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                      19623
   _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             0.05
   _Assigned_chem_shift_list.Chem_shift_13C_err            0.5
   _Assigned_chem_shift_list.Chem_shift_15N_err            0.5
   _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' 1 $sample_1 . 19623 1 
      2 '3D CBCA(CO)NH'  1 $sample_1 . 19623 1 
      3 '3D HNCACB'      1 $sample_1 . 19623 1 
      4 '3D HNHA'        1 $sample_1 . 19623 1 
      5 '3D HNCO'        1 $sample_1 . 19623 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 ASN C   C 13 175.052 0.500 . 1 . . . A  1 ASN C   . 19623 1 
        2 . 1 1  1  1 ASN CA  C 13  54.283 0.500 . 1 . . . A  1 ASN CA  . 19623 1 
        3 . 1 1  1  1 ASN CB  C 13  37.449 0.500 . 1 . . . A  1 ASN CB  . 19623 1 
        4 . 1 1  2  2 GLY H   H  1   8.533 0.005 . 1 . . . A  2 GLY H   . 19623 1 
        5 . 1 1  2  2 GLY HA2 H  1   3.943 0.050 . 1 . . . A  2 GLY HA2 . 19623 1 
        6 . 1 1  2  2 GLY HA3 H  1   3.943 0.050 . 1 . . . A  2 GLY HA3 . 19623 1 
        7 . 1 1  2  2 GLY C   C 13 173.996 0.500 . 1 . . . A  2 GLY C   . 19623 1 
        8 . 1 1  2  2 GLY CA  C 13  45.211 0.199 . 1 . . . A  2 GLY CA  . 19623 1 
        9 . 1 1  2  2 GLY N   N 15 113.169 0.500 . 1 . . . A  2 GLY N   . 19623 1 
       10 . 1 1  3  3 ASP H   H  1   8.412 0.005 . 1 . . . A  3 ASP H   . 19623 1 
       11 . 1 1  3  3 ASP HA  H  1   4.559 0.050 . 1 . . . A  3 ASP HA  . 19623 1 
       12 . 1 1  3  3 ASP C   C 13 176.675 0.500 . 1 . . . A  3 ASP C   . 19623 1 
       13 . 1 1  3  3 ASP CA  C 13  54.489 0.167 . 1 . . . A  3 ASP CA  . 19623 1 
       14 . 1 1  3  3 ASP CB  C 13  41.197 0.096 . 1 . . . A  3 ASP CB  . 19623 1 
       15 . 1 1  3  3 ASP N   N 15 120.717 0.034 . 1 . . . A  3 ASP N   . 19623 1 
       16 . 1 1  4  4 LYS H   H  1   8.49  0.004 . 1 . . . A  4 LYS H   . 19623 1 
       17 . 1 1  4  4 LYS HA  H  1   4.246 0.050 . 1 . . . A  4 LYS HA  . 19623 1 
       18 . 1 1  4  4 LYS C   C 13 177.301 0.500 . 1 . . . A  4 LYS C   . 19623 1 
       19 . 1 1  4  4 LYS CA  C 13  56.606 0.015 . 1 . . . A  4 LYS CA  . 19623 1 
       20 . 1 1  4  4 LYS CB  C 13  32.436 0.058 . 1 . . . A  4 LYS CB  . 19623 1 
       21 . 1 1  4  4 LYS N   N 15 121.955 0.066 . 1 . . . A  4 LYS N   . 19623 1 
       22 . 1 1  5  5 GLY H   H  1   8.491 0.001 . 1 . . . A  5 GLY H   . 19623 1 
       23 . 1 1  5  5 GLY HA2 H  1   3.884 0.050 . 1 . . . A  5 GLY HA2 . 19623 1 
       24 . 1 1  5  5 GLY HA3 H  1   3.884 0.050 . 1 . . . A  5 GLY HA3 . 19623 1 
       25 . 1 1  5  5 GLY C   C 13 174.045 0.500 . 1 . . . A  5 GLY C   . 19623 1 
       26 . 1 1  5  5 GLY CA  C 13  45.305 0.058 . 1 . . . A  5 GLY CA  . 19623 1 
       27 . 1 1  5  5 GLY N   N 15 109.376 0.050 . 1 . . . A  5 GLY N   . 19623 1 
       28 . 1 1  6  6 TYR H   H  1   8.134 0.005 . 1 . . . A  6 TYR H   . 19623 1 
       29 . 1 1  6  6 TYR HA  H  1   4.51  0.050 . 1 . . . A  6 TYR HA  . 19623 1 
       30 . 1 1  6  6 TYR C   C 13 175.952 0.500 . 1 . . . A  6 TYR C   . 19623 1 
       31 . 1 1  6  6 TYR CA  C 13  58.383 0.073 . 1 . . . A  6 TYR CA  . 19623 1 
       32 . 1 1  6  6 TYR CB  C 13  38.562 0.035 . 1 . . . A  6 TYR CB  . 19623 1 
       33 . 1 1  6  6 TYR N   N 15 120.416 0.057 . 1 . . . A  6 TYR N   . 19623 1 
       34 . 1 1  7  7 ASN H   H  1   8.557 0.005 . 1 . . . A  7 ASN H   . 19623 1 
       35 . 1 1  7  7 ASN HA  H  1   4.588 0.050 . 1 . . . A  7 ASN HA  . 19623 1 
