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                      19318
   _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             0.01
   _Assigned_chem_shift_list.Chem_shift_13C_err            0.1
   _Assigned_chem_shift_list.Chem_shift_15N_err            0.1
   _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      'Minimum digital resolution'
   _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 . 19318 1 
      2 '3D CBCA(CO)NH'  1 $sample_1 . 19318 1 
      3 '3D HNCACB'      1 $sample_1 . 19318 1 
      4 '3D HNCO'        1 $sample_1 . 19318 1 
      5 '3D HBHA(CO)NH'  1 $sample_1 . 19318 1 
      6 '3D HCACO'       1 $sample_1 . 19318 1 
      7 '3D HCA(CO)N'    1 $sample_1 . 19318 1 
      8 '3D HBHANH'      1 $sample_1 . 19318 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  2  2 PRO HA  H  1   4.46   0.01 . 1 . . . .  2 P HA . 19318 1 
        2 . 1 1  2  2 PRO C   C 13 177.11   0.1  . 1 . . . .  2 P C  . 19318 1 
        3 . 1 1  2  2 PRO CA  C 13  63.1    0.1  . 1 . . . .  2 P CA . 19318 1 
        4 . 1 1  2  2 PRO CB  C 13  32.4    0.1  . 1 . . . .  2 P CB . 19318 1 
        5 . 1 1  3  3 LEU H   H  1   8.642  0.01 . 1 . . . .  3 L HN . 19318 1 
        6 . 1 1  3  3 LEU HA  H  1   4.361  0.01 . 1 . . . .  3 L HA . 19318 1 
        7 . 1 1  3  3 LEU C   C 13 178.085  0.1  . 1 . . . .  3 L C  . 19318 1 
        8 . 1 1  3  3 LEU CA  C 13  55.545  0.1  . 1 . . . .  3 L CA . 19318 1 
        9 . 1 1  3  3 LEU CB  C 13  42.33   0.1  . 1 . . . .  3 L CB . 19318 1 
       10 . 1 1  3  3 LEU N   N 15 122.74   0.1  . 1 . . . .  3 L N  . 19318 1 
       11 . 1 1  4  4 GLY H   H  1   8.529  0.01 . 1 . . . .  4 G HN . 19318 1 
       12 . 1 1  4  4 GLY HA2 H  1   4.00   0.01 . 1 . . . .  4 G HA . 19318 1 
       13 . 1 1  4  4 GLY HA3 H  1   4.00   0.01 . 1 . . . .  4 G HA . 19318 1 
       14 . 1 1  4  4 GLY C   C 13 174.33   0.1  . 1 . . . .  4 G C  . 19318 1 
       15 . 1 1  4  4 GLY CA  C 13  45.32   0.1  . 1 . . . .  4 G CA . 19318 1 
       16 . 1 1  4  4 GLY N   N 15 110.06   0.1  . 1 . . . .  4 G N  . 19318 1 
       17 . 1 1  5  5 SER H   H  1   8.336  0.01 . 1 . . . .  5 S HN . 19318 1 
       18 . 1 1  5  5 SER HA  H  1   4.451  0.01 . 1 . . . .  5 S HA . 19318 1 
       19 . 1 1  5  5 SER C   C 13 174.77   0.1  . 1 . . . .  5 S C  . 19318 1 
       20 . 1 1  5  5 SER CA  C 13  58.61   0.1  . 1 . . . .  5 S CA . 19318 1 
       21 . 1 1  5  5 SER CB  C 13  63.965  0.1  . 1 . . . .  5 S CB . 19318 1 
       22 . 1 1  5  5 SER N   N 15 115.81   0.1  . 1 . . . .  5 S N  . 19318 1 
       23 . 1 1  6  6 CYS H   H  1   8.474  0.01 . 1 . . . .  6 C HN . 19318 1 
       24 . 1 1  6  6 CYS HA  H  1   4.4845 0.01 . 1 . . . .  6 C HA . 19318 1 
       25 . 1 1  6  6 CYS C   C 13 174.465  0.1  . 1 . . . .  6 C C  . 19318 1 
       26 . 1 1  6  6 CYS CA  C 13  58.71   0.1  . 1 . . . .  6 C CA . 19318 1 
       27 . 1 1  6  6 CYS CB  C 13  27.95   0.1  . 1 . . . .  6 C CB . 19318 1 
       28 . 1 1  6  6 CYS N   N 15 120.82   0.1  . 1 . . . .  6 C N  . 19318 1 
       29 . 1 1  7  7 TYR H   H  1   8.286  0.01 . 1 . . . .  7 Y HN . 19318 1 
       30 . 1 1  7  7 TYR HA  H  1   4.5305 0.01 . 1 . . . .  7 Y HA . 19318 1 
       31 . 1 1  7  7 TYR C   C 13 175.72   0.1  . 1 . . . .  7 Y C  . 19318 1 
       32 . 1 1  7  7 TYR CA  C 13  58.335  0.1  . 1 . . . .  7 Y CA . 19318 1 
       33 . 1 1  7  7 TYR CB  C 13  38.71   0.1  . 1 . . . .  7 Y CB . 19318 1 
