Content for NMR-STAR saveframe, "chemical-shift"

    save_chemical-shift
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  chemical-shift
   _Assigned_chem_shift_list.Entry_ID                      15174
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Sample_condition_list_ID      1
   _Assigned_chem_shift_list.Sample_condition_list_label  $(L-Phe44)iota-RXIA
   _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' . . . 15174 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 HA2  H  1  3.93 0.02 . 2 . . . .  1 GLY HA2  . 15174 1 
        2 . 1 1  1  1 GLY HA3  H  1  4.02 0.02 . 2 . . . .  1 GLY HA3  . 15174 1 
        3 . 1 1  1  1 GLY CA   C 13 43.5  0.02 . 1 . . . .  1 GLY CA   . 15174 1 
        4 . 1 1  2  2 HYP HA   H  1  4.5  0.02 . 1 . . . .  2 HYP HA   . 15174 1 
        5 . 1 1  2  2 HYP HB2  H  1  1.99 0.02 . 2 . . . .  2 HYP HB2  . 15174 1 
        6 . 1 1  2  2 HYP HB3  H  1  2.04 0.02 . 2 . . . .  2 HYP HB3  . 15174 1 
        7 . 1 1  2  2 HYP CA   C 13 60.8  0.02 . 1 . . . .  2 HYP CA   . 15174 1 
        8 . 1 1  3  3 SER H    H  1  8.56 0.02 . 1 . . . .  3 SER H    . 15174 1 
        9 . 1 1  3  3 SER HA   H  1  4.39 0.02 . 1 . . . .  3 SER HA   . 15174 1 
       10 . 1 1  3  3 SER HB2  H  1  3.8  0.02 . 1 . . . .  3 SER HB2  . 15174 1 
       11 . 1 1  3  3 SER HB3  H  1  3.8  0.02 . 1 . . . .  3 SER HB3  . 15174 1 
       12 . 1 1  3  3 SER CA   C 13 58.7  0.02 . 1 . . . .  3 SER CA   . 15174 1 
       13 . 1 1  4  4 PHE H    H  1  8.22 0.02 . 1 . . . .  4 PHE H    . 15174 1 
       14 . 1 1  4  4 PHE HA   H  1  4.73 0.02 . 1 . . . .  4 PHE HA   . 15174 1 
       15 . 1 1  4  4 PHE HB2  H  1  3.02 0.02 . 2 . . . .  4 PHE HB2  . 15174 1 
       16 . 1 1  4  4 PHE HB3  H  1  3.17 0.02 . 2 . . . .  4 PHE HB3  . 15174 1 
       17 . 1 1  4  4 PHE HD1  H  1  7.36 0.02 . 1 . . . .  4 PHE HD1  . 15174 1 
       18 . 1 1  4  4 PHE HD2  H  1  7.36 0.02 . 1 . . . .  4 PHE HD2  . 15174 1 
       19 . 1 1  4  4 PHE HE1  H  1  7.26 0.02 . 1 . . . .  4 PHE HE1  . 15174 1 
       20 . 1 1  4  4 PHE HE2  H  1  7.26 0.02 . 1 . . . .  4 PHE HE2  . 15174 1 
       21 . 1 1  4  4 PHE CA   C 13 57.5  0.02 . 1 . . . .  4 PHE CA   . 15174 1 
       22 . 1 1  5  5 CYS H    H  1  7.99 0.02 . 1 . . . .  5 CYS H    . 15174 1 
       23 . 1 1  5  5 CYS HA   H  1  4.51 0.02 . 1 . . . .  5 CYS HA   . 15174 1 
       24 . 1 1  5  5 CYS HB2  H  1  2.8  0.02 . 2 . . . .  5 CYS HB2  . 15174 1 
       25 . 1 1  5  5 CYS HB3  H  1  3.04 0.02 . 2 . . . .  5 CYS HB3  . 15174 1 
       26 . 1 1  5  5 CYS CA   C 13 54.3  0.02 . 1 . . . .  5 CYS CA   . 15174 1 
       27 . 1 1  6  6 LYS H    H  1  8.74 0.02 . 1 . . . .  6 LYS H    . 15174 1 
       28 . 1 1  6  6 LYS HA   H  1  4.34 0.02 . 1 . . . .  6 LYS HA   . 15174 1 
       29 . 1 1  6  6 LYS HB2  H  1  1.75 0.02 . 2 . . . .  6 LYS HB2  . 15174 1 
       30 . 1 1  6  6 LYS HB3  H  1  2.16 0.02 . 2 . . . .  6 LYS HB3  . 15174 1 
       31 . 1 1  6  6 LYS HG2  H  1  1.48 0.02 . 2 . . . .  6 LYS HG2  . 15174 1 
       32 . 1 1  6  6 LYS HG3  H  1  1.58 0.02 . 2 . . . .  6 LYS HG3  . 15174 1 
       33 . 1 1  6  6 LYS HD2  H  1  1.6  0.02 . 1 . . . .  6 LYS HD2  . 15174 1 
       34 . 1 1  6  6 LYS HD3  H  1  1.6  0.02 . 1 . . . .  6 LYS HD3  . 15174 1 
       35 . 1 1  6  6 LYS HE2  H  1  3.07 0.02 . 1 . . . .  6 LYS HE2  . 15174 1 
