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                      17817
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Sample_condition_list_ID      1
   _Assigned_chem_shift_list.Sample_condition_list_label  $sample_conditions_1
   _Assigned_chem_shift_list.Chem_shift_reference_ID       1
   _Assigned_chem_shift_list.Chem_shift_reference_label   $chemical_shift_reference_1
   _Assigned_chem_shift_list.Chem_shift_1H_err             .
   _Assigned_chem_shift_list.Chem_shift_13C_err            .
   _Assigned_chem_shift_list.Chem_shift_15N_err            .
   _Assigned_chem_shift_list.Chem_shift_31P_err            .
   _Assigned_chem_shift_list.Chem_shift_2H_err             .
   _Assigned_chem_shift_list.Chem_shift_19F_err            .
   _Assigned_chem_shift_list.Error_derivation_method       .
   _Assigned_chem_shift_list.Details                       .
   _Assigned_chem_shift_list.Text_data_format              .
   _Assigned_chem_shift_list.Text_data                     .

   loop_
      _Chem_shift_experiment.Experiment_ID
      _Chem_shift_experiment.Experiment_name
      _Chem_shift_experiment.Sample_ID
      _Chem_shift_experiment.Sample_label
      _Chem_shift_experiment.Sample_state
      _Chem_shift_experiment.Entry_ID
      _Chem_shift_experiment.Assigned_chem_shift_list_ID

      1 '2D CC SPC53' . . . 17817 1 
      2 '3D CANH'     . . . 17817 1 
      3 '3D CONH'     . . . 17817 1 
      4 '3D DQCANH'   . . . 17817 1 
      5 '3D DQCONH'   . . . 17817 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  29  29 THR CA   C 13  63.9   0.3  . 1 . . . .  29 THR CA   . 17817 1 
        2 . 1 1  29  29 THR CB   C 13  69.1   0.3  . 1 . . . .  29 THR CB   . 17817 1 
        3 . 1 1  30  30 GLY H    H  1   8.24  0.02 . 1 . . . .  30 GLY H    . 17817 1 
        4 . 1 1  30  30 GLY CA   C 13  45.1   0.3  . 1 . . . .  30 GLY CA   . 17817 1 
        5 . 1 1  30  30 GLY N    N 15 108.8   0.3  . 1 . . . .  30 GLY N    . 17817 1 
        6 . 1 1  37  37 THR C    C 13 176.5   0.3  . 1 . . . .  37 THR C    . 17817 1 
        7 . 1 1  38  38 ALA H    H  1   7.26  0.02 . 1 . . . .  38 ALA H    . 17817 1 
        8 . 1 1  38  38 ALA C    C 13 178.3   0.3  . 1 . . . .  38 ALA C    . 17817 1 
        9 . 1 1  38  38 ALA CA   C 13  54.5   0.3  . 1 . . . .  38 ALA CA   . 17817 1 
       10 . 1 1  38  38 ALA N    N 15 120.6   0.3  . 1 . . . .  38 ALA N    . 17817 1 
       11 . 1 1  39  39 ALA H    H  1   8.07  0.02 . 1 . . . .  39 ALA H    . 17817 1 
       12 . 1 1  39  39 ALA C    C 13 178.8   0.3  . 1 . . . .  39 ALA C    . 17817 1 
       13 . 1 1  39  39 ALA CA   C 13  54.5   0.3  . 1 . . . .  39 ALA CA   . 17817 1 
       14 . 1 1  39  39 ALA N    N 15 118.1   0.3  . 1 . . . .  39 ALA N    . 17817 1 
       15 . 1 1  40  40 LEU H    H  1   8.51  0.02 . 1 . . . .  40 LEU H    . 17817 1 
       16 . 1 1  40  40 LEU CA   C 13  57.4   0.3  . 1 . . . .  40 LEU CA   . 17817 1 
       17 . 1 1  40  40 LEU N    N 15 119.7   0.3  . 1 . . . .  40 LEU N    . 17817 1 
       18 . 1 1  81  81 GLY H    H  1   6.81  0.02 . 1 . . . .  81 GLY H    . 17817 1 
       19 . 1 1  81  81 GLY CA   C 13  46     0.3  . 1 . . . .  81 GLY CA   . 17817 1 
       20 . 1 1  81  81 GLY N    N 15 106.5   0.3  . 1 . . . .  81 GLY N    . 17817 1 
       21 . 1 1  82  82 VAL H    H  1   7.14  0.02 . 1 . . . .  82 VAL H    . 17817 1 
       22 . 1 1  82  82 VAL CA   C 13  65.5   0.3  . 1 . . . .  82 VAL CA   . 17817 1 
       23 . 1 1  82  82 VAL N    N 15 123.8   0.3  . 1 . . . .  82 VAL N    . 17817 1 
       24 . 1 1  86  86 THR H    H  1   8.36  0.02 . 1 . . . .  86 THR H    . 17817 1 
       25 . 1 1  86  86 THR C    C 13 176.5   0.3  . 1 . . . .  86 THR C    . 17817 1 
       26 . 1 1  86  86 THR CA   C 13  61.7   0.3  . 1 . . . .  86 THR CA   . 17817 1 
       27 . 1 1  86  86 THR N    N 15 105.6   0.3  . 1 . . . .  86 THR N    . 17817 1 
       28 . 1 1  87  87 GLY H    H  1   8.2   0.02 . 1 . . . .  87 GLY H    . 17817 1 
       29 . 1 1  87  87 GLY C    C 13 171.1   0.3  . 1 . . . .  87 GLY C    . 17817 1 