       34 . 1 1  7  7 TYR N   N 15 122.66   0.1  . 1 . . . .  7 Y N  . 19318 1 
       35 . 1 1  8  8 GLN H   H  1   8.257  0.01 . 1 . . . .  8 Q HN . 19318 1 
       36 . 1 1  8  8 GLN HA  H  1   4.2455 0.01 . 1 . . . .  8 Q HA . 19318 1 
       37 . 1 1  8  8 GLN C   C 13 175.3    0.1  . 1 . . . .  8 Q C  . 19318 1 
       38 . 1 1  8  8 GLN CA  C 13  55.88   0.1  . 1 . . . .  8 Q CA . 19318 1 
       39 . 1 1  8  8 GLN CB  C 13  29.64   0.1  . 1 . . . .  8 Q CB . 19318 1 
       40 . 1 1  8  8 GLN N   N 15 122.09   0.1  . 1 . . . .  8 Q N  . 19318 1 
       41 . 1 1  9  9 ASN H   H  1   8.437  0.01 . 1 . . . .  9 N HN . 19318 1 
       42 . 1 1  9  9 ASN HA  H  1   4.6115 0.01 . 1 . . . .  9 N HA . 19318 1 
       43 . 1 1  9  9 ASN C   C 13 175.2    0.1  . 1 . . . .  9 N C  . 19318 1 
       44 . 1 1  9  9 ASN CA  C 13  53.43   0.1  . 1 . . . .  9 N CA . 19318 1 
       45 . 1 1  9  9 ASN CB  C 13  38.815  0.1  . 1 . . . .  9 N CB . 19318 1 
       46 . 1 1  9  9 ASN N   N 15 120.04   0.1  . 1 . . . .  9 N N  . 19318 1 
       47 . 1 1 10 10 LYS H   H  1   8.369  0.01 . 1 . . . . 10 K HN . 19318 1 
       48 . 1 1 10 10 LYS HA  H  1   4.288  0.01 . 1 . . . . 10 K HA . 19318 1 
       49 . 1 1 10 10 LYS C   C 13 176.515  0.1  . 1 . . . . 10 K C  . 19318 1 
       50 . 1 1 10 10 LYS CA  C 13  56.645  0.1  . 1 . . . . 10 K CA . 19318 1 
       51 . 1 1 10 10 LYS CB  C 13  32.97   0.1  . 1 . . . . 10 K CB . 19318 1 
       52 . 1 1 10 10 LYS N   N 15 121.99   0.1  . 1 . . . . 10 K N  . 19318 1 
       53 . 1 1 11 11 LEU H   H  1   8.347  0.01 . 1 . . . . 11 L HN . 19318 1 
       54 . 1 1 11 11 LEU HA  H  1   4.3545 0.01 . 1 . . . . 11 L HA . 19318 1 
       55 . 1 1 11 11 LEU C   C 13 177.465  0.1  . 1 . . . . 11 L C  . 19318 1 
       56 . 1 1 11 11 LEU CA  C 13  55.275  0.1  . 1 . . . . 11 L CA . 19318 1 
       57 . 1 1 11 11 LEU CB  C 13  42.42   0.1  . 1 . . . . 11 L CB . 19318 1 
       58 . 1 1 11 11 LEU N   N 15 123      0.1  . 1 . . . . 11 L N  . 19318 1 
       59 . 1 1 12 12 SER H   H  1   8.356  0.01 . 1 . . . . 12 S HN . 19318 1 
       60 . 1 1 12 12 SER HA  H  1   4.485  0.01 . 1 . . . . 12 S HA . 19318 1 
       61 . 1 1 12 12 SER C   C 13 174.535  0.1  . 1 . . . . 12 S C  . 19318 1 
       62 . 1 1 12 12 SER CA  C 13  58.265  0.1  . 1 . . . . 12 S CA . 19318 1 
       63 . 1 1 12 12 SER CB  C 13  63.9    0.1  . 1 . . . . 12 S CB . 19318 1 
       64 . 1 1 12 12 SER N   N 15 116.91   0.1  . 1 . . . . 12 S N  . 19318 1 
       65 . 1 1 13 13 ILE H   H  1   8.269  0.01 . 1 . . . . 13 I HN . 19318 1 
       66 . 1 1 13 13 ILE HA  H  1   4.2355 0.01 . 1 . . . . 13 I HA . 19318 1 
       67 . 1 1 13 13 ILE C   C 13 176.335  0.1  . 1 . . . . 13 I C  . 19318 1 
       68 . 1 1 13 13 ILE CA  C 13  61.41   0.1  . 1 . . . . 13 I CA . 19318 1 
       69 . 1 1 13 13 ILE CB  C 13  38.835  0.1  . 1 . . . . 13 I CB . 19318 1 
       70 . 1 1 13 13 ILE N   N 15 122.46   0.1  . 1 . . . . 13 I N  . 19318 1 
       71 . 1 1 14 14 SER H   H  1   8.427  0.01 . 1 . . . . 14 S HN . 19318 1 
       72 . 1 1 14 14 SER HA  H  1   4.466  0.01 . 1 . . . . 14 S HA . 19318 1 
       73 . 1 1 14 14 SER C   C 13 174.35   0.1  . 1 . . . . 14 S C  . 19318 1 
       74 . 1 1 14 14 SER CA  C 13  58.3    0.1  . 1 . . . . 14 S CA . 19318 1 
       75 . 1 1 14 14 SER CB  C 13  64.02   0.1  . 1 . . . . 14 S CB . 19318 1 
       76 . 1 1 14 14 SER N   N 15 119.28   0.1  . 1 . . . . 14 S N  . 19318 1 
