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                      15622
   _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             0.001
   _Assigned_chem_shift_list.Chem_shift_13C_err            .
   _Assigned_chem_shift_list.Chem_shift_15N_err            0.01
   _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

      2 '2D 1H-1H TOCSY'       . . . 15622 1 
      3 '2D 1H-1H NOESY'       . . . 15622 1 
      5 '3D 1H-15N HSQC-NOESY' . . . 15622 1 

   stop_

   loop_
      _Chem_shift_software.Software_ID
      _Chem_shift_software.Software_label
      _Chem_shift_software.Method_ID
      _Chem_shift_software.Method_label
      _Chem_shift_software.Entry_ID
      _Chem_shift_software.Assigned_chem_shift_list_ID

      2 $GIFA . . 15622 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 ALA H    H  1   7.643 0.001 . 1 . . . .   2 ALA H    . 15622 1 
        2 . 1 1   2   2 ALA HA   H  1   4.231 0.001 . 1 . . . .   2 ALA HA   . 15622 1 
        3 . 1 1   2   2 ALA HB1  H  1   1.180 0.001 . 1 . . . .   2 ALA HB   . 15622 1 
        4 . 1 1   2   2 ALA HB2  H  1   1.180 0.001 . 1 . . . .   2 ALA HB   . 15622 1 
        5 . 1 1   2   2 ALA HB3  H  1   1.180 0.001 . 1 . . . .   2 ALA HB   . 15622 1 
        6 . 1 1   3   3 TYR H    H  1   7.888 0.001 . 1 . . . .   3 TYR H    . 15622 1 
        7 . 1 1   3   3 TYR HB2  H  1   3.185 0.001 . 2 . . . .   3 TYR HB2  . 15622 1 
        8 . 1 1   3   3 TYR HD1  H  1   7.088 0.001 . 3 . . . .   3 TYR HD1  . 15622 1 
        9 . 1 1   3   3 TYR HE1  H  1   6.865 0.001 . 3 . . . .   3 TYR HE1  . 15622 1 
       10 . 1 1   6   6 GLY H    H  1   8.608 0.001 . 1 . . . .   6 GLY H    . 15622 1 
       11 . 1 1   6   6 GLY HA2  H  1   4.132 0.001 . 2 . . . .   6 GLY HA2  . 15622 1 
       12 . 1 1   6   6 GLY HA3  H  1   3.962 0.001 . 2 . . . .   6 GLY HA3  . 15622 1 
       13 . 1 1   7   7 TRP H    H  1   7.780 0.001 . 1 . . . .   7 TRP H    . 15622 1 
       14 . 1 1   7   7 TRP HA   H  1   4.348 0.001 . 1 . . . .   7 TRP HA   . 15622 1 
       15 . 1 1   7   7 TRP HB2  H  1   2.997 0.001 . 2 . . . .   7 TRP HB2  . 15622 1 
       16 . 1 1   7   7 TRP HD1  H  1   7.226 0.001 . 1 . . . .   7 TRP HD1  . 15622 1 
       17 . 1 1   7   7 TRP HE1  H  1  10.058 0.001 . 1 . . . .   7 TRP HE1  . 15622 1 
       18 . 1 1   7   7 TRP HE3  H  1   7.037 0.001 . 1 . . . .   7 TRP HE3  . 15622 1 
       19 . 1 1   7   7 TRP HH2  H  1   7.130 0.001 . 1 . . . .   7 TRP HH2  . 15622 1 
       20 . 1 1   7   7 TRP HZ2  H  1   7.427 0.001 . 1 . . . .   7 TRP HZ2  . 15622 1 
       21 . 1 1   7   7 TRP HZ3  H  1   6.845 0.001 . 1 . . . .   7 TRP HZ3  . 15622 1 
       22 . 1 1   7   7 TRP N    N 15 118.57  0.01  . 1 . . . .   7 TRP N    . 15622 1 
       23 . 1 1   7   7 TRP NE1  N 15 129.67  0.01  . 1 . . . .   7 TRP NE1  . 15622 1 
       24 . 1 1   8   8 GLU H    H  1   8.097 0.001 . 1 . . . .   8 GLU H    . 15622 1 
       25 . 1 1   8   8 GLU HA   H  1   3.651 0.001 . 1 . . . .   8 GLU HA   . 15622 1 
       26 . 1 1   8   8 GLU HB2  H  1   1.816 0.001 . 2 . . . .   8 GLU HB2  . 15622 1 
       27 . 1 1   8   8 GLU HB3  H  1   1.789 0.001 . 2 . . . .   8 GLU HB3  . 15622 1 
       28 . 1 1   8   8 GLU N    N 15 121.23  0.01  . 1 . . . .   8 GLU N    . 15622 1 
       29 . 1 1   9   9 ALA H    H  1   7.952 0.001 . 1 . . . .   9 ALA H    . 15622 1 
       30 . 1 1   9   9 ALA HA   H  1   4.194 0.001 . 1 . . . .   9 ALA HA   . 15622 1 
       31 . 1 1   9   9 ALA HB1  H  1   1.490 0.001 . 1 . . . .   9 ALA HB   . 15622 1 
       32 . 1 1   9   9 ALA HB2  H  1   1.490 0.001 . 1 . . . .   9 ALA HB   . 15622 1 
       33 . 1 1   9   9 ALA HB3  H  1   1.490 0.001 . 1 . . . .   9 ALA HB   . 15622 1 
       34 . 1 1   9   9 ALA N    N 15 121.97  0.01  . 1 . . . .   9 ALA N    . 15622 1 
       35 . 1 1  10  10 VAL H    H  1   7.768 0.001 . 1 . . . .  10 VAL H    . 15622 1 
       36 . 1 1  10  10 VAL HA   H  1   3.993 0.001 . 1 . . . .  10 VAL HA   . 15622 1 
       37 . 1 1  10  10 VAL HB   H  1   2.240 0.001 . 1 . . . .  10 VAL HB   . 15622 1 
       38 . 1 1  10  10 VAL HG11 H  1   1.150 0.001 . 2 . . . .  10 VAL HG1  . 15622 1 
       39 . 1 1  10  10 VAL HG12 H  1   1.150 0.001 . 2 . . . .  10 VAL HG1  . 15622 1 
       40 . 1 1  10  10 VAL HG13 H  1   1.150 0.001 . 2 . . . .  10 VAL HG1  . 15622 1 
       41 . 1 1  10  10 VAL HG21 H  1   1.125 0.001 . 2 . . . .  10 VAL HG2  . 15622 1 
       42 . 1 1  10  10 VAL HG22 H  1   1.125 0.001 . 2 . . . .  10 VAL HG2  . 15622 1 
       43 . 1 1  10  10 VAL HG23 H  1   1.125 0.001 . 2 . . . .  10 VAL HG2  . 15622 1 
       44 . 1 1  10  10 VAL N    N 15 119.65  0.01  . 1 . . . .  10 VAL N    . 15622 1 
       45 . 1 1  11  11 ALA H    H  1   8.575 0.001 . 1 . . . .  11 ALA H    . 15622 1 
       46 . 1 1  11  11 ALA HA   H  1   4.002 0.001 . 1 . . . .  11 ALA HA   . 15622 1 
       47 . 1 1  11  11 ALA HB1  H  1   1.447 0.001 . 1 . . . .  11 ALA HB   . 15622 1 
       48 . 1 1  11  11 ALA HB2  H  1   1.447 0.001 . 1 . . . .  11 ALA HB   . 15622 1 
       49 . 1 1  11  11 ALA HB3  H  1   1.447 0.001 . 1 . . . .  11 ALA HB   . 15622 1 
       50 . 1 1  11  11 ALA N    N 15 122.60  0.001 . 1 . . . .  11 ALA N    . 15622 1 
       51 . 1 1  12  12 ALA H    H  1   8.023 0.001 . 1 . . . .  12 ALA H    . 15622 1 
       52 . 1 1  12  12 ALA HA   H  1   4.102 0.001 . 1 . . . .  12 ALA HA   . 15622 1 
       53 . 1 1  12  12 ALA HB1  H  1   1.593 0.001 . 1 . . . .  12 ALA HB   . 15622 1 
       54 . 1 1  12  12 ALA HB2  H  1   1.593 0.001 . 1 . . . .  12 ALA HB   . 15622 1 
       55 . 1 1  12  12 ALA HB3  H  1   1.593 0.001 . 1 . . . .  12 ALA HB   . 15622 1 
       56 . 1 1  12  12 ALA N    N 15 119.30  0.01  . 1 . . . .  12 ALA N    . 15622 1 
       57 . 1 1  13  13 ALA H    H  1   7.770 0.001 . 1 . . . .  13 ALA H    . 15622 1 
       58 . 1 1  13  13 ALA HA   H  1   4.345 0.001 . 1 . . . .  13 ALA HA   . 15622 1 
       59 . 1 1  13  13 ALA HB1  H  1   1.713 0.001 . 1 . . . .  13 ALA HB   . 15622 1 
       60 . 1 1  13  13 ALA HB2  H  1   1.713 0.001 . 1 . . . .  13 ALA HB   . 15622 1 
       61 . 1 1  13  13 ALA HB3  H  1   1.713 0.001 . 1 . . . .  13 ALA HB   . 15622 1 
       62 . 1 1  13  13 ALA N    N 15 123.09  0.001 . 1 . . . .  13 ALA N    . 15622 1 
       63 . 1 1  14  14 VAL H    H  1   9.003 0.01  . 1 . . . .  14 VAL H    . 15622 1 
       64 . 1 1  14  14 VAL HA   H  1   4.047 0.001 . 1 . . . .  14 VAL HA   . 15622 1 
       65 . 1 1  14  14 VAL HB   H  1   2.548 0.001 . 1 . . . .  14 VAL HB   . 15622 1 
       66 . 1 1  14  14 VAL HG11 H  1   1.194 0.001 . 2 . . . .  14 VAL HG1  . 15622 1 
       67 . 1 1  14  14 VAL HG12 H  1   1.194 0.001 . 2 . . . .  14 VAL HG1  . 15622 1 
       68 . 1 1  14  14 VAL HG13 H  1   1.194 0.001 . 2 . . . .  14 VAL HG1  . 15622 1 
       69 . 1 1  14  14 VAL HG21 H  1   1.464 0.001 . 2 . . . .  14 VAL HG2  . 15622 1 
       70 . 1 1  14  14 VAL HG22 H  1   1.464 0.001 . 2 . . . .  14 VAL HG2  . 15622 1 
       71 . 1 1  14  14 VAL HG23 H  1   1.464 0.001 . 2 . . . .  14 VAL HG2  . 15622 1 
       72 . 1 1  14  14 VAL N    N 15 121.16  0.01  . 1 . . . .  14 VAL N    . 15622 1 
       73 . 1 1  15  15 ALA H    H  1   8.634 0.001 . 1 . . . .  15 ALA H    . 15622 1 
       74 . 1 1  15  15 ALA HA   H  1   4.088 0.001 . 1 . . . .  15 ALA HA   . 15622 1 
       75 . 1 1  15  15 ALA HB1  H  1   1.574 0.001 . 1 . . . .  15 ALA HB   . 15622 1 
       76 . 1 1  15  15 ALA HB2  H  1   1.574 0.001 . 1 . . . .  15 ALA HB   . 15622 1 