       30 . 1 1  87  87 GLY CA   C 13  44.4   0.3  . 1 . . . .  87 GLY CA   . 17817 1 
       31 . 1 1  87  87 GLY N    N 15 112.8   0.3  . 1 . . . .  87 GLY N    . 17817 1 
       32 . 1 1  88  88 ASP H    H  1   7.69  0.02 . 1 . . . .  88 ASP H    . 17817 1 
       33 . 1 1  88  88 ASP CA   C 13  52     0.3  . 1 . . . .  88 ASP CA   . 17817 1 
       34 . 1 1  88  88 ASP CB   C 13  43.1   0.3  . 1 . . . .  88 ASP CB   . 17817 1 
       35 . 1 1  88  88 ASP N    N 15 116.6   0.3  . 1 . . . .  88 ASP N    . 17817 1 
       36 . 1 1  89  89 SER CA   C 13  56.3   0.3  . 1 . . . .  89 SER CA   . 17817 1 
       37 . 1 1  89  89 SER CB   C 13  64.4   0.3  . 1 . . . .  89 SER CB   . 17817 1 
       38 . 1 1  90  90 PRO C    C 13 180.1   0.3  . 1 . . . .  90 PRO C    . 17817 1 
       39 . 1 1  91  91 THR H    H  1   9.29  0.02 . 1 . . . .  91 THR H    . 17817 1 
       40 . 1 1  91  91 THR CA   C 13  65.6   0.3  . 1 . . . .  91 THR CA   . 17817 1 
       41 . 1 1  91  91 THR N    N 15 119.2   0.3  . 1 . . . .  91 THR N    . 17817 1 
       42 . 1 1 109 109 PHE C    C 13 177.8   0.3  . 1 . . . . 109 PHE C    . 17817 1 
       43 . 1 1 109 109 PHE CA   C 13  63.05  0.3  . 1 . . . . 109 PHE CA   . 17817 1 
       44 . 1 1 110 110 TYR H    H  1   6.97  0.02 . 1 . . . . 110 TYR H    . 17817 1 
       45 . 1 1 110 110 TYR C    C 13 175.8   0.3  . 1 . . . . 110 TYR C    . 17817 1 
       46 . 1 1 110 110 TYR CA   C 13  61.4   0.3  . 1 . . . . 110 TYR CA   . 17817 1 
       47 . 1 1 110 110 TYR N    N 15 113.6   0.3  . 1 . . . . 110 TYR N    . 17817 1 
       48 . 1 1 111 111 LEU H    H  1   8.69  0.02 . 1 . . . . 111 LEU H    . 17817 1 
       49 . 1 1 111 111 LEU C    C 13 181     0.3  . 1 . . . . 111 LEU C    . 17817 1 
       50 . 1 1 111 111 LEU CA   C 13  58     0.3  . 1 . . . . 111 LEU CA   . 17817 1 
       51 . 1 1 111 111 LEU N    N 15 118.3   0.3  . 1 . . . . 111 LEU N    . 17817 1 
       52 . 1 1 112 112 ILE H    H  1   8.84  0.02 . 1 . . . . 112 ILE H    . 17817 1 
       53 . 1 1 112 112 ILE C    C 13 177.4   0.3  . 1 . . . . 112 ILE C    . 17817 1 
       54 . 1 1 112 112 ILE CA   C 13  64     0.3  . 1 . . . . 112 ILE CA   . 17817 1 
       55 . 1 1 112 112 ILE N    N 15 113.4   0.3  . 1 . . . . 112 ILE N    . 17817 1 
       56 . 1 1 113 113 LEU H    H  1   6.93  0.02 . 1 . . . . 113 LEU H    . 17817 1 
       57 . 1 1 113 113 LEU C    C 13 179.4   0.3  . 1 . . . . 113 LEU C    . 17817 1 
       58 . 1 1 113 113 LEU CA   C 13  56.7   0.3  . 1 . . . . 113 LEU CA   . 17817 1 
       59 . 1 1 113 113 LEU N    N 15 119.1   0.3  . 1 . . . . 113 LEU N    . 17817 1 
       60 . 1 1 114 114 ALA H    H  1   8.86  0.02 . 1 . . . . 114 ALA H    . 17817 1 
       61 . 1 1 114 114 ALA C    C 13 179.4   0.3  . 1 . . . . 114 ALA C    . 17817 1 
       62 . 1 1 114 114 ALA CA   C 13  53.4   0.3  . 1 . . . . 114 ALA CA   . 17817 1 
       63 . 1 1 114 114 ALA CB   C 13  15.7   0.3  . 1 . . . . 114 ALA CB   . 17817 1 
       64 . 1 1 114 114 ALA N    N 15 122.7   0.3  . 1 . . . . 114 ALA N    . 17817 1 
       65 . 1 1 115 115 ALA H    H  1   6.97  0.02 . 1 . . . . 115 ALA H    . 17817 1 
       66 . 1 1 115 115 ALA C    C 13 177.8   0.3  . 1 . . . . 115 ALA C    . 17817 1 
       67 . 1 1 115 115 ALA CA   C 13  52.9   0.3  . 1 . . . . 115 ALA CA   . 17817 1 
       68 . 1 1 115 115 ALA N    N 15 118     0.3  . 1 . . . . 115 ALA N    . 17817 1 
       69 . 1 1 116 116 ALA H    H  1   7.28  0.02 . 1 . . . . 116 ALA H    . 17817 1 
       70 . 1 1 116 116 ALA C    C 13 181.7   0.3  . 1 . . . . 116 ALA C    . 17817 1 
       71 . 1 1 116 116 ALA CA   C 13  52.5   0.3  . 1 . . . . 116 ALA CA   . 17817 1 
       72 . 1 1 116 116 ALA CB   C 13  22.9   0.3  . 1 . . . . 116 ALA CB   . 17817 1 
       73 . 1 1 116 116 ALA N    N 15 117.8   0.3  . 1 . . . . 116 ALA N    . 17817 1 
       74 . 1 1 125 125 LYS C    C 13 177.7   0.3  . 1 . . . . 125 LYS C    . 17817 1 
       75 . 1 1 125 125 LYS CA   C 13  60.542 0.3  . 1 . . . . 125 LYS CA   . 17817 1 