       36 . 1 1  7  7 ASN C   C 13 175.521 0.500 . 1 . . . A  7 ASN C   . 19623 1 
       37 . 1 1  7  7 ASN CA  C 13  53.408 0.104 . 1 . . . A  7 ASN CA  . 19623 1 
       38 . 1 1  7  7 ASN CB  C 13  38.78  0.051 . 1 . . . A  7 ASN CB  . 19623 1 
       39 . 1 1  7  7 ASN N   N 15 122.415 0.057 . 1 . . . A  7 ASN N   . 19623 1 
       40 . 1 1  8  8 GLY H   H  1   8.285 0.001 . 1 . . . A  8 GLY H   . 19623 1 
       41 . 1 1  8  8 GLY HA2 H  1   3.865 0.050 . 1 . . . A  8 GLY HA2 . 19623 1 
       42 . 1 1  8  8 GLY HA3 H  1   3.865 0.050 . 1 . . . A  8 GLY HA3 . 19623 1 
       43 . 1 1  8  8 GLY C   C 13 175.609 0.500 . 1 . . . A  8 GLY C   . 19623 1 
       44 . 1 1  8  8 GLY CA  C 13  45.99  0.039 . 1 . . . A  8 GLY CA  . 19623 1 
       45 . 1 1  8  8 GLY N   N 15 109.431 0.039 . 1 . . . A  8 GLY N   . 19623 1 
       46 . 1 1  9  9 LEU H   H  1   8.136 0.006 . 1 . . . A  9 LEU H   . 19623 1 
       47 . 1 1  9  9 LEU HA  H  1   3.933 0.050 . 1 . . . A  9 LEU HA  . 19623 1 
       48 . 1 1  9  9 LEU C   C 13 177.458 0.500 . 1 . . . A  9 LEU C   . 19623 1 
       49 . 1 1  9  9 LEU CA  C 13  58.248 0.171 . 1 . . . A  9 LEU CA  . 19623 1 
       50 . 1 1  9  9 LEU CB  C 13  41.69  0.114 . 1 . . . A  9 LEU CB  . 19623 1 
       51 . 1 1  9  9 LEU N   N 15 123.596 0.051 . 1 . . . A  9 LEU N   . 19623 1 
       52 . 1 1 10 10 ALA H   H  1   8.361 0.003 . 1 . . . A 10 ALA H   . 19623 1 
       53 . 1 1 10 10 ALA HA  H  1   3.933 0.050 . 1 . . . A 10 ALA HA  . 19623 1 
       54 . 1 1 10 10 ALA C   C 13 181.14  0.500 . 1 . . . A 10 ALA C   . 19623 1 
       55 . 1 1 10 10 ALA CA  C 13  55.505 0.088 . 1 . . . A 10 ALA CA  . 19623 1 
       56 . 1 1 10 10 ALA CB  C 13  17.791 0.074 . 1 . . . A 10 ALA CB  . 19623 1 
       57 . 1 1 10 10 ALA N   N 15 121.31  0.092 . 1 . . . A 10 ALA N   . 19623 1 
       58 . 1 1 11 11 GLU H   H  1   8.49  0.003 . 1 . . . A 11 GLU H   . 19623 1 
       59 . 1 1 11 11 GLU HA  H  1   3.992 0.050 . 1 . . . A 11 GLU HA  . 19623 1 
       60 . 1 1 11 11 GLU C   C 13 178.797 0.500 . 1 . . . A 11 GLU C   . 19623 1 
       61 . 1 1 11 11 GLU CA  C 13  59.892 0.095 . 1 . . . A 11 GLU CA  . 19623 1 
       62 . 1 1 11 11 GLU CB  C 13  28.991 0.061 . 1 . . . A 11 GLU CB  . 19623 1 
       63 . 1 1 11 11 GLU N   N 15 118.893 0.329 . 1 . . . A 11 GLU N   . 19623 1 
       64 . 1 1 12 12 ALA H   H  1   8.099 0.008 . 1 . . . A 12 ALA H   . 19623 1 
       65 . 1 1 12 12 ALA HA  H  1   4.08  0.050 . 1 . . . A 12 ALA HA  . 19623 1 
       66 . 1 1 12 12 ALA C   C 13 181.228 0.500 . 1 . . . A 12 ALA C   . 19623 1 
       67 . 1 1 12 12 ALA CA  C 13  55.218 0.036 . 1 . . . A 12 ALA CA  . 19623 1 
       68 . 1 1 12 12 ALA CB  C 13  18.462 0.107 . 1 . . . A 12 ALA CB  . 19623 1 
       69 . 1 1 12 12 ALA N   N 15 122.362 0.022 . 1 . . . A 12 ALA N   . 19623 1 
       70 . 1 1 13 13 LYS H   H  1   8.382 0.007 . 1 . . . A 13 LYS H   . 19623 1 
       71 . 1 1 13 13 LYS HA  H  1   3.62  0.050 . 1 . . . A 13 LYS HA  . 19623 1 
       72 . 1 1 13 13 LYS C   C 13 177.203 0.500 . 1 . . . A 13 LYS C   . 19623 1 
       73 . 1 1 13 13 LYS CA  C 13  60.39  0.084 . 1 . . . A 13 LYS CA  . 19623 1 
       74 . 1 1 13 13 LYS CB  C 13  33.624 0.191 . 1 . . . A 13 LYS CB  . 19623 1 
       75 . 1 1 13 13 LYS N   N 15 118.689 0.075 . 1 . . . A 13 LYS N   . 19623 1 
       76 . 1 1 14 14 GLU H   H  1   7.952 0.007 . 1 . . . A 14 GLU H   . 19623 1 
       77 . 1 1 14 14 GLU HA  H  1   4.285 0.050 . 1 . . . A 14 GLU HA  . 19623 1 