       77 . 1 1  15  15 ALA HB3  H  1   1.574 0.001 . 1 . . . .  15 ALA HB   . 15622 1 
       78 . 1 1  15  15 ALA N    N 15 120.97  0.01  . 1 . . . .  15 ALA N    . 15622 1 
       79 . 1 1  16  16 SER H    H  1   8.050 0.001 . 1 . . . .  16 SER H    . 15622 1 
       80 . 1 1  16  16 SER HA   H  1   4.262 0.001 . 1 . . . .  16 SER HA   . 15622 1 
       81 . 1 1  16  16 SER HB2  H  1   4.094 0.001 . 2 . . . .  16 SER HB2  . 15622 1 
       82 . 1 1  16  16 SER HB3  H  1   4.063 0.001 . 2 . . . .  16 SER HB3  . 15622 1 
       83 . 1 1  16  16 SER N    N 15 112.07  0.01  . 1 . . . .  16 SER N    . 15622 1 
       84 . 1 1  17  17 LYS H    H  1   7.824 0.001 . 1 . . . .  17 LYS H    . 15622 1 
       85 . 1 1  17  17 LYS HA   H  1   4.222 0.001 . 1 . . . .  17 LYS HA   . 15622 1 
       86 . 1 1  17  17 LYS HB2  H  1   2.179 0.001 . 2 . . . .  17 LYS HB2  . 15622 1 
       87 . 1 1  17  17 LYS HB3  H  1   1.698 0.001 . 2 . . . .  17 LYS HB3  . 15622 1 
       88 . 1 1  17  17 LYS HD2  H  1   1.346 0.001 . 2 . . . .  17 LYS HD2  . 15622 1 
       89 . 1 1  17  17 LYS HD3  H  1   2.318 0.001 . 2 . . . .  17 LYS HD3  . 15622 1 
       90 . 1 1  17  17 LYS HE2  H  1   1.900 0.001 . 2 . . . .  17 LYS HE2  . 15622 1 
       91 . 1 1  17  17 LYS HE3  H  1   0.978 0.001 . 2 . . . .  17 LYS HE3  . 15622 1 
       92 . 1 1  17  17 LYS HG2  H  1   0.026 0.001 . 2 . . . .  17 LYS HG2  . 15622 1 
       93 . 1 1  17  17 LYS HG3  H  1   1.200 0.001 . 2 . . . .  17 LYS HG3  . 15622 1 
       94 . 1 1  17  17 LYS N    N 15 124.51  0.01  . 1 . . . .  17 LYS N    . 15622 1 
       95 . 1 1  18  18 ILE H    H  1   8.439 0.001 . 1 . . . .  18 ILE H    . 15622 1 
       96 . 1 1  18  18 ILE HA   H  1   3.880 0.001 . 1 . . . .  18 ILE HA   . 15622 1 
       97 . 1 1  18  18 ILE HD11 H  1   1.195 0.001 . 1 . . . .  18 ILE HD1  . 15622 1 
       98 . 1 1  18  18 ILE HD12 H  1   1.195 0.001 . 1 . . . .  18 ILE HD1  . 15622 1 
       99 . 1 1  18  18 ILE HD13 H  1   1.195 0.001 . 1 . . . .  18 ILE HD1  . 15622 1 
      100 . 1 1  18  18 ILE HG21 H  1   0.850 0.001 . 1 . . . .  18 ILE HG2  . 15622 1 
      101 . 1 1  18  18 ILE HG22 H  1   0.850 0.001 . 1 . . . .  18 ILE HG2  . 15622 1 
      102 . 1 1  18  18 ILE HG23 H  1   0.850 0.001 . 1 . . . .  18 ILE HG2  . 15622 1 
      103 . 1 1  18  18 ILE N    N 15 119.08  0.01  . 1 . . . .  18 ILE N    . 15622 1 
      104 . 1 1  19  19 VAL H    H  1   7.902 0.001 . 1 . . . .  19 VAL H    . 15622 1 
      105 . 1 1  19  19 VAL HA   H  1   3.517 0.001 . 1 . . . .  19 VAL HA   . 15622 1 
      106 . 1 1  19  19 VAL HB   H  1   2.192 0.001 . 1 . . . .  19 VAL HB   . 15622 1 
      107 . 1 1  19  19 VAL HG11 H  1   1.087 0.001 . 2 . . . .  19 VAL HG1  . 15622 1 
      108 . 1 1  19  19 VAL HG12 H  1   1.087 0.001 . 2 . . . .  19 VAL HG1  . 15622 1 
      109 . 1 1  19  19 VAL HG13 H  1   1.087 0.001 . 2 . . . .  19 VAL HG1  . 15622 1 
      110 . 1 1  19  19 VAL HG21 H  1   0.942 0.001 . 2 . . . .  19 VAL HG2  . 15622 1 
      111 . 1 1  19  19 VAL HG22 H  1   0.942 0.001 . 2 . . . .  19 VAL HG2  . 15622 1 
      112 . 1 1  19  19 VAL HG23 H  1   0.942 0.001 . 2 . . . .  19 VAL HG2  . 15622 1 
      113 . 1 1  19  19 VAL N    N 15 119.15  0.01  . 1 . . . .  19 VAL N    . 15622 1 
      114 . 1 1  20  20 GLY H    H  1   8.171 0.001 . 1 . . . .  20 GLY H    . 15622 1 
      115 . 1 1  20  20 GLY HA2  H  1   4.064 0.001 . 2 . . . .  20 GLY HA2  . 15622 1 
      116 . 1 1  20  20 GLY HA3  H  1   4.177 0.001 . 2 . . . .  20 GLY HA3  . 15622 1 
      117 . 1 1  20  20 GLY N    N 15 109.01  0.01  . 1 . . . .  20 GLY N    . 15622 1 
      118 . 1 1  21  21 LEU H    H  1   7.563 0.001 . 1 . . . .  21 LEU H    . 15622 1 
      119 . 1 1  21  21 LEU HA   H  1   4.428 0.001 . 1 . . . .  21 LEU HA   . 15622 1 
      120 . 1 1  21  21 LEU HB2  H  1   2.064 0.001 . 2 . . . .  21 LEU HB2  . 15622 1 
      121 . 1 1  21  21 LEU HB3  H  1   1.813 0.001 . 2 . . . .  21 LEU HB3  . 15622 1 
      122 . 1 1  21  21 LEU HD11 H  1   1.109 0.001 . 2 . . . .  21 LEU HD1  . 15622 1 
      123 . 1 1  21  21 LEU HD12 H  1   1.109 0.001 . 2 . . . .  21 LEU HD1  . 15622 1 
      124 . 1 1  21  21 LEU HD13 H  1   1.109 0.001 . 2 . . . .  21 LEU HD1  . 15622 1 
      125 . 1 1  21  21 LEU HD21 H  1   0.927 0.001 . 2 . . . .  21 LEU HD2  . 15622 1 
      126 . 1 1  21  21 LEU HD22 H  1   0.927 0.001 . 2 . . . .  21 LEU HD2  . 15622 1 
      127 . 1 1  21  21 LEU HD23 H  1   0.927 0.001 . 2 . . . .  21 LEU HD2  . 15622 1 
      128 . 1 1  21  21 LEU HG   H  1   1.921 0.001 . 1 . . . .  21 LEU HG   . 15622 1 
      129 . 1 1  21  21 LEU N    N 15 120.46  0.01  . 1 . . . .  21 LEU N    . 15622 1 
      130 . 1 1  22  22 TRP H    H  1   7.351 0.001 . 1 . . . .  22 TRP H    . 15622 1 
      131 . 1 1  22  22 TRP HA   H  1   5.398 0.001 . 1 . . . .  22 TRP HA   . 15622 1 
      132 . 1 1  22  22 TRP HB2  H  1   3.730 0.001 . 2 . . . .  22 TRP HB2  . 15622 1 
      133 . 1 1  22  22 TRP HB3  H  1   2.688 0.001 . 2 . . . .  22 TRP HB3  . 15622 1 
      134 . 1 1  22  22 TRP HD1  H  1   7.051 0.001 . 1 . . . .  22 TRP HD1  . 15622 1 
      135 . 1 1  22  22 TRP HE1  H  1   9.672 0.001 . 1 . . . .  22 TRP HE1  . 15622 1 
      136 . 1 1  22  22 TRP HE3  H  1   7.490 0.001 . 1 . . . .  22 TRP HE3  . 15622 1 
      137 . 1 1  22  22 TRP HH2  H  1   7.175 0.001 . 1 . . . .  22 TRP HH2  . 15622 1 
      138 . 1 1  22  22 TRP HZ2  H  1   7.440 0.001 . 1 . . . .  22 TRP HZ2  . 15622 1 
      139 . 1 1  22  22 TRP HZ3  H  1   7.072 0.001 . 1 . . . .  22 TRP HZ3  . 15622 1 
      140 . 1 1  22  22 TRP N    N 15 122.25  0.01  . 1 . . . .  22 TRP N    . 15622 1 
      141 . 1 1  22  22 TRP NE1  N 15 127.52  0.01  . 1 . . . .  22 TRP NE1  . 15622 1 
      142 . 1 1  23  23 ARG H    H  1   9.002 0.001 . 1 . . . .  23 ARG H    . 15622 1 
      143 . 1 1  23  23 ARG HA   H  1   4.171 0.001 . 1 . . . .  23 ARG HA   . 15622 1 
      144 . 1 1  23  23 ARG HB2  H  1   1.790 0.001 . 2 . . . .  23 ARG HB2  . 15622 1 
      145 . 1 1  23  23 ARG HD2  H  1   3.256 0.001 . 2 . . . .  23 ARG HD2  . 15622 1 
      146 . 1 1  23  23 ARG HD3  H  1   3.171 0.001 . 2 . . . .  23 ARG HD3  . 15622 1 
      147 . 1 1  23  23 ARG HG2  H  1   1.593 0.001 . 2 . . . .  23 ARG HG2  . 15622 1 
      148 . 1 1  23  23 ARG N    N 15 129.78  0.01  . 1 . . . .  23 ARG N    . 15622 1 
      149 . 1 1  24  24 ASN H    H  1   9.116 0.001 . 1 . . . .  24 ASN H    . 15622 1 
      150 . 1 1  24  24 ASN HA   H  1   4.362 0.001 . 1 . . . .  24 ASN HA   . 15622 1 
      151 . 1 1  24  24 ASN HB2  H  1   2.841 0.001 . 2 . . . .  24 ASN HB2  . 15622 1 
      152 . 1 1  24  24 ASN HB3  H  1   3.038 0.001 . 2 . . . .  24 ASN HB3  . 15622 1 
      153 . 1 1  24  24 ASN HD21 H  1   7.671 0.001 . 2 . . . .  24 ASN HD21 . 15622 1 
      154 . 1 1  24  24 ASN HD22 H  1   6.911 0.001 . 2 . . . .  24 ASN HD22 . 15622 1 
      155 . 1 1  24  24 ASN ND2  N 15 113.32  0.01  . 1 . . . .  24 ASN ND2  . 15622 1 
      156 . 1 1  25  25 GLU H    H  1   8.673 0.001 . 1 . . . .  25 GLU H    . 15622 1 
      157 . 1 1  25  25 GLU HA   H  1   4.760 0.001 . 1 . . . .  25 GLU HA   . 15622 1 
      158 . 1 1  25  25 GLU HB2  H  1   2.461 0.001 . 2 . . . .  25 GLU HB2  . 15622 1 
      159 . 1 1  25  25 GLU HB3  H  1   2.337 0.001 . 2 . . . .  25 GLU HB3  . 15622 1 
      160 . 1 1  25  25 GLU HG2  H  1   2.339 0.001 . 2 . . . .  25 GLU HG2  . 15622 1 
      161 . 1 1  25  25 GLU N    N 15 109.99  0.01  . 1 . . . .  25 GLU N    . 15622 1 
