1 
        5 . 1 1  2  2 MET H    H  1   8.406  .    . 1 .  24 . . 53 MET H    . 19911 1 
        6 . 1 1  2  2 MET HA   H  1   4.516  .    . 1 .  16 . . 53 MET HA   . 19911 1 
        7 . 1 1  2  2 MET HB2  H  1   2.060  .    . 1 .  21 . . 53 MET HB2  . 19911 1 
        8 . 1 1  2  2 MET HB3  H  1   2.094  .    . 1 .  23 . . 53 MET HB3  . 19911 1 
        9 . 1 1  2  2 MET HG2  H  1   2.632  .    . 1 .  20 . . 53 MET HG2  . 19911 1 
       10 . 1 1  2  2 MET HG3  H  1   2.632  .    . 1 .  18 . . 53 MET HG3  . 19911 1 
       11 . 1 1  2  2 MET HE1  H  1   2.126  .    . 1 .  25 . . 53 MET HE1  . 19911 1 
       12 . 1 1  2  2 MET HE2  H  1   2.126  .    . 1 .  25 . . 53 MET HE2  . 19911 1 
       13 . 1 1  2  2 MET HE3  H  1   2.126  .    . 1 .  25 . . 53 MET HE3  . 19911 1 
       14 . 1 1  2  2 MET CA   C 13  55.901  .    . 1 .  17 . . 53 MET CA   . 19911 1 
       15 . 1 1  2  2 MET CB   C 13  33.205 0.001 . 1 .  22 . . 53 MET CB   . 19911 1 
       16 . 1 1  2  2 MET CG   C 13  32.079  .    . 1 .  19 . . 53 MET CG   . 19911 1 
       17 . 1 1  2  2 MET CE   C 13  16.993  .    . 1 .  26 . . 53 MET CE   . 19911 1 
       18 . 1 1  2  2 MET N    N 15 126.070  .    . 1 .  29 . . 53 MET N    . 19911 1 
       19 . 1 1  3  3 THR H    H  1   8.181  .    . 1 .  13 . . 54 THR H    . 19911 1 
       20 . 1 1  3  3 THR HA   H  1   4.410  .    . 1 .   8 . . 54 THR HA   . 19911 1 
       21 . 1 1  3  3 THR HB   H  1   4.319  .    . 1 .   1 . . 54 THR HB   . 19911 1 
       22 . 1 1  3  3 THR HG21 H  1   1.263  .    . 1 .  14 . . 54 THR HG21 . 19911 1 
       23 . 1 1  3  3 THR HG22 H  1   1.263  .    . 1 .  14 . . 54 THR HG22 . 19911 1 
       24 . 1 1  3  3 THR HG23 H  1   1.263  .    . 1 .  14 . . 54 THR HG23 . 19911 1 
       25 . 1 1  3  3 THR CA   C 13  61.790  .    . 1 .   9 . . 54 THR CA   . 19911 1 
       26 . 1 1  3  3 THR CB   C 13  70.096  .    . 1 .   2 . . 54 THR CB   . 19911 1 
       27 . 1 1  3  3 THR CG2  C 13  21.708  .    . 1 .  15 . . 54 THR CG2  . 19911 1 
       28 . 1 1  3  3 THR N    N 15 115.502  .    . 1 .  30 . . 54 THR N    . 19911 1 
       29 . 1 1  4  4 ARG HA   H  1   4.332  .    . 1 . 129 . . 55 ARG HA   . 19911 1 
       30 . 1 1  4  4 ARG HB2  H  1   1.814  .    . 2 . 131 . . 55 ARG HB2  . 19911 1 
       31 . 1 1  4  4 ARG HB3  H  1   1.897  .    . 2 . 133 . . 55 ARG HB3  . 19911 1 
       32 . 1 1  4  4 ARG HG2  H  1   1.630  .    . 1 . 135 . . 55 ARG HG2  . 19911 1 
       33 . 1 1  4  4 ARG HG3  H  1   1.630  .    . 1 . 136 . . 55 ARG HG3  . 19911 1 
       34 . 1 1  4  4 ARG HD2  H  1   3.212  .    . 1 . 126 . . 55 ARG HD2  . 19911 1 