       78 . 1 1 14 14 GLU C   C 13 179.404 0.500 . 1 . . . A 14 GLU C   . 19623 1 
       79 . 1 1 14 14 GLU CA  C 13  60.007 0.014 . 1 . . . A 14 GLU CA  . 19623 1 
       80 . 1 1 14 14 GLU CB  C 13  29.418 0.025 . 1 . . . A 14 GLU CB  . 19623 1 
       81 . 1 1 14 14 GLU N   N 15 117.865 0.068 . 1 . . . A 14 GLU N   . 19623 1 
       82 . 1 1 15 15 LYS H   H  1   8.029 0.002 . 1 . . . A 15 LYS H   . 19623 1 
       83 . 1 1 15 15 LYS HA  H  1   3.933 0.050 . 1 . . . A 15 LYS HA  . 19623 1 
       84 . 1 1 15 15 LYS C   C 13 177.976 0.500 . 1 . . . A 15 LYS C   . 19623 1 
       85 . 1 1 15 15 LYS CA  C 13  59.591 0.500 . 1 . . . A 15 LYS CA  . 19623 1 
       86 . 1 1 15 15 LYS CB  C 13  32.275 0.024 . 1 . . . A 15 LYS CB  . 19623 1 
       87 . 1 1 15 15 LYS N   N 15 119.02  0.107 . 1 . . . A 15 LYS N   . 19623 1 
       88 . 1 1 16 16 ALA H   H  1   7.904 0.005 . 1 . . . A 16 ALA H   . 19623 1 
       89 . 1 1 16 16 ALA HA  H  1   3.962 0.050 . 1 . . . A 16 ALA HA  . 19623 1 
       90 . 1 1 16 16 ALA C   C 13 179.14  0.500 . 1 . . . A 16 ALA C   . 19623 1 
       91 . 1 1 16 16 ALA CA  C 13  55.426 0.166 . 1 . . . A 16 ALA CA  . 19623 1 
       92 . 1 1 16 16 ALA CB  C 13  18.41  0.002 . 1 . . . A 16 ALA CB  . 19623 1 
       93 . 1 1 16 16 ALA N   N 15 120.41  0.098 . 1 . . . A 16 ALA N   . 19623 1 
       94 . 1 1 17 17 ILE H   H  1   8.5   0.004 . 1 . . . A 17 ILE H   . 19623 1 
       95 . 1 1 17 17 ILE HA  H  1   5.85  0.050 . 1 . . . A 17 ILE HA  . 19623 1 
       96 . 1 1 17 17 ILE C   C 13 177.604 0.500 . 1 . . . A 17 ILE C   . 19623 1 
       97 . 1 1 17 17 ILE CA  C 13  66.545 0.105 . 1 . . . A 17 ILE CA  . 19623 1 
       98 . 1 1 17 17 ILE CB  C 13  37.843 0.288 . 1 . . . A 17 ILE CB  . 19623 1 
       99 . 1 1 17 17 ILE N   N 15 117.363 0.017 . 1 . . . A 17 ILE N   . 19623 1 
      100 . 1 1 18 18 LYS H   H  1   7.833 0.002 . 1 . . . A 18 LYS H   . 19623 1 
      101 . 1 1 18 18 LYS HA  H  1   3.865 0.050 . 1 . . . A 18 LYS HA  . 19623 1 
      102 . 1 1 18 18 LYS C   C 13 176.653 0.500 . 1 . . . A 18 LYS C   . 19623 1 
      103 . 1 1 18 18 LYS CA  C 13  60.189 0.500 . 1 . . . A 18 LYS CA  . 19623 1 
      104 . 1 1 18 18 LYS CB  C 13  32.26  0.500 . 1 . . . A 18 LYS CB  . 19623 1 
      105 . 1 1 18 18 LYS N   N 15 119.838 0.051 . 1 . . . A 18 LYS N   . 19623 1 
      106 . 1 1 19 19 ASP H   H  1   8.479 0.009 . 1 . . . A 19 ASP H   . 19623 1 
      107 . 1 1 19 19 ASP HA  H  1   4.569 0.050 . 1 . . . A 19 ASP HA  . 19623 1 
      108 . 1 1 19 19 ASP C   C 13 179.12  0.500 . 1 . . . A 19 ASP C   . 19623 1 
      109 . 1 1 19 19 ASP CA  C 13  57.108 0.401 . 1 . . . A 19 ASP CA  . 19623 1 
      110 . 1 1 19 19 ASP CB  C 13  40.853 0.364 . 1 . . . A 19 ASP CB  . 19623 1 
      111 . 1 1 19 19 ASP N   N 15 120.497 0.500 . 1 . . . A 19 ASP N   . 19623 1 
      112 . 1 1 20 20 LEU H   H  1   8.136 0.012 . 1 . . . A 20 LEU H   . 19623 1 
      113 . 1 1 20 20 LEU HA  H  1   4.148 0.050 . 1 . . . A 20 LEU HA  . 19623 1 
      114 . 1 1 20 20 LEU C   C 13 178.377 0.500 . 1 . . . A 20 LEU C   . 19623 1 
      115 . 1 1 20 20 LEU CA  C 13  58.225 0.032 . 1 . . . A 20 LEU CA  . 19623 1 
      116 . 1 1 20 20 LEU CB  C 13  41.585 0.727 . 1 . . . A 20 LEU CB  . 19623 1 
      117 . 1 1 20 20 LEU N   N 15 121.66  0.009 . 1 . . . A 20 LEU N   . 19623 1 
      118 . 1 1 21 21 LYS H   H  1   8.043 0.004 . 1 . . . A 21 LYS H   . 19623 1 
      119 . 1 1 21 21 LYS HA  H  1   3.904 0.050 . 1 . . . A 21 LYS HA  . 19623 1 