      162 . 1 1  26  26 LYS H    H  1   8.257 0.001 . 1 . . . .  26 LYS H    . 15622 1 
      163 . 1 1  26  26 LYS HA   H  1   5.485 0.001 . 1 . . . .  26 LYS HA   . 15622 1 
      164 . 1 1  26  26 LYS HB2  H  1   1.963 0.001 . 2 . . . .  26 LYS HB2  . 15622 1 
      165 . 1 1  26  26 LYS HB3  H  1   2.014 0.001 . 2 . . . .  26 LYS HB3  . 15622 1 
      166 . 1 1  26  26 LYS HD2  H  1   1.691 0.001 . 2 . . . .  26 LYS HD2  . 15622 1 
      167 . 1 1  26  26 LYS HG2  H  1   1.560 0.001 . 2 . . . .  26 LYS HG2  . 15622 1 
      168 . 1 1  26  26 LYS HG3  H  1   1.624 0.001 . 2 . . . .  26 LYS HG3  . 15622 1 
      169 . 1 1  26  26 LYS N    N 15 119.09  0.01  . 1 . . . .  26 LYS N    . 15622 1 
      170 . 1 1  27  27 THR H    H  1   8.791 0.001 . 1 . . . .  27 THR H    . 15622 1 
      171 . 1 1  27  27 THR HA   H  1   4.835 0.001 . 1 . . . .  27 THR HA   . 15622 1 
      172 . 1 1  27  27 THR HB   H  1   4.081 0.001 . 1 . . . .  27 THR HB   . 15622 1 
      173 . 1 1  27  27 THR HG21 H  1   0.898 0.001 . 1 . . . .  27 THR HG   . 15622 1 
      174 . 1 1  27  27 THR HG22 H  1   0.898 0.001 . 1 . . . .  27 THR HG   . 15622 1 
      175 . 1 1  27  27 THR HG23 H  1   0.898 0.001 . 1 . . . .  27 THR HG   . 15622 1 
      176 . 1 1  27  27 THR N    N 15 115.27  0.01  . 1 . . . .  27 THR N    . 15622 1 
      177 . 1 1  28  28 GLU H    H  1   8.430 0.001 . 1 . . . .  28 GLU H    . 15622 1 
      178 . 1 1  28  28 GLU HA   H  1   5.271 0.001 . 1 . . . .  28 GLU HA   . 15622 1 
      179 . 1 1  28  28 GLU HB2  H  1   1.955 0.001 . 2 . . . .  28 GLU HB2  . 15622 1 
      180 . 1 1  28  28 GLU HB3  H  1   2.090 0.001 . 2 . . . .  28 GLU HB3  . 15622 1 
      181 . 1 1  28  28 GLU HG2  H  1   2.248 0.001 . 2 . . . .  28 GLU HG2  . 15622 1 
      182 . 1 1  28  28 GLU HG3  H  1   2.248 0.001 . 2 . . . .  28 GLU HG3  . 15622 1 
      183 . 1 1  28  28 GLU N    N 15 125.52  0.01  . 1 . . . .  28 GLU N    . 15622 1 
      184 . 1 1  29  29 LEU H    H  1   7.785 0.001 . 1 . . . .  29 LEU H    . 15622 1 
      185 . 1 1  29  29 LEU HA   H  1   3.984 0.001 . 1 . . . .  29 LEU HA   . 15622 1 
      186 . 1 1  29  29 LEU HB2  H  1   1.600 0.001 . 2 . . . .  29 LEU HB2  . 15622 1 
      187 . 1 1  29  29 LEU HB3  H  1   1.600 0.001 . 2 . . . .  29 LEU HB3  . 15622 1 
      188 . 1 1  29  29 LEU HD11 H  1   0.973 0.001 . 2 . . . .  29 LEU HD1  . 15622 1 
      189 . 1 1  29  29 LEU HD12 H  1   0.973 0.001 . 2 . . . .  29 LEU HD1  . 15622 1 
      190 . 1 1  29  29 LEU HD13 H  1   0.973 0.001 . 2 . . . .  29 LEU HD1  . 15622 1 
      191 . 1 1  29  29 LEU HD21 H  1   0.856 0.001 . 2 . . . .  29 LEU HD2  . 15622 1 
      192 . 1 1  29  29 LEU HD22 H  1   0.856 0.001 . 2 . . . .  29 LEU HD2  . 15622 1 
      193 . 1 1  29  29 LEU HD23 H  1   0.856 0.001 . 2 . . . .  29 LEU HD2  . 15622 1 
      194 . 1 1  29  29 LEU HG   H  1   1.150 0.001 . 1 . . . .  29 LEU HG   . 15622 1 
      195 . 1 1  29  29 LEU N    N 15 118.35  0.01  . 1 . . . .  29 LEU N    . 15622 1 
      196 . 1 1  30  30 LEU H    H  1   5.227 0.001 . 1 . . . .  30 LEU H    . 15622 1 
      197 . 1 1  30  30 LEU HA   H  1   3.173 0.001 . 1 . . . .  30 LEU HA   . 15622 1 
      198 . 1 1  30  30 LEU HB2  H  1   1.830 0.001 . 2 . . . .  30 LEU HB2  . 15622 1 
      199 . 1 1  30  30 LEU HD11 H  1   0.763 0.001 . 2 . . . .  30 LEU HD1  . 15622 1 
      200 . 1 1  30  30 LEU HD12 H  1   0.763 0.001 . 2 . . . .  30 LEU HD1  . 15622 1 
      201 . 1 1  30  30 LEU HD13 H  1   0.763 0.001 . 2 . . . .  30 LEU HD1  . 15622 1 
      202 . 1 1  30  30 LEU HD21 H  1   0.987 0.001 . 2 . . . .  30 LEU HD2  . 15622 1 
      203 . 1 1  30  30 LEU HD22 H  1   0.987 0.001 . 2 . . . .  30 LEU HD2  . 15622 1 
      204 . 1 1  30  30 LEU HD23 H  1   0.987 0.001 . 2 . . . .  30 LEU HD2  . 15622 1 
      205 . 1 1  30  30 LEU HG   H  1   1.210 0.001 . 1 . . . .  30 LEU HG   . 15622 1 
      206 . 1 1  31  31 GLY H    H  1   8.762 0.001 . 1 . . . .  31 GLY H    . 15622 1 
      207 . 1 1  31  31 GLY HA2  H  1   3.484 0.001 . 2 . . . .  31 GLY HA2  . 15622 1 
      208 . 1 1  31  31 GLY HA3  H  1   3.799 0.001 . 2 . . . .  31 GLY HA3  . 15622 1 
      209 . 1 1  31  31 GLY N    N 15 104.31  0.01  . 1 . . . .  31 GLY N    . 15622 1 
      210 . 1 1  32  32 HIS H    H  1   7.500 0.001 . 1 . . . .  32 HIS H    . 15622 1 
      211 . 1 1  32  32 HIS HA   H  1   4.340 0.001 . 1 . . . .  32 HIS HA   . 15622 1 
      212 . 1 1  32  32 HIS HB2  H  1   2.794 0.001 . 2 . . . .  32 HIS HB2  . 15622 1 
      213 . 1 1  32  32 HIS HB3  H  1   2.697 0.001 . 2 . . . .  32 HIS HB3  . 15622 1 
      214 . 1 1  32  32 HIS HD2  H  1   5.770 0.001 . 1 . . . .  32 HIS HD2  . 15622 1 
      215 . 1 1  32  32 HIS HE1  H  1   7.910 0.001 . 1 . . . .  32 HIS HE1  . 15622 1 
      216 . 1 1  32  32 HIS N    N 15 119.19  0.01  . 1 . . . .  32 HIS N    . 15622 1 
      217 . 1 1  33  33 GLU H    H  1   8.750 0.001 . 1 . . . .  33 GLU H    . 15622 1 
      218 . 1 1  33  33 GLU HA   H  1   4.479 0.001 . 1 . . . .  33 GLU HA   . 15622 1 
      219 . 1 1  33  33 GLU HB2  H  1   2.078 0.001 . 2 . . . .  33 GLU HB2  . 15622 1 
      220 . 1 1  33  33 GLU HG2  H  1   2.356 0.001 . 2 . . . .  33 GLU HG2  . 15622 1 
      221 . 1 1  33  33 GLU N    N 15 123.03  0.01  . 1 . . . .  33 GLU N    . 15622 1 
      222 . 1 1  34  34 CYS H    H  1   8.530 0.001 . 1 . . . .  34 CYS H    . 15622 1 
      223 . 1 1  34  34 CYS HA   H  1   5.144 0.001 . 1 . . . .  34 CYS HA   . 15622 1 
      224 . 1 1  34  34 CYS HB2  H  1   2.630 0.001 . 2 . . . .  34 CYS HB2  . 15622 1 
      225 . 1 1  34  34 CYS N    N 15 126.34  0.01  . 1 . . . .  34 CYS N    . 15622 1 
      226 . 1 1  35  35 LYS H    H  1   8.804 0.001 . 1 . . . .  35 LYS H    . 15622 1 
      227 . 1 1  35  35 LYS HA   H  1   4.540 0.001 . 1 . . . .  35 LYS HA   . 15622 1 
      228 . 1 1  35  35 LYS HB2  H  1  -0.379 0.001 . 2 . . . .  35 LYS HB2  . 15622 1 
      229 . 1 1  35  35 LYS HB3  H  1   0.643 0.001 . 2 . . . .  35 LYS HB3  . 15622 1 
      230 . 1 1  35  35 LYS HD2  H  1   1.577 0.001 . 2 . . . .  35 LYS HD2  . 15622 1 
      231 . 1 1  35  35 LYS HG2  H  1   1.056 0.001 . 2 . . . .  35 LYS HG2  . 15622 1 
      232 . 1 1  35  35 LYS N    N 15 123.36  0.01  . 1 . . . .  35 LYS N    . 15622 1 
      233 . 1 1  36  36 PHE H    H  1   7.735 0.001 . 1 . . . .  36 PHE H    . 15622 1 
      234 . 1 1  36  36 PHE HA   H  1   5.535 0.001 . 1 . . . .  36 PHE HA   . 15622 1 
      235 . 1 1  36  36 PHE HB2  H  1   2.802 0.001 . 2 . . . .  36 PHE HB2  . 15622 1 
      236 . 1 1  36  36 PHE HB3  H  1   2.243 0.001 . 2 . . . .  36 PHE HB3  . 15622 1 
      237 . 1 1  36  36 PHE HD1  H  1   6.285 0.001 . 3 . . . .  36 PHE HD1  . 15622 1 
      238 . 1 1  36  36 PHE HD2  H  1   6.285 0.001 . 3 . . . .  36 PHE HD2  . 15622 1 
      239 . 1 1  36  36 PHE HE1  H  1   7.257 0.001 . 3 . . . .  36 PHE HE1  . 15622 1 
      240 . 1 1  36  36 PHE HE2  H  1   7.257 0.001 . 3 . . . .  36 PHE HE2  . 15622 1 
      241 . 1 1  36  36 PHE HZ   H  1   7.389 0.001 . 1 . . . .  36 PHE HZ   . 15622 1 
      242 . 1 1  36  36 PHE N    N 15 124.21  0.01  . 1 . . . .  36 PHE N    . 15622 1 
      243 . 1 1  37  37 THR H    H  1   9.268 0.001 . 1 . . . .  37 THR H    . 15622 1 
      244 . 1 1  37  37 THR HA   H  1   5.358 0.001 . 1 . . . .  37 THR HA   . 15622 1 
      245 . 1 1  37  37 THR HB   H  1   4.438 0.001 . 1 . . . .  37 THR HB   . 15622 1 
      246 . 1 1  37  37 THR HG21 H  1   1.465 0.001 . 1 . . . .  37 THR HG   . 15622 1 