       35 . 1 1  4  4 ARG HD3  H  1   3.212  .    . 1 . 128 . . 55 ARG HD3  . 19911 1 
       36 . 1 1  4  4 ARG CA   C 13  56.735  .    . 1 . 130 . . 55 ARG CA   . 19911 1 
       37 . 1 1  4  4 ARG CB   C 13  30.720 0.004 . 1 . 132 . . 55 ARG CB   . 19911 1 
       38 . 1 1  4  4 ARG CG   C 13  27.129  .    . 1 . 134 . . 55 ARG CG   . 19911 1 
       39 . 1 1  4  4 ARG CD   C 13  43.380  .    . 1 . 127 . . 55 ARG CD   . 19911 1 
       40 . 1 1  5  5 SER HA   H  1   4.384  .    . 1 .  88 . . 56 SER HA   . 19911 1 
       41 . 1 1  5  5 SER HB2  H  1   3.898  .    . 2 .   5 . . 56 SER HB2  . 19911 1 
       42 . 1 1  5  5 SER HB3  H  1   3.837  .    . 2 .   3 . . 56 SER HB3  . 19911 1 
       43 . 1 1  5  5 SER CA   C 13  58.845  .    . 1 .  89 . . 56 SER CA   . 19911 1 
       44 . 1 1  5  5 SER CB   C 13  63.695 0.002 . 1 .   4 . . 56 SER CB   . 19911 1 
       45 . 1 1  6  6 ALA HA   H  1   4.239  .    . 1 .  62 . . 57 ALA HA   . 19911 1 
       46 . 1 1  6  6 ALA HB1  H  1   1.309  .    . 1 .  60 . . 57 ALA HB1  . 19911 1 
       47 . 1 1  6  6 ALA HB2  H  1   1.309  .    . 1 .  60 . . 57 ALA HB2  . 19911 1 
       48 . 1 1  6  6 ALA HB3  H  1   1.309  .    . 1 .  60 . . 57 ALA HB3  . 19911 1 
       49 . 1 1  6  6 ALA CA   C 13  53.304  .    . 1 .  63 . . 57 ALA CA   . 19911 1 
       50 . 1 1  6  6 ALA CB   C 13  18.992  .    . 1 .  61 . . 57 ALA CB   . 19911 1 
       51 . 1 1  7  7 PHE H    H  1   8.073  .    . 1 .  93 . . 58 PHE H    . 19911 1 
       52 . 1 1  7  7 PHE HA   H  1   4.508  .    . 1 .  94 . . 58 PHE HA   . 19911 1 
       53 . 1 1  7  7 PHE HB2  H  1   3.174  .    . 2 .  92 . . 58 PHE HB2  . 19911 1 
       54 . 1 1  7  7 PHE HB3  H  1   3.019  .    . 2 .  90 . . 58 PHE HB3  . 19911 1 
       55 . 1 1  7  7 PHE CA   C 13  58.240  .    . 1 .  95 . . 58 PHE CA   . 19911 1 
       56 . 1 1  7  7 PHE CB   C 13  39.524 0.042 . 1 .  91 . . 58 PHE CB   . 19911 1 
       57 . 1 1  7  7 PHE N    N 15 118.554  .    . 1 . 214 . . 58 PHE N    . 19911 1 
       58 . 1 1  8  8 ALA H    H  1   7.940  .    . 1 .  57 . . 59 ALA H    . 19911 1 
       59 . 1 1  8  8 ALA HA   H  1   4.201  .    . 1 .  58 . . 59 ALA HA   . 19911 1 
       60 . 1 1  8  8 ALA HB1  H  1   1.397  .    . 1 .  55 . . 59 ALA HB1  . 19911 1 
       61 . 1 1  8  8 ALA HB2  H  1   1.397  .    . 1 .  55 . . 59 ALA HB2  . 19911 1 
       62 . 1 1  8  8 ALA HB3  H  1   1.397  .    . 1 .  55 . . 59 ALA HB3  . 19911 1 
       63 . 1 1  8  8 ALA CA   C 13  53.089  .    . 1 .  59 . . 59 ALA CA   . 19911 1 
       64 . 1 1  8  8 ALA CB   C 13  19.181  .    . 1 .  56 . . 59 ALA CB   . 19911 1 