       76 . 1 1 126 126 LYS H    H  1   8.22  0.02 . 1 . . . . 126 LYS H    . 17817 1 
       77 . 1 1 126 126 LYS C    C 13 179     0.3  . 1 . . . . 126 LYS C    . 17817 1 
       78 . 1 1 126 126 LYS CA   C 13  60     0.3  . 1 . . . . 126 LYS CA   . 17817 1 
       79 . 1 1 126 126 LYS CB   C 13  33.2   0.3  . 1 . . . . 126 LYS CB   . 17817 1 
       80 . 1 1 126 126 LYS N    N 15 116.5   0.3  . 1 . . . . 126 LYS N    . 17817 1 
       81 . 1 1 127 127 LEU H    H  1   7.71  0.02 . 1 . . . . 127 LEU H    . 17817 1 
       82 . 1 1 127 127 LEU C    C 13 179.1   0.3  . 1 . . . . 127 LEU C    . 17817 1 
       83 . 1 1 127 127 LEU CA   C 13  56.6   0.3  . 1 . . . . 127 LEU CA   . 17817 1 
       84 . 1 1 127 127 LEU CB   C 13  39.7   0.3  . 1 . . . . 127 LEU CB   . 17817 1 
       85 . 1 1 127 127 LEU N    N 15 115.2   0.3  . 1 . . . . 127 LEU N    . 17817 1 
       86 . 1 1 128 128 LEU H    H  1   8.59  0.02 . 1 . . . . 128 LEU H    . 17817 1 
       87 . 1 1 128 128 LEU C    C 13 179     0.3  . 1 . . . . 128 LEU C    . 17817 1 
       88 . 1 1 128 128 LEU CA   C 13  57.7   0.3  . 1 . . . . 128 LEU CA   . 17817 1 
       89 . 1 1 128 128 LEU N    N 15 119.8   0.3  . 1 . . . . 128 LEU N    . 17817 1 
       90 . 1 1 129 129 VAL H    H  1   8.26  0.02 . 1 . . . . 129 VAL H    . 17817 1 
       91 . 1 1 129 129 VAL C    C 13 177.8   0.3  . 1 . . . . 129 VAL C    . 17817 1 
       92 . 1 1 129 129 VAL CA   C 13  66.8   0.3  . 1 . . . . 129 VAL CA   . 17817 1 
       93 . 1 1 129 129 VAL CB   C 13  30.2   0.3  . 1 . . . . 129 VAL CB   . 17817 1 
       94 . 1 1 129 129 VAL N    N 15 116.2   0.3  . 1 . . . . 129 VAL N    . 17817 1 
       95 . 1 1 139 139 TYR C    C 13 176.9   0.3  . 1 . . . . 139 TYR C    . 17817 1 
       96 . 1 1 140 140 MET H    H  1   8.24  0.02 . 1 . . . . 140 MET H    . 17817 1 
       97 . 1 1 140 140 MET C    C 13 179.7   0.3  . 1 . . . . 140 MET C    . 17817 1 
       98 . 1 1 140 140 MET CA   C 13  60.2   0.3  . 1 . . . . 140 MET CA   . 17817 1 
       99 . 1 1 140 140 MET N    N 15 114.8   0.3  . 1 . . . . 140 MET N    . 17817 1 
      100 . 1 1 141 141 GLY H    H  1   8.28  0.02 . 1 . . . . 141 GLY H    . 17817 1 
      101 . 1 1 141 141 GLY C    C 13 176.3   0.3  . 1 . . . . 141 GLY C    . 17817 1 
      102 . 1 1 141 141 GLY CA   C 13  45.8   0.3  . 1 . . . . 141 GLY CA   . 17817 1 
      103 . 1 1 141 141 GLY N    N 15 107     0.3  . 1 . . . . 141 GLY N    . 17817 1 
      104 . 1 1 142 142 GLU H    H  1   8.57  0.02 . 1 . . . . 142 GLU H    . 17817 1 
      105 . 1 1 142 142 GLU C    C 13 178.3   0.3  . 1 . . . . 142 GLU C    . 17817 1 
      106 . 1 1 142 142 GLU CA   C 13  60.4   0.3  . 1 . . . . 142 GLU CA   . 17817 1 
      107 . 1 1 142 142 GLU CB   C 13  28.1   0.3  . 1 . . . . 142 GLU CB   . 17817 1 
      108 . 1 1 142 142 GLU N    N 15 122.6   0.3  . 1 . . . . 142 GLU N    . 17817 1 
      109 . 1 1 143 143 ALA H    H  1   8.71  0.02 . 1 . . . . 143 ALA H    . 17817 1 
      110 . 1 1 143 143 ALA C    C 13 178.5   0.3  . 1 . . . . 143 ALA C    . 17817 1 
      111 . 1 1 143 143 ALA CA   C 13  51.2   0.3  . 1 . . . . 143 ALA CA   . 17817 1 
      112 . 1 1 143 143 ALA CB   C 13  17.9   0.3  . 1 . . . . 143 ALA CB   . 17817 1 
      113 . 1 1 143 143 ALA N    N 15 117.2   0.3  . 1 . . . . 143 ALA N    . 17817 1 
      114 . 1 1 144 144 GLY H    H  1   7.42  0.02 . 1 . . . . 144 GLY H    . 17817 1 
      115 . 1 1 144 144 GLY C    C 13 174.8   0.3  . 1 . . . . 144 GLY C    . 17817 1 
      116 . 1 1 144 144 GLY CA   C 13  45.3   0.3  . 1 . . . . 144 GLY CA   . 17817 1 
      117 . 1 1 144 144 GLY N    N 15 105.7   0.3  . 1 . . . . 144 GLY N    . 17817 1 
      118 . 1 1 145 145 ILE H    H  1   8.2   0.02 . 1 . . . . 145 ILE H    . 17817 1 
      119 . 1 1 145 145 ILE C    C 13 175     0.3  . 1 . . . . 145 ILE C    . 17817 1 
      120 . 1 1 145 145 ILE CA   C 13  62.5   0.3  . 1 . . . . 145 ILE CA   . 17817 1 
      121 . 1 1 145 145 ILE N    N 15 120.9   0.3  . 1 . . . . 145 ILE N    . 17817 1 