       77 . 1 1 15 15 ASP H   H  1   8.402  0.01 . 1 . . . . 15 D HN . 19318 1 
       78 . 1 1 15 15 ASP HA  H  1   4.5585 0.01 . 1 . . . . 15 D HA . 19318 1 
       79 . 1 1 15 15 ASP C   C 13 176.135  0.1  . 1 . . . . 15 D C  . 19318 1 
       80 . 1 1 15 15 ASP CA  C 13  54.62   0.1  . 1 . . . . 15 D CA . 19318 1 
       81 . 1 1 15 15 ASP CB  C 13  41.07   0.1  . 1 . . . . 15 D CB . 19318 1 
       82 . 1 1 15 15 ASP N   N 15 122.55   0.1  . 1 . . . . 15 D N  . 19318 1 
       83 . 1 1 16 16 HIS H   H  1   8.346  0.01 . 1 . . . . 16 H HN . 19318 1 
       84 . 1 1 16 16 HIS HA  H  1   4.6225 0.01 . 1 . . . . 16 H HA . 19318 1 
       85 . 1 1 16 16 HIS C   C 13 174.66   0.1  . 1 . . . . 16 H C  . 19318 1 
       86 . 1 1 16 16 HIS CA  C 13  56.175  0.1  . 1 . . . . 16 H CA . 19318 1 
       87 . 1 1 16 16 HIS CB  C 13  29.98   0.1  . 1 . . . . 16 H CB . 19318 1 
       88 . 1 1 16 16 HIS N   N 15 118.61   0.1  . 1 . . . . 16 H N  . 19318 1 
       89 . 1 1 17 17 ASP H   H  1   8.454  0.01 . 1 . . . . 17 D HN . 19318 1 
       90 . 1 1 17 17 ASP HA  H  1   4.626  0.01 . 1 . . . . 17 D HA . 19318 1 
       91 . 1 1 17 17 ASP C   C 13 176.425  0.1  . 1 . . . . 17 D C  . 19318 1 
       92 . 1 1 17 17 ASP CA  C 13  54.565  0.1  . 1 . . . . 17 D CA . 19318 1 
       93 . 1 1 17 17 ASP CB  C 13  41.305  0.1  . 1 . . . . 17 D CB . 19318 1 
       94 . 1 1 17 17 ASP N   N 15 121.91   0.1  . 1 . . . . 17 D N  . 19318 1 
       95 . 1 1 18 18 SER H   H  1   8.465  0.01 . 1 . . . . 18 S HN . 19318 1 
       96 . 1 1 18 18 SER HA  H  1   4.417  0.01 . 1 . . . . 18 S HA . 19318 1 
       97 . 1 1 18 18 SER C   C 13 175.22   0.1  . 1 . . . . 18 S C  . 19318 1 
       98 . 1 1 18 18 SER CA  C 13  58.98   0.1  . 1 . . . . 18 S CA . 19318 1 
       99 . 1 1 18 18 SER CB  C 13  63.93   0.1  . 1 . . . . 18 S CB . 19318 1 
      100 . 1 1 18 18 SER N   N 15 117.08   0.1  . 1 . . . . 18 S N  . 19318 1 
      101 . 1 1 19 19 GLY H   H  1   8.575  0.01 . 1 . . . . 19 G HN . 19318 1 
      102 . 1 1 19 19 GLY HA2 H  1   3.9825 0.01 . 2 . . . . 19 G HA . 19318 1 
      103 . 1 1 19 19 GLY HA3 H  1   3.9825 0.01 . 2 . . . . 19 G HA . 19318 1 
      104 . 1 1 19 19 GLY C   C 13 174.11   0.1  . 1 . . . . 19 G C  . 19318 1 
      105 . 1 1 19 19 GLY CA  C 13  45.5    0.1  . 1 . . . . 19 G CA . 19318 1 
      106 . 1 1 19 19 GLY N   N 15 111.16   0.1  . 1 . . . . 19 G N  . 19318 1 
      107 . 1 1 20 20 VAL H   H  1   7.996  0.01 . 1 . . . . 20 V HN . 19318 1 
      108 . 1 1 20 20 VAL HA  H  1   4.148  0.01 . 1 . . . . 20 V HA . 19318 1 
      109 . 1 1 20 20 VAL C   C 13 176.325  0.1  . 1 . . . . 20 V C  . 19318 1 
      110 . 1 1 20 20 VAL CA  C 13  62.27   0.1  . 1 . . . . 20 V CA . 19318 1 
      111 . 1 1 20 20 VAL CB  C 13  32.845  0.1  . 1 . . . . 20 V CB . 19318 1 
      112 . 1 1 20 20 VAL N   N 15 119.22   0.1  . 1 . . . . 20 V N  . 19318 1 
      113 . 1 1 21 21 GLU H   H  1   8.651  0.01 . 1 . . . . 21 E HN . 19318 1 
      114 . 1 1 21 21 GLU HA  H  1   4.2955 0.01 . 1 . . . . 21 E HA . 19318 1 
      115 . 1 1 21 21 GLU C   C 13 176.265  0.1  . 1 . . . . 21 E C  . 19318 1 
      116 . 1 1 21 21 GLU CA  C 13  56.44   0.1  . 1 . . . . 21 E CA . 19318 1 
      117 . 1 1 21 21 GLU CB  C 13  30.275  0.1  . 1 . . . . 21 E CB . 19318 1 
      118 . 1 1 21 21 GLU N   N 15 124.83   0.1  . 1 . . . . 21 E N  . 19318 1 
      119 . 1 1 22 22 ASP H   H  1   8.454  0.01 . 1 . . . . 22 D HN . 19318 1 