       65 . 1 1  8  8 ALA N    N 15 122.927  .    . 1 . 207 . . 59 ALA N    . 19911 1 
       66 . 1 1  9  9 ASN H    H  1   8.071  .    . 1 . 109 . . 60 ASN H    . 19911 1 
       67 . 1 1  9  9 ASN HA   H  1   4.702  .    . 1 . 107 . . 60 ASN HA   . 19911 1 
       68 . 1 1  9  9 ASN HB2  H  1   2.896  .    . 2 . 112 . . 60 ASN HB2  . 19911 1 
       69 . 1 1  9  9 ASN HB3  H  1   2.716  .    . 2 . 110 . . 60 ASN HB3  . 19911 1 
       70 . 1 1  9  9 ASN CA   C 13  53.029  .    . 1 . 108 . . 60 ASN CA   . 19911 1 
       71 . 1 1  9  9 ASN CB   C 13  38.899 0.001 . 1 . 111 . . 60 ASN CB   . 19911 1 
       72 . 1 1  9  9 ASN N    N 15 116.001  .    . 1 . 213 . . 60 ASN N    . 19911 1 
       73 . 1 1 10 10 LEU H    H  1   7.884  .    . 1 . 104 . . 61 LEU H    . 19911 1 
       74 . 1 1 10 10 LEU HA   H  1   4.564  .    . 1 . 105 . . 61 LEU HA   . 19911 1 
       75 . 1 1 10 10 LEU HB2  H  1   1.634  .    . 2 . 123 . . 61 LEU HB2  . 19911 1 
       76 . 1 1 10 10 LEU HB3  H  1   1.408  .    . 2 . 102 . . 61 LEU HB3  . 19911 1 
       77 . 1 1 10 10 LEU HG   H  1   1.711  .    . 1 . 124 . . 61 LEU HG   . 19911 1 
       78 . 1 1 10 10 LEU HD11 H  1   0.876  .    . 2 . 121 . . 61 LEU HD11 . 19911 1 
       79 . 1 1 10 10 LEU HD12 H  1   0.876  .    . 2 . 121 . . 61 LEU HD12 . 19911 1 
       80 . 1 1 10 10 LEU HD13 H  1   0.876  .    . 2 . 121 . . 61 LEU HD13 . 19911 1 
       81 . 1 1 10 10 LEU HD21 H  1   0.879  .    . 2 . 119 . . 61 LEU HD21 . 19911 1 
       82 . 1 1 10 10 LEU HD22 H  1   0.879  .    . 2 . 119 . . 61 LEU HD22 . 19911 1 
       83 . 1 1 10 10 LEU HD23 H  1   0.879  .    . 2 . 119 . . 61 LEU HD23 . 19911 1 
       84 . 1 1 10 10 LEU CA   C 13  53.507  .    . 1 . 106 . . 61 LEU CA   . 19911 1 
       85 . 1 1 10 10 LEU CB   C 13  41.967 0.004 . 1 . 103 . . 61 LEU CB   . 19911 1 
       86 . 1 1 10 10 LEU CG   C 13  26.836  .    . 1 . 125 . . 61 LEU CG   . 19911 1 
       87 . 1 1 10 10 LEU CD1  C 13  23.397  .    . 2 . 122 . . 61 LEU CD1  . 19911 1 
       88 . 1 1 10 10 LEU CD2  C 13  25.561  .    . 2 . 120 . . 61 LEU CD2  . 19911 1 
       89 . 1 1 10 10 LEU N    N 15 122.968  .    . 1 . 199 . . 61 LEU N    . 19911 1 
       90 . 1 1 11 11 PRO HA   H  1   4.381  .    . 1 .   6 . . 62 PRO HA   . 19911 1 
       91 . 1 1 11 11 PRO HB2  H  1   2.221  .    . 2 .  51 . . 62 PRO HB2  . 19911 1 
       92 . 1 1 11 11 PRO HB3  H  1   1.428  .    . 2 .  49 . . 62 PRO HB3  . 19911 1 
       93 . 1 1 11 11 PRO HG2  H  1   1.798  .    . 2 .  52 . . 62 PRO HG2  . 19911 1 