      247 . 1 1  37  37 THR HG22 H  1   1.465 0.001 . 1 . . . .  37 THR HG   . 15622 1 
      248 . 1 1  37  37 THR HG23 H  1   1.465 0.001 . 1 . . . .  37 THR HG   . 15622 1 
      249 . 1 1  37  37 THR N    N 15 117.57  0.01  . 1 . . . .  37 THR N    . 15622 1 
      250 . 1 1  38  38 VAL H    H  1   8.880 0.001 . 1 . . . .  38 VAL H    . 15622 1 
      251 . 1 1  38  38 VAL HA   H  1   5.137 0.001 . 1 . . . .  38 VAL HA   . 15622 1 
      252 . 1 1  38  38 VAL HB   H  1   2.314 0.001 . 1 . . . .  38 VAL HB   . 15622 1 
      253 . 1 1  38  38 VAL HG11 H  1   0.957 0.001 . 2 . . . .  38 VAL HG1  . 15622 1 
      254 . 1 1  38  38 VAL HG12 H  1   0.957 0.001 . 2 . . . .  38 VAL HG1  . 15622 1 
      255 . 1 1  38  38 VAL HG13 H  1   0.957 0.001 . 2 . . . .  38 VAL HG1  . 15622 1 
      256 . 1 1  38  38 VAL HG21 H  1   1.087 0.001 . 2 . . . .  38 VAL HG2  . 15622 1 
      257 . 1 1  38  38 VAL HG22 H  1   1.087 0.001 . 2 . . . .  38 VAL HG2  . 15622 1 
      258 . 1 1  38  38 VAL HG23 H  1   1.087 0.001 . 2 . . . .  38 VAL HG2  . 15622 1 
      259 . 1 1  38  38 VAL N    N 15 121.60  0.01  . 1 . . . .  38 VAL N    . 15622 1 
      260 . 1 1  39  39 LYS H    H  1   8.916 0.001 . 1 . . . .  39 LYS H    . 15622 1 
      261 . 1 1  39  39 LYS HA   H  1   5.372 0.001 . 1 . . . .  39 LYS HA   . 15622 1 
      262 . 1 1  39  39 LYS HB2  H  1   2.050 0.001 . 2 . . . .  39 LYS HB2  . 15622 1 
      263 . 1 1  39  39 LYS HB3  H  1   1.879 0.001 . 2 . . . .  39 LYS HB3  . 15622 1 
      264 . 1 1  39  39 LYS HG2  H  1   1.660 0.001 . 2 . . . .  39 LYS HG2  . 15622 1 
      265 . 1 1  39  39 LYS HG3  H  1   1.660 0.001 . 2 . . . .  39 LYS HG3  . 15622 1 
      266 . 1 1  39  39 LYS N    N 15 126.84  0.01  . 1 . . . .  39 LYS N    . 15622 1 
      267 . 1 1  40  40 PRO HA   H  1   5.196 0.001 . 1 . . . .  40 PRO HA   . 15622 1 
      268 . 1 1  40  40 PRO HB2  H  1   1.940 0.001 . 2 . . . .  40 PRO HB2  . 15622 1 
      269 . 1 1  40  40 PRO HB3  H  1   2.062 0.001 . 2 . . . .  40 PRO HB3  . 15622 1 
      270 . 1 1  40  40 PRO HD2  H  1   4.074 0.001 . 2 . . . .  40 PRO HD2  . 15622 1 
      271 . 1 1  40  40 PRO HD3  H  1   3.952 0.001 . 2 . . . .  40 PRO HD3  . 15622 1 
      272 . 1 1  40  40 PRO HG2  H  1   2.208 0.001 . 2 . . . .  40 PRO HG2  . 15622 1 
      273 . 1 1  41  41 TYR H    H  1   9.193 0.001 . 1 . . . .  41 TYR H    . 15622 1 
      274 . 1 1  41  41 TYR HA   H  1   4.704 0.001 . 1 . . . .  41 TYR HA   . 15622 1 
      275 . 1 1  41  41 TYR HB2  H  1   3.010 0.001 . 2 . . . .  41 TYR HB2  . 15622 1 
      276 . 1 1  41  41 TYR HB3  H  1   2.790 0.001 . 2 . . . .  41 TYR HB3  . 15622 1 
      277 . 1 1  41  41 TYR HD1  H  1   6.920 0.001 . 3 . . . .  41 TYR HD1  . 15622 1 
      278 . 1 1  41  41 TYR HD2  H  1   6.920 0.001 . 3 . . . .  41 TYR HD2  . 15622 1 
      279 . 1 1  41  41 TYR HE1  H  1   6.472 0.001 . 3 . . . .  41 TYR HE1  . 15622 1 
      280 . 1 1  41  41 TYR HE2  H  1   6.472 0.001 . 3 . . . .  41 TYR HE2  . 15622 1 
      281 . 1 1  41  41 TYR N    N 15 119.64  0.01  . 1 . . . .  41 TYR N    . 15622 1 
      282 . 1 1  42  42 LEU H    H  1   8.293 0.001 . 1 . . . .  42 LEU H    . 15622 1 
      283 . 1 1  42  42 LEU HA   H  1   4.940 0.001 . 1 . . . .  42 LEU HA   . 15622 1 
      284 . 1 1  42  42 LEU HB2  H  1   1.584 0.001 . 2 . . . .  42 LEU HB2  . 15622 1 
      285 . 1 1  42  42 LEU HB3  H  1   1.357 0.001 . 2 . . . .  42 LEU HB3  . 15622 1 
      286 . 1 1  42  42 LEU HD11 H  1   0.722 0.001 . 2 . . . .  42 LEU HD1  . 15622 1 
      287 . 1 1  42  42 LEU HD12 H  1   0.722 0.001 . 2 . . . .  42 LEU HD1  . 15622 1 
      288 . 1 1  42  42 LEU HD13 H  1   0.722 0.001 . 2 . . . .  42 LEU HD1  . 15622 1 
      289 . 1 1  42  42 LEU HD21 H  1   0.825 0.001 . 2 . . . .  42 LEU HD2  . 15622 1 
      290 . 1 1  42  42 LEU HD22 H  1   0.825 0.001 . 2 . . . .  42 LEU HD2  . 15622 1 
      291 . 1 1  42  42 LEU HD23 H  1   0.825 0.001 . 2 . . . .  42 LEU HD2  . 15622 1 
      292 . 1 1  42  42 LEU HG   H  1   1.478 0.001 . 1 . . . .  42 LEU HG   . 15622 1 
      293 . 1 1  42  42 LEU N    N 15 120.76  0.01  . 1 . . . .  42 LEU N    . 15622 1 
      294 . 1 1  43  43 LYS H    H  1   8.862 0.001 . 1 . . . .  43 LYS H    . 15622 1 
      295 . 1 1  43  43 LYS HA   H  1   4.360 0.001 . 1 . . . .  43 LYS HA   . 15622 1 
      296 . 1 1  43  43 LYS HB2  H  1   1.343 0.001 . 2 . . . .  43 LYS HB2  . 15622 1 
      297 . 1 1  43  43 LYS HB3  H  1   1.608 0.001 . 2 . . . .  43 LYS HB3  . 15622 1 
      298 . 1 1  43  43 LYS HG2  H  1   1.231 0.001 . 2 . . . .  43 LYS HG2  . 15622 1 
      299 . 1 1  43  43 LYS N    N 15 125.07  0.01  . 1 . . . .  43 LYS N    . 15622 1 
      300 . 1 1  44  44 ARG H    H  1   9.116 0.001 . 1 . . . .  44 ARG H    . 15622 1 
      301 . 1 1  44  44 ARG HA   H  1   3.495 0.001 . 1 . . . .  44 ARG HA   . 15622 1 
      302 . 1 1  44  44 ARG HB2  H  1   1.890 0.001 . 2 . . . .  44 ARG HB2  . 15622 1 
      303 . 1 1  44  44 ARG HB3  H  1   1.980 0.001 . 2 . . . .  44 ARG HB3  . 15622 1 
      304 . 1 1  44  44 ARG HD2  H  1   3.197 0.001 . 2 . . . .  44 ARG HD2  . 15622 1 
      305 . 1 1  44  44 ARG HG2  H  1   1.533 0.001 . 2 . . . .  44 ARG HG2  . 15622 1 
      306 . 1 1  45  45 PHE H    H  1   8.268 0.001 . 1 . . . .  45 PHE H    . 15622 1 
      307 . 1 1  45  45 PHE HA   H  1   4.220 0.001 . 1 . . . .  45 PHE HA   . 15622 1 
      308 . 1 1  45  45 PHE HB2  H  1   3.313 0.001 . 2 . . . .  45 PHE HB2  . 15622 1 
      309 . 1 1  45  45 PHE HB3  H  1   3.490 0.001 . 2 . . . .  45 PHE HB3  . 15622 1 
      310 . 1 1  45  45 PHE HD1  H  1   7.228 0.001 . 3 . . . .  45 PHE HD1  . 15622 1 
      311 . 1 1  45  45 PHE HD2  H  1   7.228 0.001 . 3 . . . .  45 PHE HD2  . 15622 1 
      312 . 1 1  45  45 PHE HE1  H  1   7.380 0.001 . 3 . . . .  45 PHE HE1  . 15622 1 
      313 . 1 1  45  45 PHE HE2  H  1   7.380 0.001 . 3 . . . .  45 PHE HE2  . 15622 1 
      314 . 1 1  45  45 PHE HZ   H  1   7.340 0.001 . 1 . . . .  45 PHE HZ   . 15622 1 
      315 . 1 1  46  46 GLN H    H  1   7.960 0.001 . 1 . . . .  46 GLN H    . 15622 1 
      316 . 1 1  46  46 GLN HA   H  1   4.687 0.001 . 1 . . . .  46 GLN HA   . 15622 1 
      317 . 1 1  46  46 GLN HB2  H  1   2.205 0.001 . 2 . . . .  46 GLN HB2  . 15622 1 
      318 . 1 1  46  46 GLN HB3  H  1   2.080 0.001 . 2 . . . .  46 GLN HB3  . 15622 1 
      319 . 1 1  46  46 GLN HG2  H  1   2.414 0.001 . 2 . . . .  46 GLN HG2  . 15622 1 
      320 . 1 1  46  46 GLN N    N 15 120.20  0.01  . 1 . . . .  46 GLN N    . 15622 1 
      321 . 1 1  47  47 VAL H    H  1   8.390 0.001 . 1 . . . .  47 VAL H    . 15622 1 
      322 . 1 1  47  47 VAL HA   H  1   4.181 0.001 . 1 . . . .  47 VAL HA   . 15622 1 
      323 . 1 1  47  47 VAL HB   H  1   1.844 0.001 . 1 . . . .  47 VAL HB   . 15622 1 
      324 . 1 1  47  47 VAL HG11 H  1   0.603 0.001 . 2 . . . .  47 VAL HG1  . 15622 1 
      325 . 1 1  47  47 VAL HG12 H  1   0.603 0.001 . 2 . . . .  47 VAL HG1  . 15622 1 
      326 . 1 1  47  47 VAL HG13 H  1   0.603 0.001 . 2 . . . .  47 VAL HG1  . 15622 1 
      327 . 1 1  47  47 VAL HG21 H  1   0.902 0.001 . 2 . . . .  47 VAL HG2  . 15622 1 
      328 . 1 1  47  47 VAL HG22 H  1   0.902 0.001 . 2 . . . .  47 VAL HG2  . 15622 1 
      329 . 1 1  47  47 VAL HG23 H  1   0.902 0.001 . 2 . . . .  47 VAL HG2  . 15622 1 
      330 . 1 1  47  47 VAL N    N 15 124.23  0.01  . 1 . . . .  47 VAL N    . 15622 1 
      331 . 1 1  48  48 TYR H    H  1   8.758 0.001 . 1 . . . .  48 TYR H    . 15622 1 