      122 . 1 1 146 146 MET H    H  1   7.26  0.02 . 1 . . . . 146 MET H    . 17817 1 
      123 . 1 1 146 146 MET C    C 13 174.4   0.3  . 1 . . . . 146 MET C    . 17817 1 
      124 . 1 1 146 146 MET CA   C 13  52.6   0.3  . 1 . . . . 146 MET CA   . 17817 1 
      125 . 1 1 146 146 MET N    N 15 114.5   0.3  . 1 . . . . 146 MET N    . 17817 1 
      126 . 1 1 147 147 ALA H    H  1   9.04  0.02 . 1 . . . . 147 ALA H    . 17817 1 
      127 . 1 1 147 147 ALA C    C 13 178.3   0.3  . 1 . . . . 147 ALA C    . 17817 1 
      128 . 1 1 147 147 ALA CA   C 13  52.8   0.3  . 1 . . . . 147 ALA CA   . 17817 1 
      129 . 1 1 147 147 ALA CB   C 13  17.8   0.3  . 1 . . . . 147 ALA CB   . 17817 1 
      130 . 1 1 147 147 ALA N    N 15 125.2   0.3  . 1 . . . . 147 ALA N    . 17817 1 
      131 . 1 1 148 148 ALA H    H  1   8.47  0.02 . 1 . . . . 148 ALA H    . 17817 1 
      132 . 1 1 148 148 ALA C    C 13 182.1   0.3  . 1 . . . . 148 ALA C    . 17817 1 
      133 . 1 1 148 148 ALA CA   C 13  55.2   0.3  . 1 . . . . 148 ALA CA   . 17817 1 
      134 . 1 1 148 148 ALA CB   C 13  17.9   0.3  . 1 . . . . 148 ALA CB   . 17817 1 
      135 . 1 1 148 148 ALA N    N 15 123.9   0.3  . 1 . . . . 148 ALA N    . 17817 1 
      136 . 1 1 149 149 TRP H    H  1   9.82  0.02 . 1 . . . . 149 TRP H    . 17817 1 
      137 . 1 1 149 149 TRP C    C 13 176.6   0.3  . 1 . . . . 149 TRP C    . 17817 1 
      138 . 1 1 149 149 TRP CA   C 13  62.3   0.3  . 1 . . . . 149 TRP CA   . 17817 1 
      139 . 1 1 149 149 TRP N    N 15 118.4   0.3  . 1 . . . . 149 TRP N    . 17817 1 
      140 . 1 1 150 150 PRO C    C 13 177.5   0.3  . 1 . . . . 150 PRO C    . 17817 1 
      141 . 1 1 150 150 PRO CA   C 13  65.6   0.3  . 1 . . . . 150 PRO CA   . 17817 1 
      142 . 1 1 151 151 ALA H    H  1   7.42  0.02 . 1 . . . . 151 ALA H    . 17817 1 
      143 . 1 1 151 151 ALA C    C 13 178.3   0.3  . 1 . . . . 151 ALA C    . 17817 1 
      144 . 1 1 151 151 ALA CA   C 13  55.9   0.3  . 1 . . . . 151 ALA CA   . 17817 1 
      145 . 1 1 151 151 ALA CB   C 13  17.6   0.3  . 1 . . . . 151 ALA CB   . 17817 1 
      146 . 1 1 151 151 ALA N    N 15 117.5   0.3  . 1 . . . . 151 ALA N    . 17817 1 
      147 . 1 1 152 152 PHE H    H  1   7.73  0.02 . 1 . . . . 152 PHE H    . 17817 1 
      148 . 1 1 152 152 PHE C    C 13 177.8   0.3  . 1 . . . . 152 PHE C    . 17817 1 
      149 . 1 1 152 152 PHE CA   C 13  60.1   0.3  . 1 . . . . 152 PHE CA   . 17817 1 
      150 . 1 1 152 152 PHE N    N 15 116.3   0.3  . 1 . . . . 152 PHE N    . 17817 1 
      151 . 1 1 156 156 CYS CA   C 13  64.3   0.3  . 1 . . . . 156 CYS CA   . 17817 1 
      152 . 1 1 156 156 CYS CB   C 13  26.6   0.3  . 1 . . . . 156 CYS CB   . 17817 1 
      153 . 1 1 166 166 LEU CA   C 13  54.9   0.3  . 1 . . . . 166 LEU CA   . 17817 1 
      154 . 1 1 166 166 LEU CB   C 13  40.2   0.3  . 1 . . . . 166 LEU CB   . 17817 1 
      155 . 1 1 168 168 ALA H    H  1   8.69  0.02 . 1 . . . . 168 ALA H    . 17817 1 
      156 . 1 1 168 168 ALA C    C 13 177.5   0.3  . 1 . . . . 168 ALA C    . 17817 1 
      157 . 1 1 168 168 ALA CA   C 13  51.2   0.3  . 1 . . . . 168 ALA CA   . 17817 1 
      158 . 1 1 168 168 ALA CB   C 13  21.8   0.3  . 1 . . . . 168 ALA CB   . 17817 1 
      159 . 1 1 168 168 ALA N    N 15 117     0.3  . 1 . . . . 168 ALA N    . 17817 1 
      160 . 1 1 169 169 GLY H    H  1   7.4   0.02 . 1 . . . . 169 GLY H    . 17817 1 
      161 . 1 1 169 169 GLY C    C 13 174.7   0.3  . 1 . . . . 169 GLY C    . 17817 1 
      162 . 1 1 169 169 GLY CA   C 13  44.3   0.3  . 1 . . . . 169 GLY CA   . 17817 1 
      163 . 1 1 169 169 GLY N    N 15 109     0.3  . 1 . . . . 169 GLY N    . 17817 1 
      164 . 1 1 170 170 GLU H    H  1   9.39  0.02 . 1 . . . . 170 GLU H    . 17817 1 
      165 . 1 1 170 170 GLU C    C 13 179.9   0.3  . 1 . . . . 170 GLU C    . 17817 1 
      166 . 1 1 170 170 GLU CA   C 13  58.8   0.3  . 1 . . . . 170 GLU CA   . 17817 1 
      167 . 1 1 170 170 GLU N    N 15 125.7   0.3  . 1 . . . . 170 GLU N    . 17817 1 