       94 . 1 1 11 11 PRO HG3  H  1   2.026  .    . 2 .  54 . . 62 PRO HG3  . 19911 1 
       95 . 1 1 11 11 PRO HD2  H  1   3.844  .    . 2 .  48 . . 62 PRO HD2  . 19911 1 
       96 . 1 1 11 11 PRO HD3  H  1   3.461  .    . 2 .  46 . . 62 PRO HD3  . 19911 1 
       97 . 1 1 11 11 PRO CA   C 13  63.112  .    . 1 .   7 . . 62 PRO CA   . 19911 1 
       98 . 1 1 11 11 PRO CB   C 13  32.007 0.003 . 1 .  50 . . 62 PRO CB   . 19911 1 
       99 . 1 1 11 11 PRO CG   C 13  27.695  .    . 1 .  53 . . 62 PRO CG   . 19911 1 
      100 . 1 1 11 11 PRO CD   C 13  50.474 0.001 . 1 .  47 . . 62 PRO CD   . 19911 1 
      101 . 1 1 12 12 LEU H    H  1   8.423  .    . 1 . 149 . . 63 LEU H    . 19911 1 
      102 . 1 1 12 12 LEU HA   H  1   4.096  .    . 1 . 162 . . 63 LEU HA   . 19911 1 
      103 . 1 1 12 12 LEU HB2  H  1   1.679  .    . 1 . 150 . . 63 LEU HB2  . 19911 1 
      104 . 1 1 12 12 LEU HB3  H  1   1.679  .    . 1 . 151 . . 63 LEU HB3  . 19911 1 
      105 . 1 1 12 12 LEU HD11 H  1   0.960  .    . 2 . 147 . . 63 LEU HD11 . 19911 1 
      106 . 1 1 12 12 LEU HD12 H  1   0.960  .    . 2 . 147 . . 63 LEU HD12 . 19911 1 
      107 . 1 1 12 12 LEU HD13 H  1   0.960  .    . 2 . 147 . . 63 LEU HD13 . 19911 1 
      108 . 1 1 12 12 LEU HD21 H  1   0.908  .    . 2 . 145 . . 63 LEU HD21 . 19911 1 
      109 . 1 1 12 12 LEU HD22 H  1   0.908  .    . 2 . 145 . . 63 LEU HD22 . 19911 1 
      110 . 1 1 12 12 LEU HD23 H  1   0.908  .    . 2 . 145 . . 63 LEU HD23 . 19911 1 
      111 . 1 1 12 12 LEU CA   C 13  57.164  .    . 1 . 163 . . 63 LEU CA   . 19911 1 
      112 . 1 1 12 12 LEU CB   C 13  41.886  .    . 1 . 152 . . 63 LEU CB   . 19911 1 
      113 . 1 1 12 12 LEU CD1  C 13  24.517  .    . 2 . 148 . . 63 LEU CD1  . 19911 1 
      114 . 1 1 12 12 LEU CD2  C 13  24.013  .    . 2 . 146 . . 63 LEU CD2  . 19911 1 
      115 . 1 1 12 12 LEU N    N 15 122.522  .    . 1 . 204 . . 63 LEU N    . 19911 1 
      116 . 1 1 13 13 TRP H    H  1   7.859  .    . 1 .  99 . . 64 TRP H    . 19911 1 
      117 . 1 1 13 13 TRP HA   H  1   4.558  .    . 1 . 101 . . 64 TRP HA   . 19911 1 
      118 . 1 1 13 13 TRP HB2  H  1   3.419  .    . 2 .  98 . . 64 TRP HB2  . 19911 1 
      119 . 1 1 13 13 TRP HB3  H  1   3.343  .    . 2 .  96 . . 64 TRP HB3  . 19911 1 
      120 . 1 1 13 13 TRP HE1  H  1  10.336  .    . 1 . 194 . . 64 TRP HE1  . 19911 1 
      121 . 1 1 13 13 TRP CA   C 13  58.335  .    . 1 . 100 . . 64 TRP CA   . 19911 1 
      122 . 1 1 13 13 TRP CB   C 13  28.425 0.001 . 1 .  97 . . 64 TRP CB   . 19911 1 
      123 . 1 1 13 13 TRP N    N 15 117.881  .    . 1 . 212 . . 64 TRP N    . 19911 1 