      120 . 1 1 21 21 LYS C   C 13 179.785 0.500 . 1 . . . A 21 LYS C   . 19623 1 
      121 . 1 1 21 21 LYS CA  C 13  59.557 0.084 . 1 . . . A 21 LYS CA  . 19623 1 
      122 . 1 1 21 21 LYS CB  C 13  29.655 0.022 . 1 . . . A 21 LYS CB  . 19623 1 
      123 . 1 1 21 21 LYS N   N 15 120.182 0.037 . 1 . . . A 21 LYS N   . 19623 1 
      124 . 1 1 22 22 ILE H   H  1   8.735 0.004 . 1 . . . A 22 ILE H   . 19623 1 
      125 . 1 1 22 22 ILE HA  H  1   3.522 0.050 . 1 . . . A 22 ILE HA  . 19623 1 
      126 . 1 1 22 22 ILE C   C 13 177.399 0.500 . 1 . . . A 22 ILE C   . 19623 1 
      127 . 1 1 22 22 ILE CA  C 13  64.863 0.411 . 1 . . . A 22 ILE CA  . 19623 1 
      128 . 1 1 22 22 ILE CB  C 13  38.046 0.081 . 1 . . . A 22 ILE CB  . 19623 1 
      129 . 1 1 22 22 ILE N   N 15 121.523 0.010 . 1 . . . A 22 ILE N   . 19623 1 
      130 . 1 1 23 23 TYR H   H  1   7.291 0.003 . 1 . . . A 23 TYR H   . 19623 1 
      131 . 1 1 23 23 TYR HA  H  1   4.481 0.050 . 1 . . . A 23 TYR HA  . 19623 1 
      132 . 1 1 23 23 TYR C   C 13 176.02  0.500 . 1 . . . A 23 TYR C   . 19623 1 
      133 . 1 1 23 23 TYR CA  C 13  58.369 0.214 . 1 . . . A 23 TYR CA  . 19623 1 
      134 . 1 1 23 23 TYR CB  C 13  38.499 0.215 . 1 . . . A 23 TYR CB  . 19623 1 
      135 . 1 1 23 23 TYR N   N 15 117.506 0.120 . 1 . . . A 23 TYR N   . 19623 1 
      136 . 1 1 24 24 GLY H   H  1   7.91  0.003 . 1 . . . A 24 GLY H   . 19623 1 
      137 . 1 1 24 24 GLY HA2 H  1   3.855 0.050 . 1 . . . A 24 GLY HA2 . 19623 1 
      138 . 1 1 24 24 GLY HA3 H  1   3.855 0.050 . 1 . . . A 24 GLY HA3 . 19623 1 
      139 . 1 1 24 24 GLY C   C 13 174.651 0.500 . 1 . . . A 24 GLY C   . 19623 1 
      140 . 1 1 24 24 GLY CA  C 13  46.409 0.147 . 1 . . . A 24 GLY CA  . 19623 1 
      141 . 1 1 24 24 GLY N   N 15 108.209 0.046 . 1 . . . A 24 GLY N   . 19623 1 
      142 . 1 1 25 25 ILE H   H  1   7.383 0.010 . 1 . . . A 25 ILE H   . 19623 1 
      143 . 1 1 25 25 ILE HA  H  1   3.747 0.050 . 1 . . . A 25 ILE HA  . 19623 1 
      144 . 1 1 25 25 ILE C   C 13 175.864 0.500 . 1 . . . A 25 ILE C   . 19623 1 
      145 . 1 1 25 25 ILE CA  C 13  60.984 0.013 . 1 . . . A 25 ILE CA  . 19623 1 
      146 . 1 1 25 25 ILE CB  C 13  37.12  0.068 . 1 . . . A 25 ILE CB  . 19623 1 
      147 . 1 1 25 25 ILE N   N 15 119.897 0.002 . 1 . . . A 25 ILE N   . 19623 1 
      148 . 1 1 26 26 GLY H   H  1   8.811 0.022 . 1 . . . A 26 GLY H   . 19623 1 
      149 . 1 1 26 26 GLY HA2 H  1   4.148 0.050 . 1 . . . A 26 GLY HA2 . 19623 1 
      150 . 1 1 26 26 GLY HA3 H  1   4.148 0.050 . 1 . . . A 26 GLY HA3 . 19623 1 
      151 . 1 1 26 26 GLY C   C 13 174.847 0.500 . 1 . . . A 26 GLY C   . 19623 1 
      152 . 1 1 26 26 GLY CA  C 13  45.322 0.076 . 1 . . . A 26 GLY CA  . 19623 1 
      153 . 1 1 26 26 GLY N   N 15 111.58  0.046 . 1 . . . A 26 GLY N   . 19623 1 
      154 . 1 1 27 27 GLU H   H  1   8.711 0.004 . 1 . . . A 27 GLU H   . 19623 1 
      155 . 1 1 27 27 GLU C   C 13 177.311 0.500 . 1 . . . A 27 GLU C   . 19623 1 
      156 . 1 1 27 27 GLU CA  C 13  59.73  0.088 . 1 . . . A 27 GLU CA  . 19623 1 
      157 . 1 1 27 27 GLU CB  C 13  29.933 0.254 . 1 . . . A 27 GLU CB  . 19623 1 
      158 . 1 1 27 27 GLU N   N 15 120.229 0.500 . 1 . . . A 27 GLU N   . 19623 1 
      159 . 1 1 28 28 HIS H   H  1   8.87  0.004 . 1 . . . A 28 HIS H   . 19623 1 
      160 . 1 1 28 28 HIS C   C 13 176.949 0.500 . 1 . . . A 28 HIS C   . 19623 1 
      161 . 1 1 28 28 HIS CA  C 13  59.674 0.267 . 1 . . . A 28 HIS CA  . 19623 1 