       36 . 1 1  6  6 LYS HE3  H  1  3.07 0.02 . 1 . . . .  6 LYS HE3  . 15174 1 
       37 . 1 1  6  6 LYS CA   C 13 57.4  0.02 . 1 . . . .  6 LYS CA   . 15174 1 
       38 . 1 1  7  7 ALA H    H  1  8.42 0.02 . 1 . . . .  7 ALA H    . 15174 1 
       39 . 1 1  7  7 ALA HA   H  1  4.09 0.02 . 1 . . . .  7 ALA HA   . 15174 1 
       40 . 1 1  7  7 ALA HB1  H  1  1.44 0.02 . 1 . . . .  7 ALA HB   . 15174 1 
       41 . 1 1  7  7 ALA HB2  H  1  1.44 0.02 . 1 . . . .  7 ALA HB   . 15174 1 
       42 . 1 1  7  7 ALA HB3  H  1  1.44 0.02 . 1 . . . .  7 ALA HB   . 15174 1 
       43 . 1 1  7  7 ALA CA   C 13 51.4  0.02 . 1 . . . .  7 ALA CA   . 15174 1 
       44 . 1 1  8  8 ASP H    H  1  8.17 0.02 . 1 . . . .  8 ASP H    . 15174 1 
       45 . 1 1  8  8 ASP HA   H  1  4.1  0.02 . 1 . . . .  8 ASP HA   . 15174 1 
       46 . 1 1  8  8 ASP HB2  H  1  2.55 0.02 . 2 . . . .  8 ASP HB2  . 15174 1 
       47 . 1 1  8  8 ASP HB3  H  1  2.74 0.02 . 2 . . . .  8 ASP HB3  . 15174 1 
       48 . 1 1  8  8 ASP CA   C 13 51.4  0.02 . 1 . . . .  8 ASP CA   . 15174 1 
       49 . 1 1  9  9 GLU H    H  1  9.21 0.02 . 1 . . . .  9 GLU H    . 15174 1 
       50 . 1 1  9  9 GLU HA   H  1  3.8  0.02 . 1 . . . .  9 GLU HA   . 15174 1 
       51 . 1 1  9  9 GLU HB2  H  1  2.23 0.02 . 2 . . . .  9 GLU HB2  . 15174 1 
       52 . 1 1  9  9 GLU HB3  H  1  2.29 0.02 . 2 . . . .  9 GLU HB3  . 15174 1 
       53 . 1 1  9  9 GLU HG2  H  1  2.6  0.02 . 1 . . . .  9 GLU HG2  . 15174 1 
       54 . 1 1  9  9 GLU HG3  H  1  2.6  0.02 . 1 . . . .  9 GLU HG3  . 15174 1 
       55 . 1 1  9  9 GLU CA   C 13 58.2  0.02 . 1 . . . .  9 GLU CA   . 15174 1 
       56 . 1 1 10 10 LYS H    H  1  7.5  0.02 . 1 . . . . 10 LYS H    . 15174 1 
       57 . 1 1 10 10 LYS HA   H  1  4.7  0.02 . 1 . . . . 10 LYS HA   . 15174 1 
       58 . 1 1 10 10 LYS HB2  H  1  1.76 0.02 . 2 . . . . 10 LYS HB2  . 15174 1 
       59 . 1 1 10 10 LYS HB3  H  1  2.04 0.02 . 2 . . . . 10 LYS HB3  . 15174 1 
       60 . 1 1 10 10 LYS HG2  H  1  1.48 0.02 . 2 . . . . 10 LYS HG2  . 15174 1 
       61 . 1 1 10 10 LYS HG3  H  1  1.57 0.02 . 2 . . . . 10 LYS HG3  . 15174 1 
       62 . 1 1 10 10 LYS HD2  H  1  1.69 0.02 . 1 . . . . 10 LYS HD2  . 15174 1 
       63 . 1 1 10 10 LYS HD3  H  1  1.69 0.02 . 1 . . . . 10 LYS HD3  . 15174 1 
       64 . 1 1 10 10 LYS HE2  H  1  3.04 0.02 . 1 . . . . 10 LYS HE2  . 15174 1 
       65 . 1 1 10 10 LYS HE3  H  1  3.04 0.02 . 1 . . . . 10 LYS HE3  . 15174 1 
       66 . 1 1 10 10 LYS CA   C 13 53.7  0.02 . 1 . . . . 10 LYS CA   . 15174 1 
       67 . 1 1 11 11 HYP HA   H  1  4.62 0.02 . 1 . . . . 11 HYP HA   . 15174 1 
       68 . 1 1 11 11 HYP HB2  H  1  2    0.02 . 2 . . . . 11 HYP HB2  . 15174 1 
       69 . 1 1 11 11 HYP HB3  H  1  2.39 0.02 . 2 . . . . 11 HYP HB3  . 15174 1 
       70 . 1 1 11 11 HYP HG   H  1  5.18 0.02 . 1 . . . . 11 HYP HG   . 15174 1 
       71 . 1 1 11 11 HYP HD22 H  1  3.8  0.02 . 2 . . . . 11 HYP HD2  . 15174 1 
       72 . 1 1 11 11 HYP HD23 H  1  3.9  0.02 . 2 . . . . 11 HYP HD3  . 15174 1 
       73 . 1 1 11 11 HYP CA   C 13 61.1  0.02 . 1 . . . . 11 HYP CA   . 15174 1 
       74 . 1 1 12 12 CYS H    H  1  8.29 0.02 . 1 . . . . 12 CYS H    . 15174 1 
       75 . 1 1 12 12 CYS HA   H  1  4.81 0.02 . 1 . . . . 12 CYS HA   . 15174 1 