      124 . 1 1 13 13 TRP NE1  N 15 130.107  .    . 1 . 205 . . 64 TRP NE1  . 19911 1 
      125 . 1 1 14 14 LYS H    H  1   7.337  .    . 1 .  33 . . 65 LYS H    . 19911 1 
      126 . 1 1 14 14 LYS HA   H  1   4.069  .    . 1 .  31 . . 65 LYS HA   . 19911 1 
      127 . 1 1 14 14 LYS HB2  H  1   1.660  .    . 2 .  39 . . 65 LYS HB2  . 19911 1 
      128 . 1 1 14 14 LYS HB3  H  1   1.300  .    . 2 .  37 . . 65 LYS HB3  . 19911 1 
      129 . 1 1 14 14 LYS HG2  H  1   1.046  .    . 1 .  42 . . 65 LYS HG2  . 19911 1 
      130 . 1 1 14 14 LYS HG3  H  1   1.011  .    . 1 .  40 . . 65 LYS HG3  . 19911 1 
      131 . 1 1 14 14 LYS HD2  H  1   1.558  .    . 1 .  43 . . 65 LYS HD2  . 19911 1 
      132 . 1 1 14 14 LYS HD3  H  1   1.558  .    . 1 .  45 . . 65 LYS HD3  . 19911 1 
      133 . 1 1 14 14 LYS HE2  H  1   2.918  .    . 1 .  34 . . 65 LYS HE2  . 19911 1 
      134 . 1 1 14 14 LYS HE3  H  1   2.918  .    . 1 .  36 . . 65 LYS HE3  . 19911 1 
      135 . 1 1 14 14 LYS CA   C 13  57.250  .    . 1 .  32 . . 65 LYS CA   . 19911 1 
      136 . 1 1 14 14 LYS CB   C 13  32.917  .    . 1 .  38 . . 65 LYS CB   . 19911 1 
      137 . 1 1 14 14 LYS CG   C 13  24.906  .    . 1 .  41 . . 65 LYS CG   . 19911 1 
      138 . 1 1 14 14 LYS CD   C 13  29.264  .    . 1 .  44 . . 65 LYS CD   . 19911 1 
      139 . 1 1 14 14 LYS CE   C 13  42.141  .    . 1 .  35 . . 65 LYS CE   . 19911 1 
      140 . 1 1 14 14 LYS N    N 15 121.770  .    . 1 . 206 . . 65 LYS N    . 19911 1 
      141 . 1 1 15 15 GLN H    H  1   7.894  .    . 1 . 172 . . 66 GLN H    . 19911 1 
      142 . 1 1 15 15 GLN HA   H  1   4.058  .    . 1 . 173 . . 66 GLN HA   . 19911 1 
      143 . 1 1 15 15 GLN HB2  H  1   2.065  .    . 1 . 168 . . 66 GLN HB2  . 19911 1 
      144 . 1 1 15 15 GLN HB3  H  1   2.065  .    . 1 . 166 . . 66 GLN HB3  . 19911 1 
      145 . 1 1 15 15 GLN HG2  H  1   2.307  .    . 2 . 171 . . 66 GLN HG2  . 19911 1 
      146 . 1 1 15 15 GLN HG3  H  1   2.116  .    . 2 . 169 . . 66 GLN HG3  . 19911 1 
      147 . 1 1 15 15 GLN CA   C 13  57.316  .    . 1 . 174 . . 66 GLN CA   . 19911 1 
      148 . 1 1 15 15 GLN CB   C 13  29.102  .    . 1 . 167 . . 66 GLN CB   . 19911 1 
      149 . 1 1 15 15 GLN CG   C 13  33.989 0.003 . 1 . 170 . . 66 GLN CG   . 19911 1 
      150 . 1 1 15 15 GLN N    N 15 119.768  .    . 1 . 200 . . 66 GLN N    . 19911 1 
      151 . 1 1 16 16 GLN H    H  1   8.226  .    . 1 . 156 . . 67 GLN H    . 19911 1 
      152 . 1 1 16 16 GLN HA   H  1   4.233  .    . 1 . 161 . . 67 GLN HA   . 19911 1 
      153 . 1 1 16 16 GLN HB2  H  1   2.098  .    . 1 . 155 . . 67 GLN HB2  . 19911 1 