      162 . 1 1 28 28 HIS CB  C 13  29.838 0.082 . 1 . . . A 28 HIS CB  . 19623 1 
      163 . 1 1 28 28 HIS N   N 15 117.558 0.054 . 1 . . . A 28 HIS N   . 19623 1 
      164 . 1 1 29 29 TYR H   H  1   7.227 0.006 . 1 . . . A 29 TYR H   . 19623 1 
      165 . 1 1 29 29 TYR HA  H  1   4.09  0.050 . 1 . . . A 29 TYR HA  . 19623 1 
      166 . 1 1 29 29 TYR C   C 13 177.552 0.500 . 1 . . . A 29 TYR C   . 19623 1 
      167 . 1 1 29 29 TYR CA  C 13  60.998 0.066 . 1 . . . A 29 TYR CA  . 19623 1 
      168 . 1 1 29 29 TYR CB  C 13  38.683 0.126 . 1 . . . A 29 TYR CB  . 19623 1 
      169 . 1 1 29 29 TYR N   N 15 115.589 0.016 . 1 . . . A 29 TYR N   . 19623 1 
      170 . 1 1 30 30 ILE H   H  1   7.485 0.001 . 1 . . . A 30 ILE H   . 19623 1 
      171 . 1 1 30 30 ILE HA  H  1   3.444 0.050 . 1 . . . A 30 ILE HA  . 19623 1 
      172 . 1 1 30 30 ILE C   C 13 178.211 0.500 . 1 . . . A 30 ILE C   . 19623 1 
      173 . 1 1 30 30 ILE CA  C 13  65.64  0.131 . 1 . . . A 30 ILE CA  . 19623 1 
      174 . 1 1 30 30 ILE CB  C 13  37.553 0.105 . 1 . . . A 30 ILE CB  . 19623 1 
      175 . 1 1 30 30 ILE N   N 15 120.353 0.122 . 1 . . . A 30 ILE N   . 19623 1 
      176 . 1 1 31 31 LYS H   H  1   8.064 0.005 . 1 . . . A 31 LYS H   . 19623 1 
      177 . 1 1 31 31 LYS HA  H  1   4.011 0.050 . 1 . . . A 31 LYS HA  . 19623 1 
      178 . 1 1 31 31 LYS C   C 13 178.954 0.500 . 1 . . . A 31 LYS C   . 19623 1 
      179 . 1 1 31 31 LYS CA  C 13  58.893 0.044 . 1 . . . A 31 LYS CA  . 19623 1 
      180 . 1 1 31 31 LYS CB  C 13  31.673 0.117 . 1 . . . A 31 LYS CB  . 19623 1 
      181 . 1 1 31 31 LYS N   N 15 117.249 0.095 . 1 . . . A 31 LYS N   . 19623 1 
      182 . 1 1 32 32 LEU H   H  1   7.154 0.002 . 1 . . . A 32 LEU H   . 19623 1 
      183 . 1 1 32 32 LEU HA  H  1   3.894 0.050 . 1 . . . A 32 LEU HA  . 19623 1 
      184 . 1 1 32 32 LEU C   C 13 179.883 0.500 . 1 . . . A 32 LEU C   . 19623 1 
      185 . 1 1 32 32 LEU CA  C 13  57.987 0.011 . 1 . . . A 32 LEU CA  . 19623 1 
      186 . 1 1 32 32 LEU CB  C 13  41.255 0.001 . 1 . . . A 32 LEU CB  . 19623 1 
      187 . 1 1 32 32 LEU N   N 15 117.176 0.114 . 1 . . . A 32 LEU N   . 19623 1 
      188 . 1 1 33 33 ILE H   H  1   7.412 0.004 . 1 . . . A 33 ILE H   . 19623 1 
      189 . 1 1 33 33 ILE HA  H  1   3.571 0.050 . 1 . . . A 33 ILE HA  . 19623 1 
      190 . 1 1 33 33 ILE C   C 13 177.917 0.500 . 1 . . . A 33 ILE C   . 19623 1 
      191 . 1 1 33 33 ILE CA  C 13  63.579 0.103 . 1 . . . A 33 ILE CA  . 19623 1 
      192 . 1 1 33 33 ILE CB  C 13  35.702 0.500 . 1 . . . A 33 ILE CB  . 19623 1 
      193 . 1 1 33 33 ILE N   N 15 118.598 0.103 . 1 . . . A 33 ILE N   . 19623 1 
      194 . 1 1 34 34 GLU H   H  1   7.987 0.007 . 1 . . . A 34 GLU H   . 19623 1 
      195 . 1 1 34 34 GLU HA  H  1   3.826 0.050 . 1 . . . A 34 GLU HA  . 19623 1 
      196 . 1 1 34 34 GLU C   C 13 178.661 0.500 . 1 . . . A 34 GLU C   . 19623 1 
      197 . 1 1 34 34 GLU CA  C 13  59.689 0.030 . 1 . . . A 34 GLU CA  . 19623 1 
      198 . 1 1 34 34 GLU CB  C 13  29.855 0.214 . 1 . . . A 34 GLU CB  . 19623 1 
      199 . 1 1 34 34 GLU N   N 15 116.574 0.500 . 1 . . . A 34 GLU N   . 19623 1 
      200 . 1 1 35 35 LYS H   H  1   7.361 0.006 . 1 . . . A 35 LYS H   . 19623 1 
      201 . 1 1 35 35 LYS HA  H  1   4.207 0.050 . 1 . . . A 35 LYS HA  . 19623 1 
      202 . 1 1 35 35 LYS C   C 13 176.861 0.500 . 1 . . . A 35 LYS C   . 19623 1 
      203 . 1 1 35 35 LYS CA  C 13  56.328 0.168 . 1 . . . A 35 LYS CA  . 19623 1 