      332 . 1 1  48  48 TYR HA   H  1   4.479 0.001 . 1 . . . .  48 TYR HA   . 15622 1 
      333 . 1 1  48  48 TYR HB2  H  1   2.467 0.001 . 2 . . . .  48 TYR HB2  . 15622 1 
      334 . 1 1  48  48 TYR HB3  H  1   1.767 0.001 . 2 . . . .  48 TYR HB3  . 15622 1 
      335 . 1 1  48  48 TYR HD1  H  1   6.826 0.001 . 3 . . . .  48 TYR HD1  . 15622 1 
      336 . 1 1  48  48 TYR HD2  H  1   6.826 0.001 . 3 . . . .  48 TYR HD2  . 15622 1 
      337 . 1 1  48  48 TYR HE1  H  1   6.742 0.001 . 3 . . . .  48 TYR HE1  . 15622 1 
      338 . 1 1  48  48 TYR HE2  H  1   6.742 0.001 . 3 . . . .  48 TYR HE2  . 15622 1 
      339 . 1 1  48  48 TYR N    N 15 128.70  0.01  . 1 . . . .  48 TYR N    . 15622 1 
      340 . 1 1  49  49 TYR H    H  1   8.833 0.001 . 1 . . . .  49 TYR H    . 15622 1 
      341 . 1 1  49  49 TYR HA   H  1   4.966 0.001 . 1 . . . .  49 TYR HA   . 15622 1 
      342 . 1 1  49  49 TYR HB2  H  1   2.674 0.001 . 2 . . . .  49 TYR HB2  . 15622 1 
      343 . 1 1  49  49 TYR HB3  H  1   2.735 0.001 . 2 . . . .  49 TYR HB3  . 15622 1 
      344 . 1 1  49  49 TYR HD1  H  1   6.771 0.001 . 3 . . . .  49 TYR HD1  . 15622 1 
      345 . 1 1  49  49 TYR HD2  H  1   6.771 0.001 . 3 . . . .  49 TYR HD2  . 15622 1 
      346 . 1 1  49  49 TYR HE1  H  1   6.771 0.001 . 3 . . . .  49 TYR HE1  . 15622 1 
      347 . 1 1  49  49 TYR HE2  H  1   6.771 0.001 . 3 . . . .  49 TYR HE2  . 15622 1 
      348 . 1 1  49  49 TYR N    N 15 115.27  0.01  . 1 . . . .  49 TYR N    . 15622 1 
      349 . 1 1  50  50 LYS H    H  1   9.180 0.001 . 1 . . . .  50 LYS H    . 15622 1 
      350 . 1 1  50  50 LYS HA   H  1   5.481 0.001 . 1 . . . .  50 LYS HA   . 15622 1 
      351 . 1 1  50  50 LYS HB2  H  1   1.967 0.001 . 2 . . . .  50 LYS HB2  . 15622 1 
      352 . 1 1  50  50 LYS HB3  H  1   1.777 0.001 . 2 . . . .  50 LYS HB3  . 15622 1 
      353 . 1 1  50  50 LYS HD2  H  1   1.421 0.001 . 2 . . . .  50 LYS HD2  . 15622 1 
      354 . 1 1  50  50 LYS HD3  H  1   1.421 0.001 . 2 . . . .  50 LYS HD3  . 15622 1 
      355 . 1 1  50  50 LYS HG2  H  1   1.337 0.001 . 2 . . . .  50 LYS HG2  . 15622 1 
      356 . 1 1  50  50 LYS HG3  H  1   1.337 0.001 . 2 . . . .  50 LYS HG3  . 15622 1 
      357 . 1 1  50  50 LYS N    N 15 122.17  0.01  . 1 . . . .  50 LYS N    . 15622 1 
      358 . 1 1  51  51 GLY H    H  1   9.472 0.001 . 1 . . . .  51 GLY H    . 15622 1 
      359 . 1 1  51  51 GLY HA2  H  1   3.938 0.001 . 2 . . . .  51 GLY HA2  . 15622 1 
      360 . 1 1  51  51 GLY HA3  H  1   5.549 0.001 . 2 . . . .  51 GLY HA3  . 15622 1 
      361 . 1 1  51  51 GLY N    N 15 117.98  0.001 . 1 . . . .  51 GLY N    . 15622 1 
      362 . 1 1  52  52 ARG H    H  1   8.857 0.001 . 1 . . . .  52 ARG H    . 15622 1 
      363 . 1 1  52  52 ARG HA   H  1   5.265 0.001 . 1 . . . .  52 ARG HA   . 15622 1 
      364 . 1 1  52  52 ARG HB2  H  1   1.928 0.001 . 2 . . . .  52 ARG HB2  . 15622 1 
      365 . 1 1  52  52 ARG HB3  H  1   1.783 0.001 . 2 . . . .  52 ARG HB3  . 15622 1 
      366 . 1 1  52  52 ARG HD2  H  1   2.981 0.001 . 2 . . . .  52 ARG HD2  . 15622 1 
      367 . 1 1  52  52 ARG HD3  H  1   2.889 0.001 . 2 . . . .  52 ARG HD3  . 15622 1 
      368 . 1 1  52  52 ARG HG2  H  1   1.593 0.001 . 2 . . . .  52 ARG HG2  . 15622 1 
      369 . 1 1  52  52 ARG HG3  H  1   1.603 0.001 . 2 . . . .  52 ARG HG3  . 15622 1 
      370 . 1 1  52  52 ARG N    N 15 123.15  0.01  . 1 . . . .  52 ARG N    . 15622 1 
      371 . 1 1  53  53 MET H    H  1   8.853 0.001 . 1 . . . .  53 MET H    . 15622 1 
      372 . 1 1  53  53 MET HA   H  1   5.593 0.001 . 1 . . . .  53 MET HA   . 15622 1 
      373 . 1 1  53  53 MET HB2  H  1   2.355 0.001 . 2 . . . .  53 MET HB2  . 15622 1 
      374 . 1 1  53  53 MET HB3  H  1   1.567 0.001 . 2 . . . .  53 MET HB3  . 15622 1 
      375 . 1 1  53  53 MET HG2  H  1   1.362 0.001 . 2 . . . .  53 MET HG2  . 15622 1 
      376 . 1 1  53  53 MET HG3  H  1   1.275 0.001 . 2 . . . .  53 MET HG3  . 15622 1 
      377 . 1 1  53  53 MET N    N 15 121.71  0.01  . 1 . . . .  53 MET N    . 15622 1 
      378 . 1 1  54  54 TRP H    H  1   9.073 0.001 . 1 . . . .  54 TRP H    . 15622 1 
      379 . 1 1  54  54 TRP HA   H  1   5.177 0.001 . 1 . . . .  54 TRP HA   . 15622 1 
      380 . 1 1  54  54 TRP HB2  H  1   3.618 0.001 . 2 . . . .  54 TRP HB2  . 15622 1 
      381 . 1 1  54  54 TRP HB3  H  1   3.452 0.001 . 2 . . . .  54 TRP HB3  . 15622 1 
      382 . 1 1  54  54 TRP HD1  H  1   7.254 0.001 . 1 . . . .  54 TRP HD1  . 15622 1 
      383 . 1 1  54  54 TRP HE1  H  1  10.473 0.001 . 1 . . . .  54 TRP HE1  . 15622 1 
      384 . 1 1  54  54 TRP HE3  H  1   7.220 0.001 . 1 . . . .  54 TRP HE3  . 15622 1 
      385 . 1 1  54  54 TRP HH2  H  1   7.242 0.001 . 1 . . . .  54 TRP HH2  . 15622 1 
      386 . 1 1  54  54 TRP HZ2  H  1   7.522 0.001 . 1 . . . .  54 TRP HZ2  . 15622 1 
      387 . 1 1  54  54 TRP HZ3  H  1   7.095 0.001 . 1 . . . .  54 TRP HZ3  . 15622 1 
      388 . 1 1  54  54 TRP N    N 15 128.28  0.01  . 1 . . . .  54 TRP N    . 15622 1 
      389 . 1 1  54  54 TRP NE1  N 15 129.30  0.01  . 1 . . . .  54 TRP NE1  . 15622 1 
      390 . 1 1  55  55 CYS H    H  1  10.480 0.001 . 1 . . . .  55 CYS H    . 15622 1 
      391 . 1 1  55  55 CYS HA   H  1   5.234 0.001 . 1 . . . .  55 CYS HA   . 15622 1 
      392 . 1 1  55  55 CYS HB2  H  1   3.440 0.001 . 2 . . . .  55 CYS HB2  . 15622 1 
      393 . 1 1  55  55 CYS N    N 15 122.09  0.01  . 1 . . . .  55 CYS N    . 15622 1 
      394 . 1 1  56  56 PRO HA   H  1   4.623 0.001 . 1 . . . .  56 PRO HA   . 15622 1 
      395 . 1 1  56  56 PRO HB2  H  1   2.573 0.001 . 2 . . . .  56 PRO HB2  . 15622 1 
      396 . 1 1  56  56 PRO HB3  H  1   2.170 0.001 . 2 . . . .  56 PRO HB3  . 15622 1 
      397 . 1 1  56  56 PRO HD2  H  1   3.851 0.001 . 2 . . . .  56 PRO HD2  . 15622 1 
      398 . 1 1  56  56 PRO HD3  H  1   3.659 0.001 . 2 . . . .  56 PRO HD3  . 15622 1 
      399 . 1 1  56  56 PRO HG2  H  1   2.233 0.001 . 2 . . . .  56 PRO HG2  . 15622 1 
      400 . 1 1  56  56 PRO HG3  H  1   2.149 0.001 . 2 . . . .  56 PRO HG3  . 15622 1 
      401 . 1 1  57  57 GLY H    H  1   9.054 0.001 . 1 . . . .  57 GLY H    . 15622 1 
      402 . 1 1  57  57 GLY HA2  H  1   4.512 0.001 . 2 . . . .  57 GLY HA2  . 15622 1 
      403 . 1 1  57  57 GLY HA3  H  1   3.829 0.001 . 2 . . . .  57 GLY HA3  . 15622 1 
      404 . 1 1  58  58 TRP H    H  1   7.940 0.001 . 1 . . . .  58 TRP H    . 15622 1 
      405 . 1 1  58  58 TRP HA   H  1   5.147 0.001 . 1 . . . .  58 TRP HA   . 15622 1 
      406 . 1 1  58  58 TRP HB2  H  1   2.820 0.001 . 2 . . . .  58 TRP HB2  . 15622 1 
      407 . 1 1  58  58 TRP HB3  H  1   3.185 0.001 . 2 . . . .  58 TRP HB3  . 15622 1 
      408 . 1 1  58  58 TRP HD1  H  1   7.180 0.001 . 1 . . . .  58 TRP HD1  . 15622 1 
      409 . 1 1  58  58 TRP HE1  H  1  10.199 0.001 . 1 . . . .  58 TRP HE1  . 15622 1 
      410 . 1 1  58  58 TRP HE3  H  1   7.111 0.001 . 1 . . . .  58 TRP HE3  . 15622 1 
      411 . 1 1  58  58 TRP HH2  H  1   6.616 0.001 . 1 . . . .  58 TRP HH2  . 15622 1 
      412 . 1 1  58  58 TRP HZ2  H  1   7.221 0.001 . 1 . . . .  58 TRP HZ2  . 15622 1 
      413 . 1 1  58  58 TRP HZ3  H  1   6.783 0.001 . 1 . . . .  58 TRP HZ3  . 15622 1 
      414 . 1 1  58  58 TRP N    N 15 120.96  0.01  . 1 . . . .  58 TRP N    . 15622 1 
      415 . 1 1  58  58 TRP NE1  N 15 130.02  0.01  . 1 . . . .  58 TRP NE1  . 15622 1 
      416 . 1 1  59  59 THR H    H  1   7.412 0.001 . 1 . . . .  59 THR H    . 15622 1 