      154 . 1 1 16 16 GLN HB3  H  1   2.098  .    . 1 . 153 . . 67 GLN HB3  . 19911 1 
      155 . 1 1 16 16 GLN HG2  H  1   2.446  .    . 2 . 159 . . 67 GLN HG2  . 19911 1 
      156 . 1 1 16 16 GLN HG3  H  1   2.394  .    . 2 . 157 . . 67 GLN HG3  . 19911 1 
      157 . 1 1 16 16 GLN CA   C 13  56.886  .    . 1 . 160 . . 67 GLN CA   . 19911 1 
      158 . 1 1 16 16 GLN CB   C 13  29.210  .    . 1 . 154 . . 67 GLN CB   . 19911 1 
      159 . 1 1 16 16 GLN CG   C 13  33.938 0.006 . 1 . 158 . . 67 GLN CG   . 19911 1 
      160 . 1 1 16 16 GLN N    N 15 119.028  .    . 1 . 210 . . 67 GLN N    . 19911 1 
      161 . 1 1 17 17 ASN H    H  1   8.150  .    . 1 . 113 . . 68 ASN H    . 19911 1 
      162 . 1 1 17 17 ASN HA   H  1   4.680  .    . 1 . 114 . . 68 ASN HA   . 19911 1 
      163 . 1 1 17 17 ASN HB2  H  1   2.866  .    . 2 . 117 . . 68 ASN HB2  . 19911 1 
      164 . 1 1 17 17 ASN HB3  H  1   2.750  .    . 2 . 116 . . 68 ASN HB3  . 19911 1 
      165 . 1 1 17 17 ASN CA   C 13  54.027  .    . 1 . 115 . . 68 ASN CA   . 19911 1 
      166 . 1 1 17 17 ASN CB   C 13  38.740 0.001 . 1 . 118 . . 68 ASN CB   . 19911 1 
      167 . 1 1 17 17 ASN N    N 15 121.037  .    . 1 . 215 . . 68 ASN N    . 19911 1 
      168 . 1 1 18 18 LEU H    H  1   8.092  .    . 1 . 140 . . 69 LEU H    . 19911 1 
      169 . 1 1 18 18 LEU HA   H  1   4.326  .    . 1 . 176 . . 69 LEU HA   . 19911 1 
      170 . 1 1 18 18 LEU HB2  H  1   1.626  .    . 2 . 139 . . 69 LEU HB2  . 19911 1 
      171 . 1 1 18 18 LEU HB3  H  1   1.753  .    . 2 . 137 . . 69 LEU HB3  . 19911 1 
      172 . 1 1 18 18 LEU HG   H  1   1.682  .    . 1 . 201 . . 69 LEU HG   . 19911 1 
      173 . 1 1 18 18 LEU HD11 H  1   0.908  .    . 2 . 141 . . 69 LEU HD11 . 19911 1 
      174 . 1 1 18 18 LEU HD12 H  1   0.908  .    . 2 . 141 . . 69 LEU HD12 . 19911 1 
      175 . 1 1 18 18 LEU HD13 H  1   0.908  .    . 2 . 141 . . 69 LEU HD13 . 19911 1 
      176 . 1 1 18 18 LEU HD21 H  1   0.933  .    . 2 . 143 . . 69 LEU HD21 . 19911 1 
      177 . 1 1 18 18 LEU HD22 H  1   0.933  .    . 2 . 143 . . 69 LEU HD22 . 19911 1 
      178 . 1 1 18 18 LEU HD23 H  1   0.933  .    . 2 . 143 . . 69 LEU HD23 . 19911 1 
      179 . 1 1 18 18 LEU CA   C 13  55.967  .    . 1 . 177 . . 69 LEU CA   . 19911 1 
      180 . 1 1 18 18 LEU CB   C 13  42.372 0.006 . 1 . 138 . . 69 LEU CB   . 19911 1 
      181 . 1 1 18 18 LEU CG   C 13  27.154  .    . 1 . 202 . . 69 LEU CG   . 19911 1 
      182 . 1 1 18 18 LEU CD1  C 13  23.373  .    . 2 . 142 . . 69 LEU CD1  . 19911 1 
      183 . 1 1 18 18 LEU CD2  C 13  25.300  .    . 2 . 144 . . 69 LEU CD2  . 19911 1 