      120 . 1 1 22 22 ASP HA  H  1   4.5695 0.01 . 1 . . . . 22 D HA . 19318 1 
      121 . 1 1 22 22 ASP C   C 13 176.475  0.1  . 1 . . . . 22 D C  . 19318 1 
      122 . 1 1 22 22 ASP CA  C 13  54.605  0.1  . 1 . . . . 22 D CA . 19318 1 
      123 . 1 1 22 22 ASP CB  C 13  41.28   0.1  . 1 . . . . 22 D CB . 19318 1 
      124 . 1 1 22 22 ASP N   N 15 121.91   0.1  . 1 . . . . 22 D N  . 19318 1 
      125 . 1 1 23 23 GLU H   H  1   8.486  0.01 . 1 . . . . 23 E HN . 19318 1 
      126 . 1 1 23 23 GLU HA  H  1   4.1895 0.01 . 1 . . . . 23 E HA . 19318 1 
      127 . 1 1 23 23 GLU C   C 13 176.25   0.1  . 1 . . . . 23 E C  . 19318 1 
      128 . 1 1 23 23 GLU CA  C 13  56.995  0.1  . 1 . . . . 23 E CA . 19318 1 
      129 . 1 1 23 23 GLU CB  C 13  30.495  0.1  . 1 . . . . 23 E CB . 19318 1 
      130 . 1 1 23 23 GLU N   N 15 122.01   0.1  . 1 . . . . 23 E N  . 19318 1 
      131 . 1 1 24 24 ASP H   H  1   8.517  0.01 . 1 . . . . 24 D HN . 19318 1 
      132 . 1 1 24 24 ASP HA  H  1   4.5955 0.01 . 1 . . . . 24 D HA . 19318 1 
      133 . 1 1 24 24 ASP C   C 13 176.435  0.1  . 1 . . . . 24 D C  . 19318 1 
      134 . 1 1 24 24 ASP CA  C 13  54.495  0.1  . 1 . . . . 24 D CA . 19318 1 
      135 . 1 1 24 24 ASP CB  C 13  40.995  0.1  . 1 . . . . 24 D CB . 19318 1 
      136 . 1 1 24 24 ASP N   N 15 121.47   0.1  . 1 . . . . 24 D N  . 19318 1 
      137 . 1 1 25 25 LEU H   H  1   8.302  0.01 . 1 . . . . 25 L HN . 19318 1 
      138 . 1 1 25 25 LEU HA  H  1   4.3665 0.01 . 1 . . . . 25 L HA . 19318 1 
      139 . 1 1 25 25 LEU C   C 13 177.595  0.1  . 1 . . . . 25 L C  . 19318 1 
      140 . 1 1 25 25 LEU CA  C 13  54.93   0.1  . 1 . . . . 25 L CA . 19318 1 
      141 . 1 1 25 25 LEU CB  C 13  42.07   0.1  . 1 . . . . 25 L CB . 19318 1 
      142 . 1 1 25 25 LEU N   N 15 123.2    0.1  . 1 . . . . 25 L N  . 19318 1 
      143 . 1 1 26 26 SER H   H  1   8.274  0.01 . 1 . . . . 26 S HN . 19318 1 
      144 . 1 1 26 26 SER HA  H  1   4.648  0.01 . 1 . . . . 26 S HA . 19318 1 
      145 . 1 1 26 26 SER C   C 13 172.33   0.1  . 1 . . . . 26 S C  . 19318 1 
      146 . 1 1 26 26 SER CA  C 13  56.98   0.1  . 1 . . . . 26 S CA . 19318 1 
      147 . 1 1 26 26 SER CB  C 13  63.02   0.1  . 1 . . . . 26 S CB . 19318 1 
      148 . 1 1 26 26 SER N   N 15 117.89   0.1  . 1 . . . . 26 S N  . 19318 1 
      149 . 1 1 27 27 PRO HA  H  1   4.436  0.01 . 1 . . . . 27 P HA . 19318 1 
      150 . 1 1 27 27 PRO C   C 13 176.89   0.1  . 1 . . . . 27 P C  . 19318 1 
      151 . 1 1 27 27 PRO CA  C 13  63.23   0.1  . 1 . . . . 27 P CA . 19318 1 
      152 . 1 1 27 27 PRO CB  C 13  32.04   0.1  . 1 . . . . 27 P CB . 19318 1 
      153 . 1 1 28 28 ARG H   H  1   8.597  0.01 . 1 . . . . 28 R HN . 19318 1 
      154 . 1 1 28 28 ARG HA  H  1   4.61   0.01 . 1 . . . . 28 R HA . 19318 1 
      155 . 1 1 28 28 ARG C   C 13 174.35   0.1  . 1 . . . . 28 R C  . 19318 1 
      156 . 1 1 28 28 ARG CA  C 13  53.78   0.1  . 1 . . . . 28 R CA . 19318 1 
      157 . 1 1 28 28 ARG CB  C 13  30.18   0.1  . 1 . . . . 28 R CB . 19318 1 
      158 . 1 1 28 28 ARG N   N 15 123.29   0.1  . 1 . . . . 28 R N  . 19318 1 
      159 . 1 1 29 29 PRO HA  H  1   4.437  0.01 . 1 . . . . 29 P HA . 19318 1 
      160 . 1 1 29 29 PRO C   C 13 176.75   0.1  . 1 . . . . 29 P C  . 19318 1 
      161 . 1 1 29 29 PRO CA  C 13  63.04   0.1  . 1 . . . . 29 P CA . 19318 1 
      162 . 1 1 29 29 PRO CB  C 13  32.16   0.1  . 1 . . . . 29 P CB . 19318 1 