      168 . 1 1 171 171 GLY H    H  1   8.39  0.02 . 1 . . . . 171 GLY H    . 17817 1 
      169 . 1 1 171 171 GLY C    C 13 174.5   0.3  . 1 . . . . 171 GLY C    . 17817 1 
      170 . 1 1 171 171 GLY CA   C 13  47.3   0.3  . 1 . . . . 171 GLY CA   . 17817 1 
      171 . 1 1 171 171 GLY N    N 15 105.3   0.3  . 1 . . . . 171 GLY N    . 17817 1 
      172 . 1 1 172 172 LYS H    H  1   6.36  0.02 . 1 . . . . 172 LYS H    . 17817 1 
      173 . 1 1 172 172 LYS C    C 13 178.3   0.3  . 1 . . . . 172 LYS C    . 17817 1 
      174 . 1 1 172 172 LYS CA   C 13  56.8   0.3  . 1 . . . . 172 LYS CA   . 17817 1 
      175 . 1 1 172 172 LYS N    N 15 122.4   0.3  . 1 . . . . 172 LYS N    . 17817 1 
      176 . 1 1 173 173 SER H    H  1   8.08  0.02 . 1 . . . . 173 SER H    . 17817 1 
      177 . 1 1 173 173 SER C    C 13 176.3   0.3  . 1 . . . . 173 SER C    . 17817 1 
      178 . 1 1 173 173 SER CA   C 13  61.1   0.3  . 1 . . . . 173 SER CA   . 17817 1 
      179 . 1 1 173 173 SER CB   C 13  61.9   0.3  . 1 . . . . 173 SER CB   . 17817 1 
      180 . 1 1 173 173 SER N    N 15 112.1   0.3  . 1 . . . . 173 SER N    . 17817 1 
      181 . 1 1 174 174 ALA H    H  1   7.34  0.02 . 1 . . . . 174 ALA H    . 17817 1 
      182 . 1 1 174 174 ALA C    C 13 180.2   0.3  . 1 . . . . 174 ALA C    . 17817 1 
      183 . 1 1 174 174 ALA CA   C 13  53.9   0.3  . 1 . . . . 174 ALA CA   . 17817 1 
      184 . 1 1 174 174 ALA CB   C 13  18     0.3  . 1 . . . . 174 ALA CB   . 17817 1 
      185 . 1 1 174 174 ALA N    N 15 121     0.3  . 1 . . . . 174 ALA N    . 17817 1 
      186 . 1 1 175 175 CYS H    H  1   8.88  0.02 . 1 . . . . 175 CYS H    . 17817 1 
      187 . 1 1 175 175 CYS C    C 13 176.3   0.3  . 1 . . . . 175 CYS C    . 17817 1 
      188 . 1 1 175 175 CYS CA   C 13  61.3   0.3  . 1 . . . . 175 CYS CA   . 17817 1 
      189 . 1 1 175 175 CYS CB   C 13  25     0.3  . 1 . . . . 175 CYS CB   . 17817 1 
      190 . 1 1 175 175 CYS N    N 15 122.3   0.3  . 1 . . . . 175 CYS N    . 17817 1 
      191 . 1 1 176 176 ASN H    H  1   8.04  0.02 . 1 . . . . 176 ASN H    . 17817 1 
      192 . 1 1 176 176 ASN C    C 13 176.5   0.3  . 1 . . . . 176 ASN C    . 17817 1 
      193 . 1 1 176 176 ASN CA   C 13  54.5   0.3  . 1 . . . . 176 ASN CA   . 17817 1 
      194 . 1 1 176 176 ASN CB   C 13  37.3   0.3  . 1 . . . . 176 ASN CB   . 17817 1 
      195 . 1 1 176 176 ASN N    N 15 113.9   0.3  . 1 . . . . 176 ASN N    . 17817 1 
      196 . 1 1 176 176 ASN HD21 H  1   7.60  0.02 . 1 . . . . 176 ASN HD21 . 17817 1 
      197 . 1 1 176 176 ASN HD22 H  1   6.94  0.02 . 1 . . . . 176 ASN HD22 . 17817 1 
      198 . 1 1 176 176 ASN ND2  N 15 110.1   0.3  . 1 . . . . 176 ASN ND2  . 17817 1 
      199 . 1 1 176 176 ASN CG   C 13 175.7   0.3  . 1 . . . . 176 ASN CG   . 17817 1 
      200 . 1 1 177 177 THR H    H  1   7.69  0.02 . 1 . . . . 177 THR H    . 17817 1 
      201 . 1 1 177 177 THR C    C 13 174.3   0.3  . 1 . . . . 177 THR C    . 17817 1 
      202 . 1 1 177 177 THR CA   C 13  61     0.3  . 1 . . . . 177 THR CA   . 17817 1 
      203 . 1 1 177 177 THR CB   C 13  69.8   0.3  . 1 . . . . 177 THR CB   . 17817 1 
      204 . 1 1 177 177 THR CG2  C 13  20.4   0.3  . 1 . . . . 177 THR CG2  . 17817 1 
      205 . 1 1 177 177 THR N    N 15 107.4   0.3  . 1 . . . . 177 THR N    . 17817 1 
      206 . 1 1 178 178 ALA H    H  1   7.79  0.02 . 1 . . . . 178 ALA H    . 17817 1 
      207 . 1 1 178 178 ALA C    C 13 176.6   0.3  . 1 . . . . 178 ALA C    . 17817 1 
      208 . 1 1 178 178 ALA CA   C 13  50.1   0.3  . 1 . . . . 178 ALA CA   . 17817 1 
      209 . 1 1 178 178 ALA CB   C 13  19.7   0.3  . 1 . . . . 178 ALA CB   . 17817 1 
      210 . 1 1 178 178 ALA N    N 15 125     0.3  . 1 . . . . 178 ALA N    . 17817 1 
      211 . 1 1 179 179 SER H    H  1   8.45  0.02 . 1 . . . . 179 SER H    . 17817 1 
      212 . 1 1 179 179 SER C    C 13 173.2   0.3  . 1 . . . . 179 SER C    . 17817 1 
      213 . 1 1 179 179 SER CA   C 13  56.3   0.3  . 1 . . . . 179 SER CA   . 17817 1 