      184 . 1 1 18 18 LEU N    N 15 121.918  .    . 1 . 209 . . 69 LEU N    . 19911 1 
      185 . 1 1 20 20 LYS HA   H  1   4.308  .    . 1 . 181 . . 71 LYS HA   . 19911 1 
      186 . 1 1 20 20 LYS HB2  H  1   1.835  .    . 2 . 186 . . 71 LYS HB2  . 19911 1 
      187 . 1 1 20 20 LYS HB3  H  1   1.900  .    . 2 . 185 . . 71 LYS HB3  . 19911 1 
      188 . 1 1 20 20 LYS HG2  H  1   1.527  .    . 1 . 190 . . 71 LYS HG2  . 19911 1 
      189 . 1 1 20 20 LYS HG3  H  1   1.527  .    . 1 . 189 . . 71 LYS HG3  . 19911 1 
      190 . 1 1 20 20 LYS HD2  H  1   1.720  .    . 1 . 182 . . 71 LYS HD2  . 19911 1 
      191 . 1 1 20 20 LYS HD3  H  1   1.720  .    . 1 . 184 . . 71 LYS HD3  . 19911 1 
      192 . 1 1 20 20 LYS HE2  H  1   3.022  .    . 1 .  87 . . 71 LYS HE2  . 19911 1 
      193 . 1 1 20 20 LYS HE3  H  1   3.022  .    . 1 .  85 . . 71 LYS HE3  . 19911 1 
      194 . 1 1 20 20 LYS CA   C 13  56.823  .    . 1 . 188 . . 71 LYS CA   . 19911 1 
      195 . 1 1 20 20 LYS CB   C 13  32.832 0.004 . 1 . 187 . . 71 LYS CB   . 19911 1 
      196 . 1 1 20 20 LYS CG   C 13  24.956  .    . 1 . 191 . . 71 LYS CG   . 19911 1 
      197 . 1 1 20 20 LYS CD   C 13  29.213  .    . 1 . 183 . . 71 LYS CD   . 19911 1 
      198 . 1 1 20 20 LYS CE   C 13  42.216  .    . 1 .  86 . . 71 LYS CE   . 19911 1 
      199 . 1 1 21 21 GLU HA   H  1   4.295  .    . 1 . 179 . . 72 GLU HA   . 19911 1 
      200 . 1 1 21 21 GLU HB2  H  1   2.010  .    . 2 .  80 . . 72 GLU HB2  . 19911 1 
      201 . 1 1 21 21 GLU HB3  H  1   2.098  .    . 2 .  81 . . 72 GLU HB3  . 19911 1 
      202 . 1 1 21 21 GLU HG2  H  1   2.320  .    . 1 .  84 . . 72 GLU HG2  . 19911 1 
      203 . 1 1 21 21 GLU HG3  H  1   2.320  .    . 1 .  82 . . 72 GLU HG3  . 19911 1 
      204 . 1 1 21 21 GLU CA   C 13  56.883  .    . 1 . 180 . . 72 GLU CA   . 19911 1 
      205 . 1 1 21 21 GLU CB   C 13  30.358  .    . 1 .  79 . . 72 GLU CB   . 19911 1 
      206 . 1 1 21 21 GLU CG   C 13  36.337  .    . 1 .  83 . . 72 GLU CG   . 19911 1 
      207 . 1 1 22 22 LYS H    H  1   8.164  .    . 1 . 198 . . 73 LYS H    . 19911 1 
      208 . 1 1 22 22 LYS HA   H  1   4.275  .    . 1 . 192 . . 73 LYS HA   . 19911 1 
      209 . 1 1 22 22 LYS HG2  H  1   1.438  .    . 1 . 195 . . 73 LYS HG2  . 19911 1 
      210 . 1 1 22 22 LYS HG3  H  1   1.438  .    . 1 . 197 . . 73 LYS HG3  . 19911 1 
      211 . 1 1 22 22 LYS CA   C 13  56.936  .    . 1 . 193 . . 73 LYS CA   . 19911 1 
      212 . 1 1 22 22 LYS CG   C 13  24.915  .    . 1 . 196 . . 73 LYS CG   . 19911 1 
      213 . 1 1 22 22 LYS N    N 15 121.978  .    . 1 . 216 . . 73 LYS N    . 19911 1 