      163 . 1 1 30 30 SER H   H  1   8.578  0.01 . 1 . . . . 30 S HN . 19318 1 
      164 . 1 1 30 30 SER HA  H  1   4.721  0.01 . 1 . . . . 30 S HA . 19318 1 
      165 . 1 1 30 30 SER C   C 13 172.96   0.1  . 1 . . . . 30 S C  . 19318 1 
      166 . 1 1 30 30 SER CA  C 13  56.42   0.1  . 1 . . . . 30 S CA . 19318 1 
      167 . 1 1 30 30 SER CB  C 13  63.73   0.1  . 1 . . . . 30 S CB . 19318 1 
      168 . 1 1 30 30 SER N   N 15 118.05   0.1  . 1 . . . . 30 S N  . 19318 1 
      169 . 1 1 31 31 PRO HA  H  1   4.425  0.01 . 1 . . . . 31 P HA . 19318 1 
      170 . 1 1 31 31 PRO C   C 13 176.36   0.1  . 1 . . . . 31 P C  . 19318 1 
      171 . 1 1 31 31 PRO CA  C 13  63.3    0.1  . 1 . . . . 31 P CA . 19318 1 
      172 . 1 1 31 31 PRO CB  C 13  32.05   0.1  . 1 . . . . 31 P CB . 19318 1 
      173 . 1 1 32 32 ASN H   H  1   8.51   0.01 . 1 . . . . 32 N HN . 19318 1 
      174 . 1 1 32 32 ASN HA  H  1   4.909  0.01 . 1 . . . . 32 N HA . 19318 1 
      175 . 1 1 32 32 ASN C   C 13 173.34   0.1  . 1 . . . . 32 N C  . 19318 1 
      176 . 1 1 32 32 ASN CA  C 13  51.31   0.1  . 1 . . . . 32 N CA . 19318 1 
      177 . 1 1 32 32 ASN CB  C 13  38.68   0.1  . 1 . . . . 32 N CB . 19318 1 
      178 . 1 1 32 32 ASN N   N 15 120.11   0.1  . 1 . . . . 32 N N  . 19318 1 
      179 . 1 1 33 33 PRO HA  H  1   4.37   0.01 . 1 . . . . 33 P HA . 19318 1 
      180 . 1 1 33 33 PRO C   C 13 176.42   0.1  . 1 . . . . 33 P C  . 19318 1 
      181 . 1 1 33 33 PRO CA  C 13  63.27   0.1  . 1 . . . . 33 P CA . 19318 1 
      182 . 1 1 33 33 PRO CB  C 13  32.18   0.1  . 1 . . . . 33 P CB . 19318 1 
      183 . 1 1 34 34 HIS H   H  1   8.392  0.01 . 1 . . . . 34 H HN . 19318 1 
      184 . 1 1 34 34 HIS HA  H  1   4.914  0.01 . 1 . . . . 34 H HA . 19318 1 
      185 . 1 1 34 34 HIS C   C 13 173.01   0.1  . 1 . . . . 34 H C  . 19318 1 
      186 . 1 1 34 34 HIS CA  C 13  53.87   0.1  . 1 . . . . 34 H CA . 19318 1 
      187 . 1 1 34 34 HIS N   N 15 120.14   0.1  . 1 . . . . 34 H N  . 19318 1 
      188 . 1 1 35 35 PRO HA  H  1   4.458  0.01 . 1 . . . . 35 P HA . 19318 1 
      189 . 1 1 35 35 PRO C   C 13 177.14   0.1  . 1 . . . . 35 P C  . 19318 1 
      190 . 1 1 35 35 PRO CA  C 13  63.25   0.1  . 1 . . . . 35 P CA . 19318 1 
      191 . 1 1 35 35 PRO CB  C 13  32.22   0.1  . 1 . . . . 35 P CB . 19318 1 
      192 . 1 1 36 36 VAL H   H  1   8.513  0.01 . 1 . . . . 36 V HN . 19318 1 
      193 . 1 1 36 36 VAL HA  H  1   4.1295 0.01 . 1 . . . . 36 V HA . 19318 1 
      194 . 1 1 36 36 VAL C   C 13 176.555  0.1  . 1 . . . . 36 V C  . 19318 1 
      195 . 1 1 36 36 VAL CA  C 13  62.705  0.1  . 1 . . . . 36 V CA . 19318 1 
      196 . 1 1 36 36 VAL CB  C 13  32.94   0.1  . 1 . . . . 36 V CB . 19318 1 
      197 . 1 1 36 36 VAL N   N 15 121.12   0.1  . 1 . . . . 36 V N  . 19318 1 
      198 . 1 1 37 37 SER H   H  1   8.52   0.01 . 1 . . . . 37 S HN . 19318 1 
      199 . 1 1 37 37 SER HA  H  1   4.442  0.01 . 1 . . . . 37 S HA . 19318 1 
      200 . 1 1 37 37 SER C   C 13 174.72   0.1  . 1 . . . . 37 S C  . 19318 1 
      201 . 1 1 37 37 SER CA  C 13  58.385  0.1  . 1 . . . . 37 S CA . 19318 1 
      202 . 1 1 37 37 SER CB  C 13  63.87   0.1  . 1 . . . . 37 S CB . 19318 1 
      203 . 1 1 37 37 SER N   N 15 119.54   0.1  . 1 . . . . 37 S N  . 19318 1 
      204 . 1 1 38 38 GLN H   H  1   8.573  0.01 . 1 . . . . 38 Q HN . 19318 1 
      205 . 1 1 38 38 GLN HA  H  1   4.346  0.01 . 1 . . . . 38 Q HA . 19318 1 