      204 . 1 1 35 35 LYS CB  C 13  33.007 0.075 . 1 . . . A 35 LYS CB  . 19623 1 
      205 . 1 1 35 35 LYS N   N 15 114.863 0.500 . 1 . . . A 35 LYS N   . 19623 1 
      206 . 1 1 36 36 ALA H   H  1   7.365 0.004 . 1 . . . A 36 ALA H   . 19623 1 
      207 . 1 1 36 36 ALA HA  H  1   4.129 0.050 . 1 . . . A 36 ALA HA  . 19623 1 
      208 . 1 1 36 36 ALA C   C 13 178.279 0.500 . 1 . . . A 36 ALA C   . 19623 1 
      209 . 1 1 36 36 ALA CA  C 13  53.257 0.126 . 1 . . . A 36 ALA CA  . 19623 1 
      210 . 1 1 36 36 ALA CB  C 13  19.581 0.083 . 1 . . . A 36 ALA CB  . 19623 1 
      211 . 1 1 36 36 ALA N   N 15 124.407 0.036 . 1 . . . A 36 ALA N   . 19623 1 
      212 . 1 1 37 37 LYS H   H  1   8.908 0.007 . 1 . . . A 37 LYS H   . 19623 1 
      213 . 1 1 37 37 LYS HA  H  1   4.383 0.050 . 1 . . . A 37 LYS HA  . 19623 1 
      214 . 1 1 37 37 LYS C   C 13 176.167 0.500 . 1 . . . A 37 LYS C   . 19623 1 
      215 . 1 1 37 37 LYS CA  C 13  56.602 0.090 . 1 . . . A 37 LYS CA  . 19623 1 
      216 . 1 1 37 37 LYS CB  C 13  34.883 0.193 . 1 . . . A 37 LYS CB  . 19623 1 
      217 . 1 1 37 37 LYS N   N 15 116.217 0.095 . 1 . . . A 37 LYS N   . 19623 1 
      218 . 1 1 38 38 GLN H   H  1   7.033 0.002 . 1 . . . A 38 GLN H   . 19623 1 
      219 . 1 1 38 38 GLN HA  H  1   4.813 0.050 . 1 . . . A 38 GLN HA  . 19623 1 
      220 . 1 1 38 38 GLN C   C 13 176.138 0.500 . 1 . . . A 38 GLN C   . 19623 1 
      221 . 1 1 38 38 GLN CA  C 13  54.117 0.050 . 1 . . . A 38 GLN CA  . 19623 1 
      222 . 1 1 38 38 GLN CB  C 13  32.222 0.276 . 1 . . . A 38 GLN CB  . 19623 1 
      223 . 1 1 38 38 GLN N   N 15 113.293 0.058 . 1 . . . A 38 GLN N   . 19623 1 
      224 . 1 1 39 39 VAL H   H  1   9.25  0.005 . 1 . . . A 39 VAL H   . 19623 1 
      225 . 1 1 39 39 VAL C   C 13 177.751 0.500 . 1 . . . A 39 VAL C   . 19623 1 
      226 . 1 1 39 39 VAL CA  C 13  67.737 0.076 . 1 . . . A 39 VAL CA  . 19623 1 
      227 . 1 1 39 39 VAL CB  C 13  31.438 0.500 . 1 . . . A 39 VAL CB  . 19623 1 
      228 . 1 1 39 39 VAL N   N 15 125.474 0.031 . 1 . . . A 39 VAL N   . 19623 1 
      229 . 1 1 40 40 ALA H   H  1   8.903 0.006 . 1 . . . A 40 ALA H   . 19623 1 
      230 . 1 1 40 40 ALA HA  H  1   4.041 0.050 . 1 . . . A 40 ALA HA  . 19623 1 
      231 . 1 1 40 40 ALA C   C 13 179.081 0.500 . 1 . . . A 40 ALA C   . 19623 1 
      232 . 1 1 40 40 ALA CA  C 13  55.059 0.123 . 1 . . . A 40 ALA CA  . 19623 1 
      233 . 1 1 40 40 ALA CB  C 13  17.735 0.287 . 1 . . . A 40 ALA CB  . 19623 1 
      234 . 1 1 40 40 ALA N   N 15 120.717 0.004 . 1 . . . A 40 ALA N   . 19623 1 
      235 . 1 1 41 41 ALA H   H  1   6.701 0.003 . 1 . . . A 41 ALA H   . 19623 1 
      236 . 1 1 41 41 ALA HA  H  1   4.236 0.050 . 1 . . . A 41 ALA HA  . 19623 1 
      237 . 1 1 41 41 ALA C   C 13 180.294 0.500 . 1 . . . A 41 ALA C   . 19623 1 
      238 . 1 1 41 41 ALA CA  C 13  54.688 0.054 . 1 . . . A 41 ALA CA  . 19623 1 
      239 . 1 1 41 41 ALA CB  C 13  18.724 0.232 . 1 . . . A 41 ALA CB  . 19623 1 
      240 . 1 1 41 41 ALA N   N 15 116.698 0.063 . 1 . . . A 41 ALA N   . 19623 1 
      241 . 1 1 42 42 VAL H   H  1   7.552 0.003 . 1 . . . A 42 VAL H   . 19623 1 
      242 . 1 1 42 42 VAL HA  H  1   3.278 0.050 . 1 . . . A 42 VAL HA  . 19623 1 
      243 . 1 1 42 42 VAL C   C 13 176.812 0.500 . 1 . . . A 42 VAL C   . 19623 1 
      244 . 1 1 42 42 VAL CA  C 13  67.641 0.058 . 1 . . . A 42 VAL CA  . 19623 1 
      245 . 1 1 42 42 VAL CB  C 13  31.399 0.500 . 1 . . . A 42 VAL CB  . 19623 1 