      214 . 1 1 179 179 SER CB   C 13  61.8   0.3  . 1 . . . . 179 SER CB   . 17817 1 
      215 . 1 1 179 179 SER N    N 15 116.8   0.3  . 1 . . . . 179 SER N    . 17817 1 
      216 . 1 1 180 180 PRO CA   C 13  65.5   0.3  . 1 . . . . 180 PRO CA   . 17817 1 
      217 . 1 1 180 180 PRO C    C 13 179.6   0.3  . 1 . . . . 180 PRO C    . 17817 1 
      218 . 1 1 181 181 ALA H    H  1   8.51  0.02 . 1 . . . . 181 ALA H    . 17817 1 
      219 . 1 1 181 181 ALA C    C 13 181.2   0.3  . 1 . . . . 181 ALA C    . 17817 1 
      220 . 1 1 181 181 ALA CA   C 13  54.6   0.3  . 1 . . . . 181 ALA CA   . 17817 1 
      221 . 1 1 181 181 ALA CB   C 13  17.3   0.3  . 1 . . . . 181 ALA CB   . 17817 1 
      222 . 1 1 181 181 ALA N    N 15 118.8   0.3  . 1 . . . . 181 ALA N    . 17817 1 
      223 . 1 1 182 182 VAL H    H  1   7.67  0.02 . 1 . . . . 182 VAL H    . 17817 1 
      224 . 1 1 182 182 VAL C    C 13 177.3   0.3  . 1 . . . . 182 VAL C    . 17817 1 
      225 . 1 1 182 182 VAL CA   C 13  66.1   0.3  . 1 . . . . 182 VAL CA   . 17817 1 
      226 . 1 1 182 182 VAL CB   C 13  29.7   0.3  . 1 . . . . 182 VAL CB   . 17817 1 
      227 . 1 1 182 182 VAL N    N 15 121     0.3  . 1 . . . . 182 VAL N    . 17817 1 
      228 . 1 1 183 183 GLN H    H  1   8.73  0.02 . 1 . . . . 183 GLN H    . 17817 1 
      229 . 1 1 183 183 GLN C    C 13 178.7   0.3  . 1 . . . . 183 GLN C    . 17817 1 
      230 . 1 1 183 183 GLN CA   C 13  59.4   0.3  . 1 . . . . 183 GLN CA   . 17817 1 
      231 . 1 1 183 183 GLN CB   C 13  26.6   0.3  . 1 . . . . 183 GLN CB   . 17817 1 
      232 . 1 1 183 183 GLN N    N 15 118.6   0.3  . 1 . . . . 183 GLN N    . 17817 1 
      233 . 1 1 183 183 GLN NE2  N 15 111.8   0.3  . 1 . . . . 183 GLN NE2  . 17817 1 
      234 . 1 1 183 183 GLN HE21 H  1   7.43  0.02 . 1 . . . . 183 GLN HE21 . 17817 1 
      235 . 1 1 183 183 GLN HE22 H  1   6.74  0.02 . 1 . . . . 183 GLN HE22 . 17817 1 
      236 . 1 1 183 183 GLN CG   C 13  33.2   0.3  . 1 . . . . 183 GLN CG   . 17817 1 
      237 . 1 1 183 183 GLN CD   C 13 180.5   0.3  . 1 . . . . 183 GLN CD   . 17817 1 
      238 . 1 1 184 184 SER H    H  1   8.2   0.02 . 1 . . . . 184 SER H    . 17817 1 
      239 . 1 1 184 184 SER C    C 13 177.4   0.3  . 1 . . . . 184 SER C    . 17817 1 
      240 . 1 1 184 184 SER CA   C 13  60.9   0.3  . 1 . . . . 184 SER CA   . 17817 1 
      241 . 1 1 184 184 SER CB   C 13  62.1   0.3  . 1 . . . . 184 SER CB   . 17817 1 
      242 . 1 1 184 184 SER N    N 15 112     0.3  . 1 . . . . 184 SER N    . 17817 1 
      243 . 1 1 185 185 ALA H    H  1   7.73  0.02 . 1 . . . . 185 ALA H    . 17817 1 
      244 . 1 1 185 185 ALA C    C 13 177.8   0.3  . 1 . . . . 185 ALA C    . 17817 1 
      245 . 1 1 185 185 ALA CA   C 13  54.9   0.3  . 1 . . . . 185 ALA CA   . 17817 1 
      246 . 1 1 185 185 ALA N    N 15 124.1   0.3  . 1 . . . . 185 ALA N    . 17817 1 
      247 . 1 1 186 186 TYR H    H  1   8.96  0.02 . 1 . . . . 186 TYR H    . 17817 1 
      248 . 1 1 186 186 TYR C    C 13 178     0.3  . 1 . . . . 186 TYR C    . 17817 1 
      249 . 1 1 186 186 TYR CA   C 13  60.7   0.3  . 1 . . . . 186 TYR CA   . 17817 1 
      250 . 1 1 186 186 TYR CB   C 13  39.1   0.3  . 1 . . . . 186 TYR CB   . 17817 1 
      251 . 1 1 186 186 TYR N    N 15 118.3   0.3  . 1 . . . . 186 TYR N    . 17817 1 
      252 . 1 1 187 187 ASN H    H  1   8.55  0.02 . 1 . . . . 187 ASN H    . 17817 1 
      253 . 1 1 187 187 ASN C    C 13 173.3   0.3  . 1 . . . . 187 ASN C    . 17817 1 
      254 . 1 1 187 187 ASN CA   C 13  56.3   0.3  . 1 . . . . 187 ASN CA   . 17817 1 
      255 . 1 1 187 187 ASN N    N 15 116.9   0.3  . 1 . . . . 187 ASN N    . 17817 1 
      256 . 1 1 189 189 MET CA   C 13  59.4   0.3  . 1 . . . . 189 MET CA   . 17817 1 
      257 . 1 1 189 189 MET CB   C 13  34.7   0.3  . 1 . . . . 189 MET CB   . 17817 1 
      258 . 1 1 203 203 GLY H    H  1   8.96  0.02 . 1 . . . . 203 GLY H    . 17817 1 
      259 . 1 1 203 203 GLY CA   C 13  47.5   0.3  . 1 . . . . 203 GLY CA   . 17817 1 
      260 . 1 1 203 203 GLY N    N 15 111.7   0.3  . 1 . . . . 203 GLY N    . 17817 1 