      206 . 1 1 38 38 GLN C   C 13 176.04   0.1  . 1 . . . . 38 Q C  . 19318 1 
      207 . 1 1 38 38 GLN CA  C 13  55.87   0.1  . 1 . . . . 38 Q CA . 19318 1 
      208 . 1 1 38 38 GLN CB  C 13  29.5    0.1  . 1 . . . . 38 Q CB . 19318 1 
      209 . 1 1 38 38 GLN N   N 15 122.81   0.1  . 1 . . . . 38 Q N  . 19318 1 
      210 . 1 1 39 39 GLN H   H  1   8.506  0.01 . 1 . . . . 39 Q HN . 19318 1 
      211 . 1 1 39 39 GLN HA  H  1   4.3635 0.01 . 1 . . . . 39 Q HA . 19318 1 
      212 . 1 1 39 39 GLN C   C 13 176.255  0.1  . 1 . . . . 39 Q C  . 19318 1 
      213 . 1 1 39 39 GLN CA  C 13  56.055  0.1  . 1 . . . . 39 Q CA . 19318 1 
      214 . 1 1 39 39 GLN CB  C 13  29.47   0.1  . 1 . . . . 39 Q CB . 19318 1 
      215 . 1 1 39 39 GLN N   N 15 121.66   0.1  . 1 . . . . 39 Q N  . 19318 1 
      216 . 1 1 40 40 THR H   H  1   8.306  0.01 . 1 . . . . 40 T HN . 19318 1 
      217 . 1 1 40 40 THR HA  H  1   4.2825 0.01 . 1 . . . . 40 T HA . 19318 1 
      218 . 1 1 40 40 THR C   C 13 174.4    0.1  . 1 . . . . 40 T C  . 19318 1 
      219 . 1 1 40 40 THR CA  C 13  62.235  0.1  . 1 . . . . 40 T CA . 19318 1 
      220 . 1 1 40 40 THR CB  C 13  69.815  0.1  . 1 . . . . 40 T CB . 19318 1 
      221 . 1 1 40 40 THR N   N 15 116.54   0.1  . 1 . . . . 40 T N  . 19318 1 
      222 . 1 1 41 41 LYS H   H  1   8.443  0.01 . 1 . . . . 41 K HN . 19318 1 
      223 . 1 1 41 41 LYS HA  H  1   4.309  0.01 . 1 . . . . 41 K HA . 19318 1 
      224 . 1 1 41 41 LYS C   C 13 176.25   0.1  . 1 . . . . 41 K C  . 19318 1 
      225 . 1 1 41 41 LYS CA  C 13  56.345  0.1  . 1 . . . . 41 K CA . 19318 1 
      226 . 1 1 41 41 LYS CB  C 13  33.1    0.1  . 1 . . . . 41 K CB . 19318 1 
      227 . 1 1 41 41 LYS N   N 15 124.62   0.1  . 1 . . . . 41 K N  . 19318 1 
      228 . 1 1 42 42 ARG H   H  1   8.481  0.01 . 1 . . . . 42 R HN . 19318 1 
      229 . 1 1 42 42 ARG HA  H  1   4.314  0.01 . 1 . . . . 42 R HA . 19318 1 
      230 . 1 1 42 42 ARG C   C 13 176.055  0.1  . 1 . . . . 42 R C  . 19318 1 
      231 . 1 1 42 42 ARG CA  C 13  56.075  0.1  . 1 . . . . 42 R CA . 19318 1 
      232 . 1 1 42 42 ARG CB  C 13  31.055  0.1  . 1 . . . . 42 R CB . 19318 1 
      233 . 1 1 42 42 ARG N   N 15 123.68   0.1  . 1 . . . . 42 R N  . 19318 1 
      234 . 1 1 43 43 VAL H   H  1   8.357  0.01 . 1 . . . . 43 V HN . 19318 1 
      235 . 1 1 43 43 VAL HA  H  1   4.0325 0.01 . 1 . . . . 43 V HA . 19318 1 
      236 . 1 1 43 43 VAL C   C 13 175.665  0.1  . 1 . . . . 43 V C  . 19318 1 
      237 . 1 1 43 43 VAL CA  C 13  62.345  0.1  . 1 . . . . 43 V CA . 19318 1 
      238 . 1 1 43 43 VAL CB  C 13  32.895  0.1  . 1 . . . . 43 V CB . 19318 1 
      239 . 1 1 43 43 VAL N   N 15 122.62   0.1  . 1 . . . . 43 V N  . 19318 1 
      240 . 1 1 44 44 HIS H   H  1   8.51   0.01 . 1 . . . . 44 H HN . 19318 1 
      241 . 1 1 44 44 HIS HA  H  1   4.9    0.01 . 1 . . . . 44 H HA . 19318 1 
      242 . 1 1 44 44 HIS C   C 13 173.25   0.1  . 1 . . . . 44 H C  . 19318 1 
      243 . 1 1 44 44 HIS CA  C 13  54.06   0.1  . 1 . . . . 44 H CA . 19318 1 
      244 . 1 1 44 44 HIS N   N 15 124.61   0.1  . 1 . . . . 44 H N  . 19318 1 
      245 . 1 1 45 45 PRO HA  H  1   4.415  0.01 . 1 . . . . 45 P HA . 19318 1 
      246 . 1 1 45 45 PRO C   C 13 176.66   0.1  . 1 . . . . 45 P C  . 19318 1 
      247 . 1 1 45 45 PRO CA  C 13  63.13   0.1  . 1 . . . . 45 P CA . 19318 1 
      248 . 1 1 45 45 PRO CB  C 13  32.35   0.1  . 1 . . . . 45 P CB . 19318 1 