       76 . 1 1 12 12 CYS HB2  H  1  3.1  0.02 . 2 . . . . 12 CYS HB2  . 15174 1 
       77 . 1 1 12 12 CYS HB3  H  1  3.17 0.02 . 2 . . . . 12 CYS HB3  . 15174 1 
       78 . 1 1 12 12 CYS CA   C 13 54.4  0.02 . 1 . . . . 12 CYS CA   . 15174 1 
       79 . 1 1 13 13 GLU H    H  1  8.79 0.02 . 1 . . . . 13 GLU H    . 15174 1 
       80 . 1 1 13 13 GLU HA   H  1  4.16 0.02 . 1 . . . . 13 GLU HA   . 15174 1 
       81 . 1 1 13 13 GLU HB2  H  1  1.44 0.02 . 2 . . . . 13 GLU HB2  . 15174 1 
       82 . 1 1 13 13 GLU HB3  H  1  1.63 0.02 . 2 . . . . 13 GLU HB3  . 15174 1 
       83 . 1 1 13 13 GLU HG2  H  1  1.77 0.02 . 2 . . . . 13 GLU HG2  . 15174 1 
       84 . 1 1 13 13 GLU HG3  H  1  1.95 0.02 . 2 . . . . 13 GLU HG3  . 15174 1 
       85 . 1 1 13 13 GLU CA   C 13 57.1  0.02 . 1 . . . . 13 GLU CA   . 15174 1 
       86 . 1 1 14 14 TYR H    H  1  7.91 0.02 . 1 . . . . 14 TYR H    . 15174 1 
       87 . 1 1 14 14 TYR HA   H  1  4.82 0.02 . 1 . . . . 14 TYR HA   . 15174 1 
       88 . 1 1 14 14 TYR HB2  H  1  2.55 0.02 . 2 . . . . 14 TYR HB2  . 15174 1 
       89 . 1 1 14 14 TYR HB3  H  1  3.39 0.02 . 2 . . . . 14 TYR HB3  . 15174 1 
       90 . 1 1 14 14 TYR HD1  H  1  6.81 0.02 . 1 . . . . 14 TYR HD1  . 15174 1 
       91 . 1 1 14 14 TYR HD2  H  1  6.81 0.02 . 1 . . . . 14 TYR HD2  . 15174 1 
       92 . 1 1 14 14 TYR HE1  H  1  7.21 0.02 . 1 . . . . 14 TYR HE1  . 15174 1 
       93 . 1 1 14 14 TYR HE2  H  1  7.21 0.02 . 1 . . . . 14 TYR HE2  . 15174 1 
       94 . 1 1 14 14 TYR CA   C 13 55.5  0.02 . 1 . . . . 14 TYR CA   . 15174 1 
       95 . 1 1 15 15 HIS H    H  1  8.5  0.02 . 1 . . . . 15 HIS H    . 15174 1 
       96 . 1 1 15 15 HIS HA   H  1  4.51 0.02 . 1 . . . . 15 HIS HA   . 15174 1 
       97 . 1 1 15 15 HIS HB2  H  1  3.07 0.02 . 1 . . . . 15 HIS HB2  . 15174 1 
       98 . 1 1 15 15 HIS HB3  H  1  3.07 0.02 . 1 . . . . 15 HIS HB3  . 15174 1 
       99 . 1 1 15 15 HIS HD1  H  1  7.13 0.02 . 1 . . . . 15 HIS HD1  . 15174 1 
      100 . 1 1 15 15 HIS HE2  H  1  7.78 0.02 . 1 . . . . 15 HIS HE2  . 15174 1 
      101 . 1 1 15 15 HIS CA   C 13 57.1  0.02 . 1 . . . . 15 HIS CA   . 15174 1 
      102 . 1 1 16 16 ALA H    H  1  8.32 0.02 . 1 . . . . 16 ALA H    . 15174 1 
      103 . 1 1 16 16 ALA HA   H  1  4.24 0.02 . 1 . . . . 16 ALA HA   . 15174 1 
      104 . 1 1 16 16 ALA HB1  H  1  1.45 0.02 . 1 . . . . 16 ALA HB   . 15174 1 
      105 . 1 1 16 16 ALA HB2  H  1  1.45 0.02 . 1 . . . . 16 ALA HB   . 15174 1 
      106 . 1 1 16 16 ALA HB3  H  1  1.45 0.02 . 1 . . . . 16 ALA HB   . 15174 1 
      107 . 1 1 16 16 ALA CA   C 13 54.1  0.02 . 1 . . . . 16 ALA CA   . 15174 1 
      108 . 1 1 17 17 ASP H    H  1  7.88 0.02 . 1 . . . . 17 ASP H    . 15174 1 
      109 . 1 1 17 17 ASP HA   H  1  4.45 0.02 . 1 . . . . 17 ASP HA   . 15174 1 
      110 . 1 1 17 17 ASP HB2  H  1  2.7  0.02 . 2 . . . . 17 ASP HB2  . 15174 1 
      111 . 1 1 17 17 ASP HB3  H  1  3.2  0.02 . 2 . . . . 17 ASP HB3  . 15174 1 
      112 . 1 1 17 17 ASP CA   C 13 55.2  0.02 . 1 . . . . 17 ASP CA   . 15174 1 
      113 . 1 1 18 18 CYS H    H  1  8.08 0.02 . 1 . . . . 18 CYS H    . 15174 1 
      114 . 1 1 18 18 CYS HA   H  1  4.92 0.02 . 1 . . . . 18 CYS HA   . 15174 1 
      115 . 1 1 18 18 CYS HB2  H  1  2.56 0.02 . 2 . . . . 18 CYS HB2  . 15174 1 
      116 . 1 1 18 18 CYS HB3  H  1  3.16 0.02 . 2 . . . . 18 CYS HB3  . 15174 1 