      246 . 1 1 42 42 VAL N   N 15 119.051 0.094 . 1 . . . A 42 VAL N   . 19623 1 
      247 . 1 1 43 43 GLU H   H  1   7.804 0.003 . 1 . . . A 43 GLU H   . 19623 1 
      248 . 1 1 43 43 GLU HA  H  1   3.855 0.050 . 1 . . . A 43 GLU HA  . 19623 1 
      249 . 1 1 43 43 GLU C   C 13 178.973 0.500 . 1 . . . A 43 GLU C   . 19623 1 
      250 . 1 1 43 43 GLU CA  C 13  59.393 0.013 . 1 . . . A 43 GLU CA  . 19623 1 
      251 . 1 1 43 43 GLU CB  C 13  28.811 0.086 . 1 . . . A 43 GLU CB  . 19623 1 
      252 . 1 1 43 43 GLU N   N 15 117.715 0.020 . 1 . . . A 43 GLU N   . 19623 1 
      253 . 1 1 44 44 ASP H   H  1   8.169 0.008 . 1 . . . A 44 ASP H   . 19623 1 
      254 . 1 1 44 44 ASP HA  H  1   4.363 0.050 . 1 . . . A 44 ASP HA  . 19623 1 
      255 . 1 1 44 44 ASP C   C 13 178.211 0.500 . 1 . . . A 44 ASP C   . 19623 1 
      256 . 1 1 44 44 ASP CA  C 13  57.308 0.104 . 1 . . . A 44 ASP CA  . 19623 1 
      257 . 1 1 44 44 ASP CB  C 13  40.504 0.147 . 1 . . . A 44 ASP CB  . 19623 1 
      258 . 1 1 44 44 ASP N   N 15 119.175 0.050 . 1 . . . A 44 ASP N   . 19623 1 
      259 . 1 1 45 45 LEU H   H  1   8.119 0.003 . 1 . . . A 45 LEU H   . 19623 1 
      260 . 1 1 45 45 LEU HA  H  1   4.119 0.050 . 1 . . . A 45 LEU HA  . 19623 1 
      261 . 1 1 45 45 LEU C   C 13 178.416 0.500 . 1 . . . A 45 LEU C   . 19623 1 
      262 . 1 1 45 45 LEU CA  C 13  57.294 0.500 . 1 . . . A 45 LEU CA  . 19623 1 
      263 . 1 1 45 45 LEU CB  C 13  40.474 0.500 . 1 . . . A 45 LEU CB  . 19623 1 
      264 . 1 1 45 45 LEU N   N 15 117.848 0.062 . 1 . . . A 45 LEU N   . 19623 1 
      265 . 1 1 46 46 LYS H   H  1   8.483 0.010 . 1 . . . A 46 LYS H   . 19623 1 
      266 . 1 1 46 46 LYS HA  H  1   3.972 0.050 . 1 . . . A 46 LYS HA  . 19623 1 
      267 . 1 1 46 46 LYS C   C 13 177.653 0.500 . 1 . . . A 46 LYS C   . 19623 1 
      268 . 1 1 46 46 LYS CA  C 13  60.276 0.361 . 1 . . . A 46 LYS CA  . 19623 1 
      269 . 1 1 46 46 LYS CB  C 13  31.45  0.012 . 1 . . . A 46 LYS CB  . 19623 1 
      270 . 1 1 46 46 LYS N   N 15 119.462 0.500 . 1 . . . A 46 LYS N   . 19623 1 
      271 . 1 1 47 47 ASP H   H  1   7.846 0.008 . 1 . . . A 47 ASP H   . 19623 1 
      272 . 1 1 47 47 ASP HA  H  1   4.344 0.050 . 1 . . . A 47 ASP HA  . 19623 1 
      273 . 1 1 47 47 ASP C   C 13 179.384 0.500 . 1 . . . A 47 ASP C   . 19623 1 
      274 . 1 1 47 47 ASP CA  C 13  57.687 0.158 . 1 . . . A 47 ASP CA  . 19623 1 
      275 . 1 1 47 47 ASP CB  C 13  40.809 0.100 . 1 . . . A 47 ASP CB  . 19623 1 
      276 . 1 1 47 47 ASP N   N 15 117.47  0.043 . 1 . . . A 47 ASP N   . 19623 1 
      277 . 1 1 48 48 GLU H   H  1   8.327 0.013 . 1 . . . A 48 GLU H   . 19623 1 
      278 . 1 1 48 48 GLU HA  H  1   4.011 0.050 . 1 . . . A 48 GLU HA  . 19623 1 
      279 . 1 1 48 48 GLU C   C 13 180.724 0.500 . 1 . . . A 48 GLU C   . 19623 1 
      280 . 1 1 48 48 GLU CA  C 13  60.091 0.059 . 1 . . . A 48 GLU CA  . 19623 1 
      281 . 1 1 48 48 GLU CB  C 13  31.991 0.033 . 1 . . . A 48 GLU CB  . 19623 1 
      282 . 1 1 48 48 GLU N   N 15 119.662 0.043 . 1 . . . A 48 GLU N   . 19623 1 
      283 . 1 1 49 49 ILE H   H  1   7.667 0.011 . 1 . . . A 49 ILE H   . 19623 1 
      284 . 1 1 49 49 ILE HA  H  1   3.738 0.050 . 1 . . . A 49 ILE HA  . 19623 1 
      285 . 1 1 49 49 ILE C   C 13 179.238 0.500 . 1 . . . A 49 ILE C   . 19623 1 
      286 . 1 1 49 49 ILE CA  C 13  64.592 0.492 . 1 . . . A 49 ILE CA  . 19623 1 
      287 . 1 1 49 49 ILE CB  C 13  37.959 0.380 . 1 . . . A 49 ILE CB  . 19623 1 