      261 . 1 1 206 206 THR H    H  1   8.06  0.02 . 1 . . . . 206 THR H    . 17817 1 
      262 . 1 1 206 206 THR C    C 13 176     0.3  . 1 . . . . 206 THR C    . 17817 1 
      263 . 1 1 206 206 THR CA   C 13  61.4   0.3  . 1 . . . . 206 THR CA   . 17817 1 
      264 . 1 1 206 206 THR CB   C 13  71.8   0.3  . 1 . . . . 206 THR CB   . 17817 1 
      265 . 1 1 206 206 THR N    N 15 105.2   0.3  . 1 . . . . 206 THR N    . 17817 1 
      266 . 1 1 207 207 GLY H    H  1   8     0.02 . 1 . . . . 207 GLY H    . 17817 1 
      267 . 1 1 207 207 GLY C    C 13 177.2   0.3  . 1 . . . . 207 GLY C    . 17817 1 
      268 . 1 1 207 207 GLY CA   C 13  45     0.3  . 1 . . . . 207 GLY CA   . 17817 1 
      269 . 1 1 207 207 GLY N    N 15 111.7   0.3  . 1 . . . . 207 GLY N    . 17817 1 
      270 . 1 1 208 208 TYR H    H  1   7.65  0.02 . 1 . . . . 208 TYR H    . 17817 1 
      271 . 1 1 208 208 TYR CA   C 13  51.3   0.3  . 1 . . . . 208 TYR CA   . 17817 1 
      272 . 1 1 208 208 TYR N    N 15 117.5   0.3  . 1 . . . . 208 TYR N    . 17817 1 
      273 . 1 1 219 219 LEU C    C 13 178.1   0.3  . 1 . . . . 219 LEU C    . 17817 1 
      274 . 1 1 219 219 LEU CA   C 13  59.3   0.3  . 1 . . . . 219 LEU CA   . 17817 1 
      275 . 1 1 220 220 ASN H    H  1   8.08  0.02 . 1 . . . . 220 ASN H    . 17817 1 
      276 . 1 1 220 220 ASN C    C 13 175.1   0.3  . 1 . . . . 220 ASN C    . 17817 1 
      277 . 1 1 220 220 ASN CA   C 13  57.7   0.3  . 1 . . . . 220 ASN CA   . 17817 1 
      278 . 1 1 220 220 ASN CB   C 13  38.1   0.3  . 1 . . . . 220 ASN CB   . 17817 1 
      279 . 1 1 220 220 ASN N    N 15 114     0.3  . 1 . . . . 220 ASN N    . 17817 1 
      280 . 1 1 222 222 ILE H    H  1   7.65  0.02 . 1 . . . . 222 ILE H    . 17817 1 
      281 . 1 1 222 222 ILE C    C 13 177.4   0.3  . 1 . . . . 222 ILE C    . 17817 1 
      282 . 1 1 222 222 ILE CA   C 13  65.1   0.3  . 1 . . . . 222 ILE CA   . 17817 1 
      283 . 1 1 222 222 ILE CB   C 13  37.4   0.3  . 1 . . . . 222 ILE CB   . 17817 1 
      284 . 1 1 222 222 ILE N    N 15 115     0.3  . 1 . . . . 222 ILE N    . 17817 1 
      285 . 1 1 223 223 TYR H    H  1   9.23  0.02 . 1 . . . . 223 TYR H    . 17817 1 
      286 . 1 1 223 223 TYR C    C 13 179.2   0.3  . 1 . . . . 223 TYR C    . 17817 1 
      287 . 1 1 223 223 TYR CA   C 13  57     0.3  . 1 . . . . 223 TYR CA   . 17817 1 
      288 . 1 1 223 223 TYR N    N 15 117.9   0.3  . 1 . . . . 223 TYR N    . 17817 1 
      289 . 1 1 224 224 ASN H    H  1   8.22  0.02 . 1 . . . . 224 ASN H    . 17817 1 
      290 . 1 1 224 224 ASN C    C 13 177.3   0.3  . 1 . . . . 224 ASN C    . 17817 1 
      291 . 1 1 224 224 ASN CA   C 13  54.5   0.3  . 1 . . . . 224 ASN CA   . 17817 1 
      292 . 1 1 224 224 ASN N    N 15 119.8   0.3  . 1 . . . . 224 ASN N    . 17817 1 
      293 . 1 1 225 225 LEU H    H  1   7.87  0.02 . 1 . . . . 225 LEU H    . 17817 1 
      294 . 1 1 225 225 LEU C    C 13 180.1   0.3  . 1 . . . . 225 LEU C    . 17817 1 
      295 . 1 1 225 225 LEU CA   C 13  56.6   0.3  . 1 . . . . 225 LEU CA   . 17817 1 
      296 . 1 1 225 225 LEU CB   C 13  40.1   0.3  . 1 . . . . 225 LEU CB   . 17817 1 
      297 . 1 1 225 225 LEU N    N 15 115.5   0.3  . 1 . . . . 225 LEU N    . 17817 1 
      298 . 1 1 226 226 ALA H    H  1   8.92  0.02 . 1 . . . . 226 ALA H    . 17817 1 
      299 . 1 1 226 226 ALA C    C 13 183.5   0.3  . 1 . . . . 226 ALA C    . 17817 1 
      300 . 1 1 226 226 ALA CA   C 13  54.4   0.3  . 1 . . . . 226 ALA CA   . 17817 1 
      301 . 1 1 226 226 ALA N    N 15 119.1   0.3  . 1 . . . . 226 ALA N    . 17817 1 
      302 . 1 1 227 227 ASP H    H  1   7.65  0.02 . 1 . . . . 227 ASP H    . 17817 1 
      303 . 1 1 227 227 ASP CA   C 13  57.8   0.3  . 1 . . . . 227 ASP CA   . 17817 1 
      304 . 1 1 227 227 ASP N    N 15 118.8   0.3  . 1 . . . . 227 ASP N    . 17817 1 
      305 . 1 1 230 230 ASN H    H  1   8     0.02 . 1 . . . . 230 ASN H    . 17817 1 
      306 . 1 1 230 230 ASN CA   C 13  54.5   0.3  . 1 . . . . 230 ASN CA   . 17817 1 