      417 . 1 1  59  59 THR HA   H  1   4.540 0.001 . 1 . . . .  59 THR HA   . 15622 1 
      418 . 1 1  59  59 THR HB   H  1   3.361 0.001 . 1 . . . .  59 THR HB   . 15622 1 
      419 . 1 1  59  59 THR HG21 H  1   0.693 0.001 . 1 . . . .  59 THR HG   . 15622 1 
      420 . 1 1  59  59 THR HG22 H  1   0.693 0.001 . 1 . . . .  59 THR HG   . 15622 1 
      421 . 1 1  59  59 THR HG23 H  1   0.693 0.001 . 1 . . . .  59 THR HG   . 15622 1 
      422 . 1 1  59  59 THR N    N 15 109.19  0.01  . 1 . . . .  59 THR N    . 15622 1 
      423 . 1 1  60  60 ALA H    H  1   8.524 0.001 . 1 . . . .  60 ALA H    . 15622 1 
      424 . 1 1  60  60 ALA HA   H  1   4.522 0.001 . 1 . . . .  60 ALA HA   . 15622 1 
      425 . 1 1  60  60 ALA HB1  H  1   1.440 0.001 . 1 . . . .  60 ALA HB   . 15622 1 
      426 . 1 1  60  60 ALA HB2  H  1   1.440 0.001 . 1 . . . .  60 ALA HB   . 15622 1 
      427 . 1 1  60  60 ALA HB3  H  1   1.440 0.001 . 1 . . . .  60 ALA HB   . 15622 1 
      428 . 1 1  61  61 ILE H    H  1   7.858 0.001 . 1 . . . .  61 ILE H    . 15622 1 
      429 . 1 1  61  61 ILE HA   H  1   3.644 0.001 . 1 . . . .  61 ILE HA   . 15622 1 
      430 . 1 1  61  61 ILE HB   H  1   1.197 0.001 . 1 . . . .  61 ILE HB   . 15622 1 
      431 . 1 1  61  61 ILE HD11 H  1   0.795 0.001 . 1 . . . .  61 ILE HD1  . 15622 1 
      432 . 1 1  61  61 ILE HD12 H  1   0.795 0.001 . 1 . . . .  61 ILE HD1  . 15622 1 
      433 . 1 1  61  61 ILE HD13 H  1   0.795 0.001 . 1 . . . .  61 ILE HD1  . 15622 1 
      434 . 1 1  61  61 ILE HG12 H  1   1.279 0.001 . 2 . . . .  61 ILE HG12 . 15622 1 
      435 . 1 1  61  61 ILE HG13 H  1   1.279 0.001 . 2 . . . .  61 ILE HG13 . 15622 1 
      436 . 1 1  61  61 ILE HG21 H  1   0.253 0.001 . 1 . . . .  61 ILE HG2  . 15622 1 
      437 . 1 1  61  61 ILE HG22 H  1   0.253 0.001 . 1 . . . .  61 ILE HG2  . 15622 1 
      438 . 1 1  61  61 ILE HG23 H  1   0.253 0.001 . 1 . . . .  61 ILE HG2  . 15622 1 
      439 . 1 1  61  61 ILE N    N 15 121.87  0.01  . 1 . . . .  61 ILE N    . 15622 1 
      440 . 1 1  62  62 ARG H    H  1   8.208 0.001 . 1 . . . .  62 ARG H    . 15622 1 
      441 . 1 1  62  62 ARG HA   H  1   5.460 0.001 . 1 . . . .  62 ARG HA   . 15622 1 
      442 . 1 1  62  62 ARG HB2  H  1   1.893 0.001 . 2 . . . .  62 ARG HB2  . 15622 1 
      443 . 1 1  62  62 ARG HB3  H  1   1.751 0.001 . 2 . . . .  62 ARG HB3  . 15622 1 
      444 . 1 1  62  62 ARG HG2  H  1   1.748 0.001 . 2 . . . .  62 ARG HG2  . 15622 1 
      445 . 1 1  62  62 ARG HG3  H  1   1.630 0.001 . 2 . . . .  62 ARG HG3  . 15622 1 
      446 . 1 1  62  62 ARG N    N 15 124.13  0.01  . 1 . . . .  62 ARG N    . 15622 1 
      447 . 1 1  63  63 GLY H    H  1   9.657 0.001 . 1 . . . .  63 GLY H    . 15622 1 
      448 . 1 1  63  63 GLY HA2  H  1   3.473 0.001 . 2 . . . .  63 GLY HA2  . 15622 1 
      449 . 1 1  63  63 GLY HA3  H  1   5.174 0.001 . 2 . . . .  63 GLY HA3  . 15622 1 
      450 . 1 1  63  63 GLY N    N 15 109.86  0.01  . 1 . . . .  63 GLY N    . 15622 1 
      451 . 1 1  64  64 GLU H    H  1   9.770 0.001 . 1 . . . .  64 GLU H    . 15622 1 
      452 . 1 1  64  64 GLU HA   H  1   5.316 0.001 . 1 . . . .  64 GLU HA   . 15622 1 
      453 . 1 1  64  64 GLU HB2  H  1   1.972 0.001 . 2 . . . .  64 GLU HB2  . 15622 1 
      454 . 1 1  64  64 GLU HG2  H  1   2.202 0.001 . 2 . . . .  64 GLU HG2  . 15622 1 
      455 . 1 1  64  64 GLU N    N 15 124.78  0.01  . 1 . . . .  64 GLU N    . 15622 1 
      456 . 1 1  65  65 ALA H    H  1   8.113 0.001 . 1 . . . .  65 ALA H    . 15622 1 
      457 . 1 1  65  65 ALA HA   H  1   4.610 0.001 . 1 . . . .  65 ALA HA   . 15622 1 
      458 . 1 1  65  65 ALA HB1  H  1   1.350 0.001 . 1 . . . .  65 ALA HB   . 15622 1 
      459 . 1 1  65  65 ALA HB2  H  1   1.350 0.001 . 1 . . . .  65 ALA HB   . 15622 1 
      460 . 1 1  65  65 ALA HB3  H  1   1.350 0.001 . 1 . . . .  65 ALA HB   . 15622 1 
      461 . 1 1  65  65 ALA N    N 15 122.11  0.001 . 1 . . . .  65 ALA N    . 15622 1 
      462 . 1 1  66  66 SER H    H  1   8.465 0.001 . 1 . . . .  66 SER H    . 15622 1 
      463 . 1 1  66  66 SER HA   H  1   6.037 0.001 . 1 . . . .  66 SER HA   . 15622 1 
      464 . 1 1  66  66 SER HB2  H  1   3.905 0.001 . 2 . . . .  66 SER HB2  . 15622 1 
      465 . 1 1  66  66 SER HB3  H  1   3.905 0.001 . 2 . . . .  66 SER HB3  . 15622 1 
      466 . 1 1  66  66 SER N    N 15 113.98  0.01  . 1 . . . .  66 SER N    . 15622 1 
      467 . 1 1  67  67 THR H    H  1   8.862 0.001 . 1 . . . .  67 THR H    . 15622 1 
      468 . 1 1  67  67 THR HA   H  1   5.063 0.001 . 1 . . . .  67 THR HA   . 15622 1 
      469 . 1 1  67  67 THR HB   H  1   4.731 0.001 . 1 . . . .  67 THR HB   . 15622 1 
      470 . 1 1  67  67 THR HG21 H  1   1.228 0.001 . 1 . . . .  67 THR HG   . 15622 1 
      471 . 1 1  67  67 THR HG22 H  1   1.228 0.001 . 1 . . . .  67 THR HG   . 15622 1 
      472 . 1 1  67  67 THR HG23 H  1   1.228 0.001 . 1 . . . .  67 THR HG   . 15622 1 
      473 . 1 1  67  67 THR N    N 15 117.29  0.01  . 1 . . . .  67 THR N    . 15622 1 
      474 . 1 1  68  68 ARG H    H  1   8.675 0.001 . 1 . . . .  68 ARG H    . 15622 1 
      475 . 1 1  68  68 ARG HA   H  1   4.259 0.001 . 1 . . . .  68 ARG HA   . 15622 1 
      476 . 1 1  68  68 ARG N    N 15 119.41  0.01  . 1 . . . .  68 ARG N    . 15622 1 
      477 . 1 1  69  69 SER H    H  1   8.060 0.001 . 1 . . . .  69 SER H    . 15622 1 
      478 . 1 1  69  69 SER HA   H  1   4.695 0.001 . 1 . . . .  69 SER HA   . 15622 1 
      479 . 1 1  69  69 SER HB2  H  1   3.874 0.001 . 2 . . . .  69 SER HB2  . 15622 1 
      480 . 1 1  69  69 SER HB3  H  1   3.960 0.001 . 2 . . . .  69 SER HB3  . 15622 1 
      481 . 1 1  70  70 GLN H    H  1   8.740 0.001 . 1 . . . .  70 GLN H    . 15622 1 
      482 . 1 1  70  70 GLN HA   H  1   3.033 0.001 . 1 . . . .  70 GLN HA   . 15622 1 
      483 . 1 1  71  71 SER H    H  1   8.195 0.001 . 1 . . . .  71 SER H    . 15622 1 
      484 . 1 1  71  71 SER HB2  H  1   3.910 0.001 . 2 . . . .  71 SER HB2  . 15622 1 
      485 . 1 1  72  72 GLY H    H  1   8.203 0.001 . 1 . . . .  72 GLY H    . 15622 1 
      486 . 1 1  72  72 GLY HA2  H  1   3.977 0.001 . 2 . . . .  72 GLY HA2  . 15622 1 
      487 . 1 1  72  72 GLY HA3  H  1   4.257 0.001 . 2 . . . .  72 GLY HA3  . 15622 1 
      488 . 1 1  73  73 VAL H    H  1   7.594 0.001 . 1 . . . .  73 VAL H    . 15622 1 
      489 . 1 1  73  73 VAL HA   H  1   3.803 0.001 . 1 . . . .  73 VAL HA   . 15622 1 
      490 . 1 1  73  73 VAL HB   H  1   2.410 0.001 . 1 . . . .  73 VAL HB   . 15622 1 
      491 . 1 1  73  73 VAL HG11 H  1   1.042 0.001 . 2 . . . .  73 VAL HG1  . 15622 1 
      492 . 1 1  73  73 VAL HG12 H  1   1.042 0.001 . 2 . . . .  73 VAL HG1  . 15622 1 
      493 . 1 1  73  73 VAL HG13 H  1   1.042 0.001 . 2 . . . .  73 VAL HG1  . 15622 1 
      494 . 1 1  73  73 VAL HG21 H  1   1.016 0.001 . 2 . . . .  73 VAL HG2  . 15622 1 
      495 . 1 1  73  73 VAL HG22 H  1   1.016 0.001 . 2 . . . .  73 VAL HG2  . 15622 1 
      496 . 1 1  73  73 VAL HG23 H  1   1.016 0.001 . 2 . . . .  73 VAL HG2  . 15622 1 
      497 . 1 1  73  73 VAL N    N 15 120.89  0.001 . 1 . . . .  73 VAL N    . 15622 1 
      498 . 1 1  74  74 ALA H    H  1   8.509 0.001 . 1 . . . .  74 ALA H    . 15622 1 
      499 . 1 1  74  74 ALA HA   H  1   3.943 0.001 . 1 . . . .  74 ALA HA   . 15622 1 
      500 . 1 1  74  74 ALA HB1  H  1   1.424 0.001 . 1 . . . .  74 ALA HB   . 15622 1 
      501 . 1 1  74  74 ALA HB2  H  1   1.424 0.001 . 1 . . . .  74 ALA HB   . 15622 1 