      117 . 1 1 18 18 CYS CA   C 13 54    0.02 . 1 . . . . 18 CYS CA   . 15174 1 
      118 . 1 1 19 19 CYS H    H  1  9.21 0.02 . 1 . . . . 19 CYS H    . 15174 1 
      119 . 1 1 19 19 CYS HA   H  1  4.51 0.02 . 1 . . . . 19 CYS HA   . 15174 1 
      120 . 1 1 19 19 CYS HB2  H  1  2.59 0.02 . 2 . . . . 19 CYS HB2  . 15174 1 
      121 . 1 1 19 19 CYS HB3  H  1  3.14 0.02 . 2 . . . . 19 CYS HB3  . 15174 1 
      122 . 1 1 19 19 CYS CA   C 13 54.3  0.02 . 1 . . . . 19 CYS CA   . 15174 1 
      123 . 1 1 20 20 ASN H    H  1  8.58 0.02 . 1 . . . . 20 ASN H    . 15174 1 
      124 . 1 1 20 20 ASN HA   H  1  5.03 0.02 . 1 . . . . 20 ASN HA   . 15174 1 
      125 . 1 1 20 20 ASN HB2  H  1  2.42 0.02 . 2 . . . . 20 ASN HB2  . 15174 1 
      126 . 1 1 20 20 ASN HB3  H  1  2.78 0.02 . 2 . . . . 20 ASN HB3  . 15174 1 
      127 . 1 1 20 20 ASN HD21 H  1  6.76 0.02 . 1 . . . . 20 ASN HD21 . 15174 1 
      128 . 1 1 20 20 ASN HD22 H  1  9.13 0.02 . 1 . . . . 20 ASN HD22 . 15174 1 
      129 . 1 1 20 20 ASN CA   C 13 53.2  0.02 . 1 . . . . 20 ASN CA   . 15174 1 
      130 . 1 1 21 21 CYS H    H  1  8.12 0.02 . 1 . . . . 21 CYS H    . 15174 1 
      131 . 1 1 21 21 CYS HA   H  1  5.25 0.02 . 1 . . . . 21 CYS HA   . 15174 1 
      132 . 1 1 21 21 CYS HB2  H  1  2.65 0.02 . 2 . . . . 21 CYS HB2  . 15174 1 
      133 . 1 1 21 21 CYS HB3  H  1  3.09 0.02 . 2 . . . . 21 CYS HB3  . 15174 1 
      134 . 1 1 21 21 CYS CA   C 13 53    0.02 . 1 . . . . 21 CYS CA   . 15174 1 
      135 . 1 1 22 22 CYS H    H  1 12.1  0.02 . 1 . . . . 22 CYS H    . 15174 1 
      136 . 1 1 22 22 CYS HA   H  1  5.08 0.02 . 1 . . . . 22 CYS HA   . 15174 1 
      137 . 1 1 22 22 CYS HB2  H  1  2.56 0.02 . 2 . . . . 22 CYS HB2  . 15174 1 
      138 . 1 1 22 22 CYS HB3  H  1  2.79 0.02 . 2 . . . . 22 CYS HB3  . 15174 1 
      139 . 1 1 22 22 CYS CA   C 13 55.8  0.02 . 1 . . . . 22 CYS CA   . 15174 1 
      140 . 1 1 23 23 LEU H    H  1  8.75 0.02 . 1 . . . . 23 LEU H    . 15174 1 
      141 . 1 1 23 23 LEU HA   H  1  4.71 0.02 . 1 . . . . 23 LEU HA   . 15174 1 
      142 . 1 1 23 23 LEU HB2  H  1  1.54 0.02 . 2 . . . . 23 LEU HB2  . 15174 1 
      143 . 1 1 23 23 LEU HB3  H  1  1.62 0.02 . 2 . . . . 23 LEU HB3  . 15174 1 
      144 . 1 1 23 23 LEU HG   H  1  1.48 0.02 . 1 . . . . 23 LEU HG   . 15174 1 
      145 . 1 1 23 23 LEU HD11 H  1  0.82 0.02 . 2 . . . . 23 LEU HD1  . 15174 1 
      146 . 1 1 23 23 LEU HD12 H  1  0.82 0.02 . 2 . . . . 23 LEU HD1  . 15174 1 
      147 . 1 1 23 23 LEU HD13 H  1  0.82 0.02 . 2 . . . . 23 LEU HD1  . 15174 1 
      148 . 1 1 23 23 LEU HD21 H  1  1.07 0.02 . 2 . . . . 23 LEU HD2  . 15174 1 
      149 . 1 1 23 23 LEU HD22 H  1  1.07 0.02 . 2 . . . . 23 LEU HD2  . 15174 1 
      150 . 1 1 23 23 LEU HD23 H  1  1.07 0.02 . 2 . . . . 23 LEU HD2  . 15174 1 
      151 . 1 1 23 23 LEU CA   C 13 57.5  0.02 . 1 . . . . 23 LEU CA   . 15174 1 
      152 . 1 1 24 24 SER H    H  1  8.92 0.02 . 1 . . . . 24 SER H    . 15174 1 
      153 . 1 1 24 24 SER HA   H  1  3.88 0.02 . 1 . . . . 24 SER HA   . 15174 1 
      154 . 1 1 24 24 SER HB2  H  1  3.83 0.02 . 2 . . . . 24 SER HB2  . 15174 1 
      155 . 1 1 24 24 SER HB3  H  1  4.09 0.02 . 2 . . . . 24 SER HB3  . 15174 1 
      156 . 1 1 24 24 SER CA   C 13 58.3  0.02 . 1 . . . . 24 SER CA   . 15174 1 
      157 . 1 1 25 25 GLY H    H  1  7.61 0.02 . 1 . . . . 25 GLY H    . 15174 1 