      214 . 1 1 23 23 GLY H    H  1   8.350  .    . 1 . 175 . . 74 GLY H    . 19911 1 
      215 . 1 1 23 23 GLY HA2  H  1   3.950  .    . 1 .  12 . . 74 GLY HA2  . 19911 1 
      216 . 1 1 23 23 GLY HA3  H  1   3.950  .    . 1 .  10 . . 74 GLY HA3  . 19911 1 
      217 . 1 1 23 23 GLY CA   C 13  45.455  .    . 1 .  11 . . 74 GLY CA   . 19911 1 
      218 . 1 1 23 23 GLY N    N 15 109.387  .    . 1 . 203 . . 74 GLY N    . 19911 1 
      219 . 1 1 24 24 LEU H    H  1   8.033  .    . 1 .  74 . . 75 LEU H    . 19911 1 
      220 . 1 1 24 24 LEU HA   H  1   4.251  .    . 1 .  78 . . 75 LEU HA   . 19911 1 
      221 . 1 1 24 24 LEU HB2  H  1   1.470  .    . 2 .  77 . . 75 LEU HB2  . 19911 1 
      222 . 1 1 24 24 LEU HB3  H  1   1.369  .    . 2 .  75 . . 75 LEU HB3  . 19911 1 
      223 . 1 1 24 24 LEU HG   H  1   1.477  .    . 1 . 164 . . 75 LEU HG   . 19911 1 
      224 . 1 1 24 24 LEU HD11 H  1   0.823  .    . 2 .  70 . . 75 LEU HD11 . 19911 1 
      225 . 1 1 24 24 LEU HD12 H  1   0.823  .    . 2 .  70 . . 75 LEU HD12 . 19911 1 
      226 . 1 1 24 24 LEU HD13 H  1   0.823  .    . 2 .  70 . . 75 LEU HD13 . 19911 1 
      227 . 1 1 24 24 LEU HD21 H  1   0.884  .    . 2 .  72 . . 75 LEU HD21 . 19911 1 
      228 . 1 1 24 24 LEU HD22 H  1   0.884  .    . 2 .  72 . . 75 LEU HD22 . 19911 1 
      229 . 1 1 24 24 LEU HD23 H  1   0.884  .    . 2 .  72 . . 75 LEU HD23 . 19911 1 
      230 . 1 1 24 24 LEU CA   C 13  55.554  .    . 1 . 178 . . 75 LEU CA   . 19911 1 
      231 . 1 1 24 24 LEU CB   C 13  42.421 0.001 . 1 .  76 . . 75 LEU CB   . 19911 1 
      232 . 1 1 24 24 LEU CG   C 13  26.906  .    . 1 . 165 . . 75 LEU CG   . 19911 1 
      233 . 1 1 24 24 LEU CD1  C 13  23.534  .    . 2 .  71 . . 75 LEU CD1  . 19911 1 
      234 . 1 1 24 24 LEU CD2  C 13  24.900  .    . 2 .  73 . . 75 LEU CD2  . 19911 1 
      235 . 1 1 24 24 LEU N    N 15 121.679  .    . 1 . 208 . . 75 LEU N    . 19911 1 
      236 . 1 1 25 25 PHE H    H  1   8.170  .    . 1 .  66 . . 76 PHE H    . 19911 1 
      237 . 1 1 25 25 PHE HA   H  1   4.638  .    . 1 .  64 . . 76 PHE HA   . 19911 1 
      238 . 1 1 25 25 PHE HB2  H  1   3.245  .    . 2 .  69 . . 76 PHE HB2  . 19911 1 
      239 . 1 1 25 25 PHE HB3  H  1   2.993  .    . 2 .  67 . . 76 PHE HB3  . 19911 1 
      240 . 1 1 25 25 PHE CA   C 13  57.359  .    . 1 .  65 . . 76 PHE CA   . 19911 1 
      241 . 1 1 25 25 PHE CB   C 13  39.519 0.04  . 1 .  68 . . 76 PHE CB   . 19911 1 
      242 . 1 1 25 25 PHE N    N 15 120.058  .    . 1 . 211 . . 76 PHE N    . 19911 1 

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