      249 . 1 1 46 46 LEU H   H  1   8.602  0.01 . 1 . . . . 46 L HN . 19318 1 
      250 . 1 1 46 46 LEU HA  H  1   4.3355 0.01 . 1 . . . . 46 L HA . 19318 1 
      251 . 1 1 46 46 LEU C   C 13 177.32   0.1  . 1 . . . . 46 L C  . 19318 1 
      252 . 1 1 46 46 LEU CA  C 13  55.57   0.1  . 1 . . . . 46 L CA . 19318 1 
      253 . 1 1 46 46 LEU CB  C 13  42.385  0.1  . 1 . . . . 46 L CB . 19318 1 
      254 . 1 1 46 46 LEU N   N 15 122.6    0.1  . 1 . . . . 46 L N  . 19318 1 
      255 . 1 1 47 47 VAL H   H  1   8.18   0.01 . 1 . . . . 47 V HN . 19318 1 
      256 . 1 1 47 47 VAL HA  H  1   4.454  0.01 . 1 . . . . 47 V HA . 19318 1 
      257 . 1 1 47 47 VAL C   C 13 174.31   0.1  . 1 . . . . 47 V C  . 19318 1 
      258 . 1 1 47 47 VAL CA  C 13  59.66   0.1  . 1 . . . . 47 V CA . 19318 1 
      259 . 1 1 47 47 VAL CB  C 13  32.67   0.1  . 1 . . . . 47 V CB . 19318 1 
      260 . 1 1 47 47 VAL N   N 15 122.32   0.1  . 1 . . . . 47 V N  . 19318 1 
      261 . 1 1 48 48 PRO HA  H  1   4.348  0.01 . 1 . . . . 48 P HA . 19318 1 
      262 . 1 1 48 48 PRO C   C 13 176.96   0.1  . 1 . . . . 48 P C  . 19318 1 
      263 . 1 1 48 48 PRO CA  C 13  63.43   0.1  . 1 . . . . 48 P CA . 19318 1 
      264 . 1 1 48 48 PRO CB  C 13  32.26   0.1  . 1 . . . . 48 P CB . 19318 1 
      265 . 1 1 49 49 GLU H   H  1   8.636  0.01 . 1 . . . . 49 E HN . 19318 1 
      266 . 1 1 49 49 GLU HA  H  1   4.242  0.01 . 1 . . . . 49 E HA . 19318 1 
      267 . 1 1 49 49 GLU C   C 13 176.7    0.1  . 1 . . . . 49 E C  . 19318 1 
      268 . 1 1 49 49 GLU CA  C 13  56.795  0.1  . 1 . . . . 49 E CA . 19318 1 
      269 . 1 1 49 49 GLU CB  C 13  30.265  0.1  . 1 . . . . 49 E CB . 19318 1 
      270 . 1 1 49 49 GLU N   N 15 121.21   0.1  . 1 . . . . 49 E N  . 19318 1 
      271 . 1 1 50 50 LEU H   H  1   8.371  0.01 . 1 . . . . 50 L HN . 19318 1 
      272 . 1 1 50 50 LEU HA  H  1   4.3635 0.01 . 1 . . . . 50 L HA . 19318 1 
      273 . 1 1 50 50 LEU C   C 13 177.47   0.1  . 1 . . . . 50 L C  . 19318 1 
      274 . 1 1 50 50 LEU CA  C 13  55.295  0.1  . 1 . . . . 50 L CA . 19318 1 
      275 . 1 1 50 50 LEU CB  C 13  42.43   0.1  . 1 . . . . 50 L CB . 19318 1 
      276 . 1 1 50 50 LEU N   N 15 123.33   0.1  . 1 . . . . 50 L N  . 19318 1 
      277 . 1 1 51 51 SER H   H  1   8.364  0.01 . 1 . . . . 51 S HN . 19318 1 
      278 . 1 1 51 51 SER HA  H  1   4.406  0.01 . 1 . . . . 51 S HA . 19318 1 
      279 . 1 1 51 51 SER C   C 13 174.53   0.1  . 1 . . . . 51 S C  . 19318 1 
      280 . 1 1 51 51 SER CA  C 13  58.25   0.1  . 1 . . . . 51 S CA . 19318 1 
      281 . 1 1 51 51 SER CB  C 13  63.91   0.1  . 1 . . . . 51 S CB . 19318 1 
      282 . 1 1 51 51 SER N   N 15 116.52   0.1  . 1 . . . . 51 S N  . 19318 1 
      283 . 1 1 52 52 MET HA  H  1   4.503  0.01 . 1 . . . . 52 M HA . 19318 1 
      284 . 1 1 52 52 MET C   C 13 175.97   0.1  . 1 . . . . 52 M C  . 19318 1 
      285 . 1 1 52 52 MET CA  C 13  55.57   0.1  . 1 . . . . 52 M CA . 19318 1 
      286 . 1 1 52 52 MET CB  C 13  32.89   0.1  . 1 . . . . 52 M CB . 19318 1 
      287 . 1 1 53 53 VAL H   H  1   8.181  0.01 . 1 . . . . 53 V HN . 19318 1 
      288 . 1 1 53 53 VAL HA  H  1   4.062  0.01 . 1 . . . . 53 V HA . 19318 1 
      289 . 1 1 53 53 VAL C   C 13 176.2    0.1  . 1 . . . . 53 V C  . 19318 1 
      290 . 1 1 53 53 VAL CA  C 13  62.555  0.1  . 1 . . . . 53 V CA . 19318 1 
      291 . 1 1 53 53 VAL CB  C 13  32.685  0.1  . 1 . . . . 53 V CB . 19318 1 