      158 . 1 1 25 25 GLY HA2  H  1  3.8  0.02 . 2 . . . . 25 GLY HA2  . 15174 1 
      159 . 1 1 25 25 GLY HA3  H  1  4.09 0.02 . 2 . . . . 25 GLY HA3  . 15174 1 
      160 . 1 1 25 25 GLY CA   C 13 45.7  0.02 . 1 . . . . 25 GLY CA   . 15174 1 
      161 . 1 1 26 26 ILE H    H  1  7.53 0.02 . 1 . . . . 26 ILE H    . 15174 1 
      162 . 1 1 26 26 ILE HA   H  1  4.72 0.02 . 1 . . . . 26 ILE HA   . 15174 1 
      163 . 1 1 26 26 ILE HB   H  1  1.62 0.02 . 1 . . . . 26 ILE HB   . 15174 1 
      164 . 1 1 26 26 ILE HG12 H  1  1.08 0.02 . 2 . . . . 26 ILE HG12 . 15174 1 
      165 . 1 1 26 26 ILE HG13 H  1  1.37 0.02 . 2 . . . . 26 ILE HG13 . 15174 1 
      166 . 1 1 26 26 ILE HG21 H  1  0.81 0.02 . 1 . . . . 26 ILE HG2  . 15174 1 
      167 . 1 1 26 26 ILE HG22 H  1  0.81 0.02 . 1 . . . . 26 ILE HG2  . 15174 1 
      168 . 1 1 26 26 ILE HG23 H  1  0.81 0.02 . 1 . . . . 26 ILE HG2  . 15174 1 
      169 . 1 1 26 26 ILE HD11 H  1  0.75 0.02 . 1 . . . . 26 ILE HD1  . 15174 1 
      170 . 1 1 26 26 ILE HD12 H  1  0.75 0.02 . 1 . . . . 26 ILE HD1  . 15174 1 
      171 . 1 1 26 26 ILE HD13 H  1  0.75 0.02 . 1 . . . . 26 ILE HD1  . 15174 1 
      172 . 1 1 26 26 ILE CA   C 13 59.3  0.02 . 1 . . . . 26 ILE CA   . 15174 1 
      173 . 1 1 27 27 CYS H    H  1  9    0.02 . 1 . . . . 27 CYS H    . 15174 1 
      174 . 1 1 27 27 CYS HA   H  1  5.64 0.02 . 1 . . . . 27 CYS HA   . 15174 1 
      175 . 1 1 27 27 CYS HB2  H  1  3.02 0.02 . 2 . . . . 27 CYS HB2  . 15174 1 
      176 . 1 1 27 27 CYS HB3  H  1  3.72 0.02 . 2 . . . . 27 CYS HB3  . 15174 1 
      177 . 1 1 27 27 CYS CA   C 13 54.1  0.02 . 1 . . . . 27 CYS CA   . 15174 1 
      178 . 1 1 28 28 ALA H    H  1 10.34 0.02 . 1 . . . . 28 ALA H    . 15174 1 
      179 . 1 1 28 28 ALA HA   H  1  4.63 0.02 . 1 . . . . 28 ALA HA   . 15174 1 
      180 . 1 1 28 28 ALA HB1  H  1  1.38 0.02 . 1 . . . . 28 ALA HB   . 15174 1 
      181 . 1 1 28 28 ALA HB2  H  1  1.38 0.02 . 1 . . . . 28 ALA HB   . 15174 1 
      182 . 1 1 28 28 ALA HB3  H  1  1.38 0.02 . 1 . . . . 28 ALA HB   . 15174 1 
      183 . 1 1 28 28 ALA CA   C 13 51.8  0.02 . 1 . . . . 28 ALA CA   . 15174 1 
      184 . 1 1 29 29 HYP HA   H  1  4.54 0.02 . 1 . . . . 29 HYP HA   . 15174 1 
      185 . 1 1 29 29 HYP HB2  H  1  1.82 0.02 . 2 . . . . 29 HYP HB2  . 15174 1 
      186 . 1 1 29 29 HYP HB3  H  1  2.32 0.02 . 2 . . . . 29 HYP HB3  . 15174 1 
      187 . 1 1 29 29 HYP HG   H  1  4.5  0.02 . 1 . . . . 29 HYP HG   . 15174 1 
      188 . 1 1 29 29 HYP HD22 H  1  3.66 0.02 . 2 . . . . 29 HYP HD2  . 15174 1 
      189 . 1 1 29 29 HYP HD23 H  1  3.8  0.02 . 2 . . . . 29 HYP HD3  . 15174 1 
      190 . 1 1 29 29 HYP CA   C 13 61.9  0.02 . 1 . . . . 29 HYP CA   . 15174 1 
      191 . 1 1 30 30 SER H    H  1  8.58 0.02 . 1 . . . . 30 SER H    . 15174 1 
      192 . 1 1 30 30 SER HA   H  1  4.28 0.02 . 1 . . . . 30 SER HA   . 15174 1 
      193 . 1 1 30 30 SER HB2  H  1  3.76 0.02 . 2 . . . . 30 SER HB2  . 15174 1 
      194 . 1 1 30 30 SER HB3  H  1  3.98 0.02 . 2 . . . . 30 SER HB3  . 15174 1 
      195 . 1 1 30 30 SER CA   C 13 58.4  0.02 . 1 . . . . 30 SER CA   . 15174 1 
      196 . 1 1 31 31 THR H    H  1  7.98 0.02 . 1 . . . . 31 THR H    . 15174 1 
      197 . 1 1 31 31 THR HA   H  1  4.23 0.02 . 1 . . . . 31 THR HA   . 15174 1 