      288 . 1 1 49 49 ILE N   N 15 120.308 0.096 . 1 . . . A 49 ILE N   . 19623 1 
      289 . 1 1 50 50 LEU H   H  1   8.474 0.007 . 1 . . . A 50 LEU H   . 19623 1 
      290 . 1 1 50 50 LEU HA  H  1   4.559 0.050 . 1 . . . A 50 LEU HA  . 19623 1 
      291 . 1 1 50 50 LEU C   C 13 179.971 0.500 . 1 . . . A 50 LEU C   . 19623 1 
      292 . 1 1 50 50 LEU CA  C 13  57.794 1.048 . 1 . . . A 50 LEU CA  . 19623 1 
      293 . 1 1 50 50 LEU CB  C 13  40.856 0.184 . 1 . . . A 50 LEU CB  . 19623 1 
      294 . 1 1 50 50 LEU N   N 15 121.274 0.006 . 1 . . . A 50 LEU N   . 19623 1 
      295 . 1 1 51 51 LYS H   H  1   8.197 0.004 . 1 . . . A 51 LYS H   . 19623 1 
      296 . 1 1 51 51 LYS HA  H  1   3.982 0.050 . 1 . . . A 51 LYS HA  . 19623 1 
      297 . 1 1 51 51 LYS C   C 13 179.189 0.500 . 1 . . . A 51 LYS C   . 19623 1 
      298 . 1 1 51 51 LYS CA  C 13  59.526 0.042 . 1 . . . A 51 LYS CA  . 19623 1 
      299 . 1 1 51 51 LYS CB  C 13  32.175 0.163 . 1 . . . A 51 LYS CB  . 19623 1 
      300 . 1 1 51 51 LYS N   N 15 119.972 0.273 . 1 . . . A 51 LYS N   . 19623 1 
      301 . 1 1 52 52 ALA H   H  1   7.809 0.009 . 1 . . . A 52 ALA H   . 19623 1 
      302 . 1 1 52 52 ALA HA  H  1   4.158 0.050 . 1 . . . A 52 ALA HA  . 19623 1 
      303 . 1 1 52 52 ALA C   C 13 178.015 0.500 . 1 . . . A 52 ALA C   . 19623 1 
      304 . 1 1 52 52 ALA CA  C 13  53.662 0.033 . 1 . . . A 52 ALA CA  . 19623 1 
      305 . 1 1 52 52 ALA CB  C 13  17.903 0.086 . 1 . . . A 52 ALA CB  . 19623 1 
      306 . 1 1 52 52 ALA N   N 15 121.059 0.120 . 1 . . . A 52 ALA N   . 19623 1 
      307 . 1 1 53 53 HIS H   H  1   7.598 0.004 . 1 . . . A 53 HIS H   . 19623 1 
      308 . 1 1 53 53 HIS HA  H  1   4.373 0.050 . 1 . . . A 53 HIS HA  . 19623 1 
      309 . 1 1 53 53 HIS C   C 13 174.015 0.500 . 1 . . . A 53 HIS C   . 19623 1 
      310 . 1 1 53 53 HIS CA  C 13  57.409 0.115 . 1 . . . A 53 HIS CA  . 19623 1 
      311 . 1 1 53 53 HIS CB  C 13  29.01  0.120 . 1 . . . A 53 HIS CB  . 19623 1 
      312 . 1 1 53 53 HIS N   N 15 115.943 0.061 . 1 . . . A 53 HIS N   . 19623 1 
      313 . 1 1 54 54 ASP H   H  1   7.974 0.008 . 1 . . . A 54 ASP H   . 19623 1 
      314 . 1 1 54 54 ASP HA  H  1   4.442 0.050 . 1 . . . A 54 ASP HA  . 19623 1 
      315 . 1 1 54 54 ASP C   C 13 175.609 0.500 . 1 . . . A 54 ASP C   . 19623 1 
      316 . 1 1 54 54 ASP CA  C 13  54.971 0.180 . 1 . . . A 54 ASP CA  . 19623 1 
      317 . 1 1 54 54 ASP CB  C 13  40.209 0.109 . 1 . . . A 54 ASP CB  . 19623 1 
      318 . 1 1 54 54 ASP N   N 15 119.133 0.072 . 1 . . . A 54 ASP N   . 19623 1 
      319 . 1 1 55 55 ARG H   H  1   7.943 0.008 . 1 . . . A 55 ARG H   . 19623 1 
      320 . 1 1 55 55 ARG HA  H  1   4.324 0.050 . 1 . . . A 55 ARG HA  . 19623 1 
      321 . 1 1 55 55 ARG C   C 13 174.671 0.500 . 1 . . . A 55 ARG C   . 19623 1 
      322 . 1 1 55 55 ARG CA  C 13  54.785 0.073 . 1 . . . A 55 ARG CA  . 19623 1 
      323 . 1 1 55 55 ARG CB  C 13  30.507 0.124 . 1 . . . A 55 ARG CB  . 19623 1 
      324 . 1 1 55 55 ARG N   N 15 118.206 0.190 . 1 . . . A 55 ARG N   . 19623 1 
      325 . 1 1 56 56 PHE H   H  1   7.663 0.002 . 1 . . . A 56 PHE H   . 19623 1 
      326 . 1 1 56 56 PHE HA  H  1   4.334 0.050 . 1 . . . A 56 PHE HA  . 19623 1 
      327 . 1 1 56 56 PHE CA  C 13  59.406 0.500 . 1 . . . A 56 PHE CA  . 19623 1 
      328 . 1 1 56 56 PHE CB  C 13  40.552 0.500 . 1 . . . A 56 PHE CB  . 19623 1 
      329 . 1 1 56 56 PHE N   N 15 125.578 0.042 . 1 . . . A 56 PHE N   . 19623 1 

   stop_

save_