      292 . 1 1 53 53 VAL N   N 15 121.99   0.1  . 1 . . . . 53 V N  . 19318 1 
      293 . 1 1 54 54 LEU H   H  1   8.475  0.01 . 1 . . . . 54 L HN . 19318 1 
      294 . 1 1 54 54 LEU HA  H  1   4.387  0.01 . 1 . . . . 54 L HA . 19318 1 
      295 . 1 1 54 54 LEU C   C 13 177.11   0.1  . 1 . . . . 54 L C  . 19318 1 
      296 . 1 1 54 54 LEU CA  C 13  54.985  0.1  . 1 . . . . 54 L CA . 19318 1 
      297 . 1 1 54 54 LEU CB  C 13  42.325  0.1  . 1 . . . . 54 L CB . 19318 1 
      298 . 1 1 54 54 LEU N   N 15 126.66   0.1  . 1 . . . . 54 L N  . 19318 1 
      299 . 1 1 55 55 ASP H   H  1   8.369  0.01 . 1 . . . . 55 D HN . 19318 1 
      300 . 1 1 55 55 ASP HA  H  1   4.5755 0.01 . 1 . . . . 55 D HA . 19318 1 
      301 . 1 1 55 55 ASP C   C 13 176.825  0.1  . 1 . . . . 55 D C  . 19318 1 
      302 . 1 1 55 55 ASP CA  C 13  54.49   0.1  . 1 . . . . 55 D CA . 19318 1 
      303 . 1 1 55 55 ASP CB  C 13  41.365  0.1  . 1 . . . . 55 D CB . 19318 1 
      304 . 1 1 55 55 ASP N   N 15 121.64   0.1  . 1 . . . . 55 D N  . 19318 1 
      305 . 1 1 56 56 GLY H   H  1   8.452  0.01 . 1 . . . . 56 G HN . 19318 1 
      306 . 1 1 56 56 GLY HA2 H  1   3.9295 0.01 . 2 . . . . 56 G HA . 19318 1 
      307 . 1 1 56 56 GLY HA3 H  1   3.9295 0.01 . 2 . . . . 56 G HA . 19318 1 
      308 . 1 1 56 56 GLY C   C 13 174.38   0.1  . 1 . . . . 56 G C  . 19318 1 
      309 . 1 1 56 56 GLY CA  C 13  45.615  0.1  . 1 . . . . 56 G CA . 19318 1 
      310 . 1 1 56 56 GLY N   N 15 109.93   0.1  . 1 . . . . 56 G N  . 19318 1 
      311 . 1 1 57 57 SER H   H  1   8.227  0.01 . 1 . . . . 57 S HN . 19318 1 
      312 . 1 1 57 57 SER HA  H  1   4.366  0.01 . 1 . . . . 57 S HA . 19318 1 
      313 . 1 1 57 57 SER C   C 13 174.11   0.1  . 1 . . . . 57 S C  . 19318 1 
      314 . 1 1 57 57 SER CA  C 13  58.705  0.1  . 1 . . . . 57 S CA . 19318 1 
      315 . 1 1 57 57 SER CB  C 13  63.91   0.1  . 1 . . . . 57 S CB . 19318 1 
      316 . 1 1 57 57 SER N   N 15 115.93   0.1  . 1 . . . . 57 S N  . 19318 1 
      317 . 1 1 58 58 PHE H   H  1   8.271  0.01 . 1 . . . . 58 F HN . 19318 1 
      318 . 1 1 58 58 PHE HA  H  1   4.649  0.01 . 1 . . . . 58 F HA . 19318 1 
      319 . 1 1 58 58 PHE C   C 13 175.46   0.1  . 1 . . . . 58 F C  . 19318 1 
      320 . 1 1 58 58 PHE CA  C 13  57.915  0.1  . 1 . . . . 58 F CA . 19318 1 
      321 . 1 1 58 58 PHE CB  C 13  39.5    0.1  . 1 . . . . 58 F CB . 19318 1 
      322 . 1 1 58 58 PHE N   N 15 121.75   0.1  . 1 . . . . 58 F N  . 19318 1 
      323 . 1 1 59 59 LEU H   H  1   8.201  0.01 . 1 . . . . 59 L HN . 19318 1 
      324 . 1 1 59 59 LEU HA  H  1   4.3755 0.01 . 1 . . . . 59 L HA . 19318 1 
      325 . 1 1 59 59 LEU C   C 13 175.99   0.1  . 1 . . . . 59 L C  . 19318 1 
      326 . 1 1 59 59 LEU CA  C 13  54.93   0.1  . 1 . . . . 59 L CA . 19318 1 
      327 . 1 1 59 59 LEU CB  C 13  42.78   0.1  . 1 . . . . 59 L CB . 19318 1 
      328 . 1 1 59 59 LEU N   N 15 124.13   0.1  . 1 . . . . 59 L N  . 19318 1 
      329 . 1 1 60 60 ASP H   H  1   7.807  0.01 . 1 . . . . 60 D HN . 19318 1 
      330 . 1 1 60 60 ASP HA  H  1   4.339  0.01 . 1 . . . . 60 D HA . 19318 1 
      331 . 1 1 60 60 ASP C   C 13 180.88   0.1  . 1 . . . . 60 D C  . 19318 1 
      332 . 1 1 60 60 ASP CA  C 13  55.97   0.1  . 1 . . . . 60 D CA . 19318 1 
      333 . 1 1 60 60 ASP CB  C 13  42.3    0.1  . 1 . . . . 60 D CB . 19318 1 
      334 . 1 1 60 60 ASP N   N 15 126.46   0.1  . 1 . . . . 60 D N  . 19318 1 

   stop_

save_