      198 . 1 1 31 31 THR HB   H  1  4.23 0.02 . 1 . . . . 31 THR HB   . 15174 1 
      199 . 1 1 31 31 THR HG21 H  1  1.16 0.02 . 1 . . . . 31 THR HG2  . 15174 1 
      200 . 1 1 31 31 THR HG22 H  1  1.16 0.02 . 1 . . . . 31 THR HG2  . 15174 1 
      201 . 1 1 31 31 THR HG23 H  1  1.16 0.02 . 1 . . . . 31 THR HG2  . 15174 1 
      202 . 1 1 31 31 THR CA   C 13 62.3  0.02 . 1 . . . . 31 THR CA   . 15174 1 
      203 . 1 1 32 32 ASN H    H  1  8.26 0.02 . 1 . . . . 32 ASN H    . 15174 1 
      204 . 1 1 32 32 ASN HA   H  1  4.58 0.02 . 1 . . . . 32 ASN HA   . 15174 1 
      205 . 1 1 32 32 ASN HB2  H  1  2.59 0.02 . 2 . . . . 32 ASN HB2  . 15174 1 
      206 . 1 1 32 32 ASN HB3  H  1  2.78 0.02 . 2 . . . . 32 ASN HB3  . 15174 1 
      207 . 1 1 32 32 ASN HD21 H  1  6.76 0.02 . 1 . . . . 32 ASN HD21 . 15174 1 
      208 . 1 1 32 32 ASN HD22 H  1  7.4  0.02 . 1 . . . . 32 ASN HD22 . 15174 1 
      209 . 1 1 32 32 ASN CA   C 13 53.6  0.02 . 1 . . . . 32 ASN CA   . 15174 1 
      210 . 1 1 33 33 TRP H    H  1  7.9  0.02 . 1 . . . . 33 TRP H    . 15174 1 
      211 . 1 1 33 33 TRP HA   H  1  4.65 0.02 . 1 . . . . 33 TRP HA   . 15174 1 
      212 . 1 1 33 33 TRP HB2  H  1  3.26 0.02 . 1 . . . . 33 TRP HB2  . 15174 1 
      213 . 1 1 33 33 TRP HB3  H  1  3.26 0.02 . 1 . . . . 33 TRP HB3  . 15174 1 
      214 . 1 1 33 33 TRP HD1  H  1  7.23 0.02 . 1 . . . . 33 TRP HD1  . 15174 1 
      215 . 1 1 33 33 TRP HE1  H  1 10.07 0.02 . 1 . . . . 33 TRP HE1  . 15174 1 
      216 . 1 1 33 33 TRP HZ2  H  1  7.48 0.02 . 4 . . . . 33 TRP HZ2  . 15174 1 
      217 . 1 1 33 33 TRP HZ3  H  1  7.62 0.02 . 4 . . . . 33 TRP HZ3  . 15174 1 
      218 . 1 1 33 33 TRP HH2  H  1  7.15 0.02 . 1 . . . . 33 TRP HH2  . 15174 1 
      219 . 1 1 33 33 TRP CA   C 13 57.7  0.02 . 1 . . . . 33 TRP CA   . 15174 1 
      220 . 1 1 34 34 ILE H    H  1  7.64 0.02 . 1 . . . . 34 ILE H    . 15174 1 
      221 . 1 1 34 34 ILE HA   H  1  3.98 0.02 . 1 . . . . 34 ILE HA   . 15174 1 
      222 . 1 1 34 34 ILE HB   H  1  1.7  0.02 . 1 . . . . 34 ILE HB   . 15174 1 
      223 . 1 1 34 34 ILE HG12 H  1  0.73 0.02 . 2 . . . . 34 ILE HG12 . 15174 1 
      224 . 1 1 34 34 ILE HG13 H  1  0.93 0.02 . 2 . . . . 34 ILE HG13 . 15174 1 
      225 . 1 1 34 34 ILE HG21 H  1  1.48 0.02 . 1 . . . . 34 ILE HG2  . 15174 1 
      226 . 1 1 34 34 ILE HG22 H  1  1.48 0.02 . 1 . . . . 34 ILE HG2  . 15174 1 
      227 . 1 1 34 34 ILE HG23 H  1  1.48 0.02 . 1 . . . . 34 ILE HG2  . 15174 1 
      228 . 1 1 34 34 ILE HD11 H  1  1.16 0.02 . 1 . . . . 34 ILE HD1  . 15174 1 
      229 . 1 1 34 34 ILE HD12 H  1  1.16 0.02 . 1 . . . . 34 ILE HD1  . 15174 1 
      230 . 1 1 34 34 ILE HD13 H  1  1.16 0.02 . 1 . . . . 34 ILE HD1  . 15174 1 
      231 . 1 1 34 34 ILE CA   C 13 62.2  0.02 . 1 . . . . 34 ILE CA   . 15174 1 
      232 . 1 1 35 35 LEU H    H  1  7.58 0.02 . 1 . . . . 35 LEU H    . 15174 1 
      233 . 1 1 35 35 LEU HA   H  1  4.68 0.02 . 1 . . . . 35 LEU HA   . 15174 1 
      234 . 1 1 35 35 LEU HB2  H  1  1.48 0.02 . 1 . . . . 35 LEU HB2  . 15174 1 
      235 . 1 1 35 35 LEU HB3  H  1  1.48 0.02 . 1 . . . . 35 LEU HB3  . 15174 1 
      236 . 1 1 35 35 LEU HD11 H  1  0.88 0.02 . 2 . . . . 35 LEU HD1  . 15174 1 
      237 . 1 1 35 35 LEU HD12 H  1  0.88 0.02 . 2 . . . . 35 LEU HD1  . 15174 1 
      238 . 1 1 35 35 LEU HD13 H  1  0.88 0.02 . 2 . . . . 35 LEU HD1  . 15174 1 