      502 . 1 1  74  74 ALA HB3  H  1   1.424 0.001 . 1 . . . .  74 ALA HB   . 15622 1 
      503 . 1 1  74  74 ALA N    N 15 129.25  0.01  . 1 . . . .  74 ALA N    . 15622 1 
      504 . 1 1  75  75 GLY H    H  1   8.561 0.001 . 1 . . . .  75 GLY H    . 15622 1 
      505 . 1 1  75  75 GLY HA2  H  1   3.741 0.001 . 2 . . . .  75 GLY HA2  . 15622 1 
      506 . 1 1  75  75 GLY HA3  H  1   4.017 0.001 . 2 . . . .  75 GLY HA3  . 15622 1 
      507 . 1 1  75  75 GLY N    N 15 105.81  0.01  . 1 . . . .  75 GLY N    . 15622 1 
      508 . 1 1  76  76 LYS H    H  1   7.704 0.001 . 1 . . . .  76 LYS H    . 15622 1 
      509 . 1 1  76  76 LYS HA   H  1   4.008 0.001 . 1 . . . .  76 LYS HA   . 15622 1 
      510 . 1 1  76  76 LYS HB2  H  1   1.816 0.001 . 2 . . . .  76 LYS HB2  . 15622 1 
      511 . 1 1  76  76 LYS HB3  H  1   1.760 0.001 . 2 . . . .  76 LYS HB3  . 15622 1 
      512 . 1 1  76  76 LYS HG2  H  1   1.678 0.001 . 2 . . . .  76 LYS HG2  . 15622 1 
      513 . 1 1  76  76 LYS HG3  H  1   1.543 0.001 . 2 . . . .  76 LYS HG3  . 15622 1 
      514 . 1 1  76  76 LYS N    N 15 120.19  0.01  . 1 . . . .  76 LYS N    . 15622 1 
      515 . 1 1  77  77 THR H    H  1   8.172 0.001 . 1 . . . .  77 THR H    . 15622 1 
      516 . 1 1  77  77 THR HA   H  1   4.336 0.001 . 1 . . . .  77 THR HA   . 15622 1 
      517 . 1 1  77  77 THR HB   H  1   3.407 0.001 . 1 . . . .  77 THR HB   . 15622 1 
      518 . 1 1  77  77 THR HG21 H  1   0.485 0.001 . 1 . . . .  77 THR HG   . 15622 1 
      519 . 1 1  77  77 THR HG22 H  1   0.485 0.001 . 1 . . . .  77 THR HG   . 15622 1 
      520 . 1 1  77  77 THR HG23 H  1   0.485 0.001 . 1 . . . .  77 THR HG   . 15622 1 
      521 . 1 1  77  77 THR N    N 15 119.79  0.01  . 1 . . . .  77 THR N    . 15622 1 
      522 . 1 1  78  78 ALA H    H  1   8.113 0.001 . 1 . . . .  78 ALA H    . 15622 1 
      523 . 1 1  78  78 ALA HA   H  1   4.185 0.001 . 1 . . . .  78 ALA HA   . 15622 1 
      524 . 1 1  78  78 ALA HB1  H  1   1.552 0.001 . 1 . . . .  78 ALA HB   . 15622 1 
      525 . 1 1  78  78 ALA HB2  H  1   1.552 0.001 . 1 . . . .  78 ALA HB   . 15622 1 
      526 . 1 1  78  78 ALA HB3  H  1   1.552 0.001 . 1 . . . .  78 ALA HB   . 15622 1 
      527 . 1 1  78  78 ALA N    N 15 122.96  0.01  . 1 . . . .  78 ALA N    . 15622 1 
      528 . 1 1  79  79 LYS H    H  1   8.344 0.001 . 1 . . . .  79 LYS H    . 15622 1 
      529 . 1 1  79  79 LYS HA   H  1   3.830 0.001 . 1 . . . .  79 LYS HA   . 15622 1 
      530 . 1 1  79  79 LYS HB2  H  1   1.916 0.001 . 2 . . . .  79 LYS HB2  . 15622 1 
      531 . 1 1  79  79 LYS HB3  H  1   1.916 0.001 . 2 . . . .  79 LYS HB3  . 15622 1 
      532 . 1 1  79  79 LYS HD2  H  1   1.729 0.001 . 2 . . . .  79 LYS HD2  . 15622 1 
      533 . 1 1  79  79 LYS HD3  H  1   1.729 0.001 . 2 . . . .  79 LYS HD3  . 15622 1 
      534 . 1 1  79  79 LYS HG2  H  1   1.428 0.001 . 2 . . . .  79 LYS HG2  . 15622 1 
      535 . 1 1  79  79 LYS HG3  H  1   1.428 0.001 . 2 . . . .  79 LYS HG3  . 15622 1 
      536 . 1 1  79  79 LYS N    N 15 116.41  0.01  . 1 . . . .  79 LYS N    . 15622 1 
      537 . 1 1  80  80 ASP H    H  1   7.733 0.001 . 1 . . . .  80 ASP H    . 15622 1 
      538 . 1 1  80  80 ASP HA   H  1   4.514 0.001 . 1 . . . .  80 ASP HA   . 15622 1 
      539 . 1 1  80  80 ASP HB2  H  1   2.919 0.001 . 2 . . . .  80 ASP HB2  . 15622 1 
      540 . 1 1  80  80 ASP HB3  H  1   2.983 0.001 . 2 . . . .  80 ASP HB3  . 15622 1 
      541 . 1 1  80  80 ASP N    N 15 119.36  0.01  . 1 . . . .  80 ASP N    . 15622 1 
      542 . 1 1  81  81 PHE H    H  1   7.828 0.001 . 1 . . . .  81 PHE H    . 15622 1 
      543 . 1 1  81  81 PHE HA   H  1   3.527 0.001 . 1 . . . .  81 PHE HA   . 15622 1 
      544 . 1 1  81  81 PHE HB2  H  1   3.442 0.001 . 2 . . . .  81 PHE HB2  . 15622 1 
      545 . 1 1  81  81 PHE HB3  H  1   2.768 0.001 . 2 . . . .  81 PHE HB3  . 15622 1 
      546 . 1 1  81  81 PHE HD1  H  1   6.732 0.001 . 3 . . . .  81 PHE HD1  . 15622 1 
      547 . 1 1  81  81 PHE HD2  H  1   6.732 0.001 . 3 . . . .  81 PHE HD2  . 15622 1 
      548 . 1 1  81  81 PHE HE1  H  1   6.912 0.001 . 3 . . . .  81 PHE HE1  . 15622 1 
      549 . 1 1  81  81 PHE HE2  H  1   6.912 0.001 . 3 . . . .  81 PHE HE2  . 15622 1 
      550 . 1 1  81  81 PHE HZ   H  1   6.587 0.001 . 1 . . . .  81 PHE HZ   . 15622 1 
      551 . 1 1  81  81 PHE N    N 15 116.75  0.01  . 1 . . . .  81 PHE N    . 15622 1 
      552 . 1 1  82  82 VAL H    H  1   8.486 0.001 . 1 . . . .  82 VAL H    . 15622 1 
      553 . 1 1  82  82 VAL HA   H  1   3.276 0.001 . 1 . . . .  82 VAL HA   . 15622 1 
      554 . 1 1  82  82 VAL HB   H  1   2.187 0.001 . 1 . . . .  82 VAL HB   . 15622 1 
      555 . 1 1  82  82 VAL HG11 H  1   1.073 0.001 . 2 . . . .  82 VAL HG1  . 15622 1 
      556 . 1 1  82  82 VAL HG12 H  1   1.073 0.001 . 2 . . . .  82 VAL HG1  . 15622 1 
      557 . 1 1  82  82 VAL HG13 H  1   1.073 0.001 . 2 . . . .  82 VAL HG1  . 15622 1 
      558 . 1 1  82  82 VAL HG21 H  1   1.161 0.001 . 2 . . . .  82 VAL HG2  . 15622 1 
      559 . 1 1  82  82 VAL HG22 H  1   1.161 0.001 . 2 . . . .  82 VAL HG2  . 15622 1 
      560 . 1 1  82  82 VAL HG23 H  1   1.161 0.001 . 2 . . . .  82 VAL HG2  . 15622 1 
      561 . 1 1  82  82 VAL N    N 15 116.80  0.01  . 1 . . . .  82 VAL N    . 15622 1 
      562 . 1 1  83  83 ARG H    H  1   8.720 0.001 . 1 . . . .  83 ARG H    . 15622 1 
      563 . 1 1  83  83 ARG HA   H  1   4.003 0.001 . 1 . . . .  83 ARG HA   . 15622 1 
      564 . 1 1  83  83 ARG HB2  H  1   2.081 0.001 . 2 . . . .  83 ARG HB2  . 15622 1 
      565 . 1 1  83  83 ARG HB3  H  1   1.947 0.001 . 2 . . . .  83 ARG HB3  . 15622 1 
      566 . 1 1  83  83 ARG HG2  H  1   1.673 0.001 . 2 . . . .  83 ARG HG2  . 15622 1 
      567 . 1 1  83  83 ARG N    N 15 118.58  0.01  . 1 . . . .  83 ARG N    . 15622 1 
      568 . 1 1  84  84 LYS H    H  1   7.404 0.001 . 1 . . . .  84 LYS H    . 15622 1 
      569 . 1 1  84  84 LYS HA   H  1   3.909 0.001 . 1 . . . .  84 LYS HA   . 15622 1 
      570 . 1 1  84  84 LYS HB2  H  1   1.615 0.001 . 2 . . . .  84 LYS HB2  . 15622 1 
      571 . 1 1  84  84 LYS HB3  H  1   1.615 0.001 . 2 . . . .  84 LYS HB3  . 15622 1 
      572 . 1 1  84  84 LYS HD2  H  1   1.493 0.001 . 2 . . . .  84 LYS HD2  . 15622 1 
      573 . 1 1  84  84 LYS HD3  H  1   1.493 0.001 . 2 . . . .  84 LYS HD3  . 15622 1 
      574 . 1 1  84  84 LYS HG2  H  1   1.345 0.001 . 2 . . . .  84 LYS HG2  . 15622 1 
      575 . 1 1  84  84 LYS HG3  H  1   1.345 0.001 . 2 . . . .  84 LYS HG3  . 15622 1 
      576 . 1 1  84  84 LYS N    N 15 118.76  0.01  . 1 . . . .  84 LYS N    . 15622 1 
      577 . 1 1  85  85 ALA H    H  1   8.483 0.001 . 1 . . . .  85 ALA H    . 15622 1 
      578 . 1 1  85  85 ALA HA   H  1   3.542 0.001 . 1 . . . .  85 ALA HA   . 15622 1 
      579 . 1 1  85  85 ALA HB1  H  1   0.990 0.001 . 1 . . . .  85 ALA HB   . 15622 1 
      580 . 1 1  85  85 ALA HB2  H  1   0.990 0.001 . 1 . . . .  85 ALA HB   . 15622 1 
      581 . 1 1  85  85 ALA HB3  H  1   0.990 0.001 . 1 . . . .  85 ALA HB   . 15622 1 
      582 . 1 1  85  85 ALA N    N 15 121.51  0.01  . 1 . . . .  85 ALA N    . 15622 1 
      583 . 1 1  86  86 PHE H    H  1   8.529 0.001 . 1 . . . .  86 PHE H    . 15622 1 
      584 . 1 1  86  86 PHE HA   H  1   4.330 0.001 . 1 . . . .  86 PHE HA   . 15622 1 
      585 . 1 1  86  86 PHE HB2  H  1   2.578 0.001 . 2 . . . .  86 PHE HB2  . 15622 1 