      307 . 1 1 230 230 ASN N    N 15 113.9   0.3  . 1 . . . . 230 ASN N    . 17817 1 
      308 . 1 1 231 231 LYS H    H  1   7.91  0.02 . 1 . . . . 231 LYS H    . 17817 1 
      309 . 1 1 231 231 LYS CA   C 13  58.6   0.3  . 1 . . . . 231 LYS CA   . 17817 1 
      310 . 1 1 231 231 LYS N    N 15 112.5   0.3  . 1 . . . . 231 LYS N    . 17817 1 
      311 . 1 1 233 233 LEU C    C 13 177.9   0.3  . 1 . . . . 233 LEU C    . 17817 1 
      312 . 1 1 233 233 LEU CA   C 13  58.52  0.3  . 1 . . . . 233 LEU CA   . 17817 1 
      313 . 1 1 234 234 PHE H    H  1   7.16  0.02 . 1 . . . . 234 PHE H    . 17817 1 
      314 . 1 1 234 234 PHE C    C 13 175.6   0.3  . 1 . . . . 234 PHE C    . 17817 1 
      315 . 1 1 234 234 PHE CA   C 13  62.2   0.3  . 1 . . . . 234 PHE CA   . 17817 1 
      316 . 1 1 234 234 PHE CB   C 13  40.1   0.3  . 1 . . . . 234 PHE CB   . 17817 1 
      317 . 1 1 234 234 PHE N    N 15 114.9   0.3  . 1 . . . . 234 PHE N    . 17817 1 
      318 . 1 1 235 235 GLY H    H  1   7.3   0.02 . 1 . . . . 235 GLY H    . 17817 1 
      319 . 1 1 235 235 GLY C    C 13 176.7   0.3  . 1 . . . . 235 GLY C    . 17817 1 
      320 . 1 1 235 235 GLY CA   C 13  47     0.3  . 1 . . . . 235 GLY CA   . 17817 1 
      321 . 1 1 235 235 GLY N    N 15 100.8   0.3  . 1 . . . . 235 GLY N    . 17817 1 
      322 . 1 1 236 236 LEU H    H  1   8.69  0.02 . 1 . . . . 236 LEU H    . 17817 1 
      323 . 1 1 236 236 LEU C    C 13 179.3   0.3  . 1 . . . . 236 LEU C    . 17817 1 
      324 . 1 1 236 236 LEU CA   C 13  57.9   0.3  . 1 . . . . 236 LEU CA   . 17817 1 
      325 . 1 1 236 236 LEU N    N 15 123.2   0.3  . 1 . . . . 236 LEU N    . 17817 1 
      326 . 1 1 238 238 ILE H    H  1   7.05  0.02 . 1 . . . . 238 ILE H    . 17817 1 
      327 . 1 1 238 238 ILE CA   C 13  64.5   0.3  . 1 . . . . 238 ILE CA   . 17817 1 
      328 . 1 1 238 238 ILE N    N 15 122     0.3  . 1 . . . . 238 ILE N    . 17817 1 
      329 . 1 1 239 239 TRP C    C 13 175.8   0.3  . 1 . . . . 239 TRP C    . 17817 1 
      330 . 1 1 239 239 TRP CA   C 13  62.1   0.3  . 1 . . . . 239 TRP CA   . 17817 1 
      331 . 1 1 240 240 ASN H    H  1   8.61  0.02 . 1 . . . . 240 ASN H    . 17817 1 
      332 . 1 1 240 240 ASN C    C 13 176.5   0.3  . 1 . . . . 240 ASN C    . 17817 1 
      333 . 1 1 240 240 ASN CA   C 13  56.3   0.3  . 1 . . . . 240 ASN CA   . 17817 1 
      334 . 1 1 240 240 ASN CB   C 13  39.2   0.03 . 1 . . . . 240 ASN CB   . 17817 1 
      335 . 1 1 240 240 ASN N    N 15 114     0.3  . 1 . . . . 240 ASN N    . 17817 1 
      336 . 1 1 241 241 VAL H    H  1   7.69  0.02 . 1 . . . . 241 VAL H    . 17817 1 
      337 . 1 1 241 241 VAL C    C 13 174.7   0.3  . 1 . . . . 241 VAL C    . 17817 1 
      338 . 1 1 241 241 VAL CA   C 13  63.6   0.3  . 1 . . . . 241 VAL CA   . 17817 1 
      339 . 1 1 241 241 VAL CB   C 13  29.6   0.3  . 1 . . . . 241 VAL CB   . 17817 1 
      340 . 1 1 241 241 VAL N    N 15 117.3   0.3  . 1 . . . . 241 VAL N    . 17817 1 
      341 . 1 1 242 242 ALA H    H  1   8.2   0.02 . 1 . . . . 242 ALA H    . 17817 1 
      342 . 1 1 242 242 ALA C    C 13 180.7   0.3  . 1 . . . . 242 ALA C    . 17817 1 
      343 . 1 1 242 242 ALA CA   C 13  53.7   0.3  . 1 . . . . 242 ALA CA   . 17817 1 
      344 . 1 1 242 242 ALA CB   C 13  18.8   0.3  . 1 . . . . 242 ALA CB   . 17817 1 
      345 . 1 1 242 242 ALA N    N 15 125.8   0.3  . 1 . . . . 242 ALA N    . 17817 1 
      346 . 1 1 248 248 ASN H    H  1   7.24  0.02 . 1 . . . . 248 ASN H    . 17817 1 
      347 . 1 1 248 248 ASN CA   C 13  52.4   0.3  . 1 . . . . 248 ASN CA   . 17817 1 
      348 . 1 1 248 248 ASN CB   C 13  36.9   0.3  . 1 . . . . 248 ASN CB   . 17817 1 
      349 . 1 1 248 248 ASN N    N 15 114.2   0.3  . 1 . . . . 248 ASN N    . 17817 1 
      350 . 1 1 249 249 ALA H    H  1   8.96  0.02 . 1 . . . . 249 ALA H    . 17817 1 
      351 . 1 1 249 249 ALA CA   C 13  52.7   0.3  . 1 . . . . 249 ALA CA   . 17817 1 
      352 . 1 1 249 249 ALA N    N 15 125.4   0.3  . 1 . . . . 249 ALA N    . 17817 1 

   stop_

save_