      239 . 1 1 35 35 LEU HD21 H  1  0.88 0.02 . 2 . . . . 35 LEU HD2  . 15174 1 
      240 . 1 1 35 35 LEU HD22 H  1  0.88 0.02 . 2 . . . . 35 LEU HD2  . 15174 1 
      241 . 1 1 35 35 LEU HD23 H  1  0.88 0.02 . 2 . . . . 35 LEU HD2  . 15174 1 
      242 . 1 1 35 35 LEU CA   C 13 52.6  0.02 . 1 . . . . 35 LEU CA   . 15174 1 
      243 . 1 1 36 36 PRO HA   H  1  4.41 0.02 . 1 . . . . 36 PRO HA   . 15174 1 
      244 . 1 1 36 36 PRO HB2  H  1  1.91 0.02 . 2 . . . . 36 PRO HB2  . 15174 1 
      245 . 1 1 36 36 PRO HB3  H  1  2.28 0.02 . 2 . . . . 36 PRO HB3  . 15174 1 
      246 . 1 1 36 36 PRO HG2  H  1  2.02 0.02 . 1 . . . . 36 PRO HG2  . 15174 1 
      247 . 1 1 36 36 PRO HG3  H  1  2.02 0.02 . 1 . . . . 36 PRO HG3  . 15174 1 
      248 . 1 1 36 36 PRO HD2  H  1  3.63 0.02 . 2 . . . . 36 PRO HD2  . 15174 1 
      249 . 1 1 36 36 PRO HD3  H  1  3.77 0.02 . 2 . . . . 36 PRO HD3  . 15174 1 
      250 . 1 1 36 36 PRO CA   C 13 63.7  0.02 . 1 . . . . 36 PRO CA   . 15174 1 
      251 . 1 1 37 37 GLY H    H  1  8.4  0.02 . 1 . . . . 37 GLY H    . 15174 1 
      252 . 1 1 37 37 GLY HA2  H  1  3.84 0.02 . 2 . . . . 37 GLY HA2  . 15174 1 
      253 . 1 1 37 37 GLY HA3  H  1  4.15 0.02 . 2 . . . . 37 GLY HA3  . 15174 1 
      254 . 1 1 37 37 GLY CA   C 13 45.5  0.02 . 1 . . . . 37 GLY CA   . 15174 1 
      255 . 1 1 38 38 CYS H    H  1  8.31 0.02 . 1 . . . . 38 CYS H    . 15174 1 
      256 . 1 1 38 38 CYS HA   H  1  4.47 0.02 . 1 . . . . 38 CYS HA   . 15174 1 
      257 . 1 1 38 38 CYS HB2  H  1  2.07 0.02 . 2 . . . . 38 CYS HB2  . 15174 1 
      258 . 1 1 38 38 CYS HB3  H  1  2.29 0.02 . 2 . . . . 38 CYS HB3  . 15174 1 
      259 . 1 1 39 39 SER H    H  1  8.47 0.02 . 1 . . . . 39 SER H    . 15174 1 
      260 . 1 1 39 39 SER HA   H  1  4.29 0.02 . 1 . . . . 39 SER HA   . 15174 1 
      261 . 1 1 39 39 SER HB2  H  1  3.75 0.02 . 2 . . . . 39 SER HB2  . 15174 1 
      262 . 1 1 39 39 SER HB3  H  1  3.96 0.02 . 2 . . . . 39 SER HB3  . 15174 1 
      263 . 1 1 40 40 THR H    H  1  8.15 0.02 . 1 . . . . 40 THR H    . 15174 1 
      264 . 1 1 40 40 THR HA   H  1  4.4  0.02 . 1 . . . . 40 THR HA   . 15174 1 
      265 . 1 1 40 40 THR HB   H  1  4.34 0.02 . 1 . . . . 40 THR HB   . 15174 1 
      266 . 1 1 40 40 THR HG21 H  1  1.24 0.02 . 1 . . . . 40 THR HG2  . 15174 1 
      267 . 1 1 40 40 THR HG22 H  1  1.24 0.02 . 1 . . . . 40 THR HG2  . 15174 1 
      268 . 1 1 40 40 THR HG23 H  1  1.24 0.02 . 1 . . . . 40 THR HG2  . 15174 1 
      269 . 1 1 40 40 THR CA   C 13 62.1  0.02 . 1 . . . . 40 THR CA   . 15174 1 
      270 . 1 1 41 41 SER H    H  1  8.24 0.02 . 1 . . . . 41 SER H    . 15174 1 
      271 . 1 1 41 41 SER HA   H  1  4.43 0.02 . 1 . . . . 41 SER HA   . 15174 1 
      272 . 1 1 41 41 SER HB2  H  1  3.83 0.02 . 2 . . . . 41 SER HB2  . 15174 1 
      273 . 1 1 41 41 SER HB3  H  1  3.89 0.02 . 2 . . . . 41 SER HB3  . 15174 1 
      274 . 1 1 41 41 SER CA   C 13 58.6  0.02 . 1 . . . . 41 SER CA   . 15174 1 
      275 . 1 1 42 42 SER H    H  1  8.26 0.02 . 1 . . . . 42 SER H    . 15174 1 
      276 . 1 1 42 42 SER HA   H  1  4.4  0.02 . 1 . . . . 42 SER HA   . 15174 1 
      277 . 1 1 42 42 SER HB2  H  1  3.75 0.02 . 1 . . . . 42 SER HB2  . 15174 1 
      278 . 1 1 42 42 SER HB3  H  1  3.75 0.02 . 1 . . . . 42 SER HB3  . 15174 1 
      279 . 1 1 42 42 SER CA   C 13 59.2  0.02 . 1 . . . . 42 SER CA   . 15174 1 
      280 . 1 1 43 43 PHE H    H  1  8.08 0.02 . 1 . . . . 43 PHE H    . 15174 1 
      281 . 1 1 43 43 PHE HA   H  1  4.52 0.02 . 1 . . . . 43 PHE HA   . 15174 1 
      282 . 1 1 43 43 PHE HB2  H  1  2.91 0.02 . 2 . . . . 43 PHE HB2  . 15174 1 
      283 . 1 1 43 43 PHE HB3  H  1  2.98 0.02 . 2 . . . . 43 PHE HB3  . 15174 1 
      284 . 1 1 43 43 PHE HD1  H  1  7.13 0.02 . 1 . . . . 43 PHE HD1  . 15174 1 
      285 . 1 1 43 43 PHE HD2  H  1  7.13 0.02 . 1 . . . . 43 PHE HD2  . 15174 1 
      286 . 1 1 43 43 PHE HE1  H  1  7.3  0.02 . 1 . . . . 43 PHE HE1  . 15174 1 
      287 . 1 1 43 43 PHE HE2  H  1  7.3  0.02 . 1 . . . . 43 PHE HE2  . 15174 1 
      288 . 1 1 43 43 PHE CA   C 13 58.1  0.02 . 1 . . . . 43 PHE CA   . 15174 1 
      289 . 1 1 44 44 PHE H    H  1  7.95 0.02 . 1 . . . . 44 PHE H    . 15174 1 
      290 . 1 1 44 44 PHE HA   H  1  4.56 0.02 . 1 . . . . 44 PHE HA   . 15174 1 
      291 . 1 1 44 44 PHE HB2  H  1  2.94 0.02 . 2 . . . . 44 PHE HB2  . 15174 1 
      292 . 1 1 44 44 PHE HB3  H  1  3.07 0.02 . 2 . . . . 44 PHE HB3  . 15174 1 
      293 . 1 1 44 44 PHE HD1  H  1  7.2  0.02 . 1 . . . . 44 PHE HD1  . 15174 1 
      294 . 1 1 44 44 PHE HD2  H  1  7.2  0.02 . 1 . . . . 44 PHE HD2  . 15174 1 
      295 . 1 1 44 44 PHE HE1  H  1  7.33 0.02 . 1 . . . . 44 PHE HE1  . 15174 1 
      296 . 1 1 44 44 PHE HE2  H  1  7.33 0.02 . 1 . . . . 44 PHE HE2  . 15174 1 
      297 . 1 1 44 44 PHE CA   C 13 57.7  0.02 . 1 . . . . 44 PHE CA   . 15174 1 
      298 . 1 1 45 45 LYS H    H  1  8.04 0.02 . 1 . . . . 45 LYS H    . 15174 1 
      299 . 1 1 45 45 LYS HA   H  1  4.28 0.02 . 1 . . . . 45 LYS HA   . 15174 1 
      300 . 1 1 45 45 LYS HB2  H  1  1.66 0.02 . 2 . . . . 45 LYS HB2  . 15174 1 
      301 . 1 1 45 45 LYS HB3  H  1  1.77 0.02 . 2 . . . . 45 LYS HB3  . 15174 1 
      302 . 1 1 45 45 LYS HG2  H  1  1.35 0.02 . 1 . . . . 45 LYS HG2  . 15174 1 
      303 . 1 1 45 45 LYS HG3  H  1  1.35 0.02 . 1 . . . . 45 LYS HG3  . 15174 1 
      304 . 1 1 45 45 LYS HE2  H  1  2.97 0.02 . 1 . . . . 45 LYS HE2  . 15174 1 
      305 . 1 1 45 45 LYS HE3  H  1  2.97 0.02 . 1 . . . . 45 LYS HE3  . 15174 1 
      306 . 1 1 45 45 LYS CA   C 13 56.4  0.02 . 1 . . . . 45 LYS CA   . 15174 1 
      307 . 1 1 46 46 ILE H    H  1  7.73 0.02 . 1 . . . . 46 ILE H    . 15174 1 
      308 . 1 1 46 46 ILE HA   H  1  4.03 0.02 . 1 . . . . 46 ILE HA   . 15174 1 
      309 . 1 1 46 46 ILE HB   H  1  1.79 0.02 . 1 . . . . 46 ILE HB   . 15174 1 
      310 . 1 1 46 46 ILE HG12 H  1  1.14 0.02 . 2 . . . . 46 ILE HG12 . 15174 1 
      311 . 1 1 46 46 ILE HG13 H  1  1.44 0.02 . 2 . . . . 46 ILE HG13 . 15174 1 
      312 . 1 1 46 46 ILE HG21 H  1  0.89 0.02 . 1 . . . . 46 ILE HG2  . 15174 1 
      313 . 1 1 46 46 ILE HG22 H  1  0.89 0.02 . 1 . . . . 46 ILE HG2  . 15174 1 
      314 . 1 1 46 46 ILE HG23 H  1  0.89 0.02 . 1 . . . . 46 ILE HG2  . 15174 1 
      315 . 1 1 46 46 ILE HD11 H  1  0.88 0.02 . 1 . . . . 46 ILE HD1  . 15174 1 
      316 . 1 1 46 46 ILE HD12 H  1  0.88 0.02 . 1 . . . . 46 ILE HD1  . 15174 1 
      317 . 1 1 46 46 ILE HD13 H  1  0.88 0.02 . 1 . . . . 46 ILE HD1  . 15174 1 
      318 . 1 1 46 46 ILE CA   C 13 63.2  0.02 . 1 . . . . 46 ILE CA   . 15174 1 

   stop_

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