      586 . 1 1  86  86 PHE HB3  H  1   2.101 0.001 . 2 . . . .  86 PHE HB3  . 15622 1 
      587 . 1 1  86  86 PHE HD1  H  1   7.098 0.001 . 3 . . . .  86 PHE HD1  . 15622 1 
      588 . 1 1  86  86 PHE HD2  H  1   7.098 0.001 . 3 . . . .  86 PHE HD2  . 15622 1 
      589 . 1 1  86  86 PHE HE1  H  1   6.921 0.001 . 3 . . . .  86 PHE HE1  . 15622 1 
      590 . 1 1  86  86 PHE HE2  H  1   6.921 0.001 . 3 . . . .  86 PHE HE2  . 15622 1 
      591 . 1 1  86  86 PHE HZ   H  1   6.880 0.001 . 1 . . . .  86 PHE HZ   . 15622 1 
      592 . 1 1  86  86 PHE N    N 15 118.07  0.01  . 1 . . . .  86 PHE N    . 15622 1 
      593 . 1 1  87  87 GLN H    H  1   8.254 0.001 . 1 . . . .  87 GLN H    . 15622 1 
      594 . 1 1  87  87 GLN HA   H  1   3.987 0.001 . 1 . . . .  87 GLN HA   . 15622 1 
      595 . 1 1  87  87 GLN HB2  H  1   2.121 0.001 . 2 . . . .  87 GLN HB2  . 15622 1 
      596 . 1 1  87  87 GLN HB3  H  1   2.294 0.001 . 2 . . . .  87 GLN HB3  . 15622 1 
      597 . 1 1  87  87 GLN HG2  H  1   2.666 0.001 . 2 . . . .  87 GLN HG2  . 15622 1 
      598 . 1 1  87  87 GLN HG3  H  1   2.450 0.001 . 2 . . . .  87 GLN HG3  . 15622 1 
      599 . 1 1  87  87 GLN N    N 15 120.89  0.01  . 1 . . . .  87 GLN N    . 15622 1 
      600 . 1 1  88  88 LYS H    H  1   7.946 0.001 . 1 . . . .  88 LYS H    . 15622 1 
      601 . 1 1  88  88 LYS HA   H  1   4.320 0.001 . 1 . . . .  88 LYS HA   . 15622 1 
      602 . 1 1  88  88 LYS HB2  H  1   1.650 0.001 . 2 . . . .  88 LYS HB2  . 15622 1 
      603 . 1 1  88  88 LYS HB3  H  1   1.906 0.001 . 2 . . . .  88 LYS HB3  . 15622 1 
      604 . 1 1  88  88 LYS HG2  H  1   1.481 0.001 . 2 . . . .  88 LYS HG2  . 15622 1 
      605 . 1 1  88  88 LYS HG3  H  1   1.347 0.001 . 2 . . . .  88 LYS HG3  . 15622 1 
      606 . 1 1  88  88 LYS N    N 15 115.29  0.01  . 1 . . . .  88 LYS N    . 15622 1 
      607 . 1 1  89  89 GLY H    H  1   7.563 0.001 . 1 . . . .  89 GLY H    . 15622 1 
      608 . 1 1  89  89 GLY HA2  H  1   3.819 0.001 . 2 . . . .  89 GLY HA2  . 15622 1 
      609 . 1 1  89  89 GLY HA3  H  1   4.057 0.001 . 2 . . . .  89 GLY HA3  . 15622 1 
      610 . 1 1  89  89 GLY N    N 15 107.58  0.01  . 1 . . . .  89 GLY N    . 15622 1 
      611 . 1 1  90  90 LEU H    H  1   8.063 0.001 . 1 . . . .  90 LEU H    . 15622 1 
      612 . 1 1  90  90 LEU HA   H  1   4.081 0.001 . 1 . . . .  90 LEU HA   . 15622 1 
      613 . 1 1  90  90 LEU HB2  H  1   1.152 0.001 . 2 . . . .  90 LEU HB2  . 15622 1 
      614 . 1 1  90  90 LEU HB3  H  1   1.389 0.001 . 2 . . . .  90 LEU HB3  . 15622 1 
      615 . 1 1  90  90 LEU HD11 H  1   0.339 0.001 . 2 . . . .  90 LEU HD1  . 15622 1 
      616 . 1 1  90  90 LEU HD12 H  1   0.339 0.001 . 2 . . . .  90 LEU HD1  . 15622 1 
      617 . 1 1  90  90 LEU HD13 H  1   0.339 0.001 . 2 . . . .  90 LEU HD1  . 15622 1 
      618 . 1 1  90  90 LEU HD21 H  1  -0.097 0.001 . 2 . . . .  90 LEU HD2  . 15622 1 
      619 . 1 1  90  90 LEU HD22 H  1  -0.097 0.001 . 2 . . . .  90 LEU HD2  . 15622 1 
      620 . 1 1  90  90 LEU HD23 H  1  -0.097 0.001 . 2 . . . .  90 LEU HD2  . 15622 1 
      621 . 1 1  90  90 LEU HG   H  1   1.233 0.001 . 1 . . . .  90 LEU HG   . 15622 1 
      622 . 1 1  90  90 LEU N    N 15 120.80  0.01  . 1 . . . .  90 LEU N    . 15622 1 
      623 . 1 1  91  91 ILE H    H  1   6.525 0.001 . 1 . . . .  91 ILE H    . 15622 1 
      624 . 1 1  91  91 ILE HA   H  1   4.600 0.001 . 1 . . . .  91 ILE HA   . 15622 1 
      625 . 1 1  91  91 ILE HB   H  1   1.227 0.001 . 1 . . . .  91 ILE HB   . 15622 1 
      626 . 1 1  91  91 ILE HD11 H  1   0.593 0.001 . 1 . . . .  91 ILE HD1  . 15622 1 
      627 . 1 1  91  91 ILE HD12 H  1   0.593 0.001 . 1 . . . .  91 ILE HD1  . 15622 1 
      628 . 1 1  91  91 ILE HD13 H  1   0.593 0.001 . 1 . . . .  91 ILE HD1  . 15622 1 
      629 . 1 1  91  91 ILE HG12 H  1   1.094 0.001 . 2 . . . .  91 ILE HG12 . 15622 1 
      630 . 1 1  91  91 ILE HG13 H  1   1.094 0.001 . 2 . . . .  91 ILE HG13 . 15622 1 
      631 . 1 1  91  91 ILE HG21 H  1   0.783 0.001 . 1 . . . .  91 ILE HG2  . 15622 1 
      632 . 1 1  91  91 ILE HG22 H  1   0.783 0.001 . 1 . . . .  91 ILE HG2  . 15622 1 
      633 . 1 1  91  91 ILE HG23 H  1   0.783 0.001 . 1 . . . .  91 ILE HG2  . 15622 1 
      634 . 1 1  91  91 ILE N    N 15 109.80  0.01  . 1 . . . .  91 ILE N    . 15622 1 
      635 . 1 1  92  92 SER H    H  1   8.822 0.001 . 1 . . . .  92 SER H    . 15622 1 
      636 . 1 1  92  92 SER HA   H  1   4.874 0.001 . 1 . . . .  92 SER HA   . 15622 1 
      637 . 1 1  92  92 SER HB2  H  1   4.044 0.001 . 2 . . . .  92 SER HB2  . 15622 1 
      638 . 1 1  92  92 SER HB3  H  1   4.457 0.001 . 2 . . . .  92 SER HB3  . 15622 1 
      639 . 1 1  92  92 SER N    N 15 120.24  0.01  . 1 . . . .  92 SER N    . 15622 1 
      640 . 1 1  93  93 GLN H    H  1   9.324 0.001 . 1 . . . .  93 GLN H    . 15622 1 
      641 . 1 1  93  93 GLN HA   H  1   4.020 0.001 . 1 . . . .  93 GLN HA   . 15622 1 
      642 . 1 1  93  93 GLN HB2  H  1   2.190 0.001 . 2 . . . .  93 GLN HB2  . 15622 1 
      643 . 1 1  93  93 GLN HG2  H  1   2.380 0.001 . 2 . . . .  93 GLN HG2  . 15622 1 
      644 . 1 1  93  93 GLN N    N 15 121.83  0.01  . 1 . . . .  93 GLN N    . 15622 1 
      645 . 1 1  94  94 GLN H    H  1   8.740 0.001 . 1 . . . .  94 GLN H    . 15622 1 
      646 . 1 1  94  94 GLN HA   H  1   4.236 0.001 . 1 . . . .  94 GLN HA   . 15622 1 
      647 . 1 1  94  94 GLN HB2  H  1   2.520 0.001 . 2 . . . .  94 GLN HB2  . 15622 1 
      648 . 1 1  95  95 GLU H    H  1   7.953 0.001 . 1 . . . .  95 GLU H    . 15622 1 
      649 . 1 1  95  95 GLU HA   H  1   4.158 0.001 . 1 . . . .  95 GLU HA   . 15622 1 
      650 . 1 1  95  95 GLU HB2  H  1   2.084 0.001 . 2 . . . .  95 GLU HB2  . 15622 1 
      651 . 1 1  95  95 GLU HB3  H  1   2.198 0.001 . 2 . . . .  95 GLU HB3  . 15622 1 
      652 . 1 1  95  95 GLU HG2  H  1   2.342 0.001 . 2 . . . .  95 GLU HG2  . 15622 1 
      653 . 1 1  95  95 GLU HG3  H  1   2.404 0.001 . 2 . . . .  95 GLU HG3  . 15622 1 
      654 . 1 1  95  95 GLU N    N 15 120.11  0.01  . 1 . . . .  95 GLU N    . 15622 1 
      655 . 1 1  96  96 ALA H    H  1   8.406 0.001 . 1 . . . .  96 ALA H    . 15622 1 
      656 . 1 1  96  96 ALA HA   H  1   4.160 0.001 . 1 . . . .  96 ALA HA   . 15622 1 
      657 . 1 1  96  96 ALA HB1  H  1   1.672 0.001 . 1 . . . .  96 ALA HB   . 15622 1 
      658 . 1 1  96  96 ALA HB2  H  1   1.672 0.001 . 1 . . . .  96 ALA HB   . 15622 1 
      659 . 1 1  96  96 ALA HB3  H  1   1.672 0.001 . 1 . . . .  96 ALA HB   . 15622 1 
      660 . 1 1  96  96 ALA N    N 15 122.16  0.01  . 1 . . . .  96 ALA N    . 15622 1 
      661 . 1 1  97  97 ASN H    H  1   8.559 0.001 . 1 . . . .  97 ASN H    . 15622 1 
      662 . 1 1  97  97 ASN HA   H  1   4.561 0.001 . 1 . . . .  97 ASN HA   . 15622 1 
      663 . 1 1  97  97 ASN HB2  H  1   2.973 0.001 . 2 . . . .  97 ASN HB2  . 15622 1 
      664 . 1 1  97  97 ASN HB3  H  1   2.856 0.001 . 2 . . . .  97 ASN HB3  . 15622 1 
      665 . 1 1  97  97 ASN N    N 15 115.72  0.01  . 1 . . . .  97 ASN N    . 15622 1 
      666 . 1 1  98  98 GLN H    H  1   8.096 0.001 . 1 . . . .  98 GLN H    . 15622 1 
      667 . 1 1  98  98 GLN HA   H  1   4.161 0.001 . 1 . . . .  98 GLN HA   . 15622 1 
      668 . 1 1  98  98 GLN HB2  H  1   2.288 0.001 . 2 . . . .  98 GLN HB2  . 15622 1 
      669 . 1 1  98  98 GLN HB3  H  1   2.321 0.001 . 2 . . . .  98 GLN HB3  . 15622 1 
      670 . 1 1  98  98 GLN HE21 H  1   7.527 0.001 . 2 . . . .  98 GLN HE21 . 15622 1 
      671 . 1 1  98  98 GLN HE22 H  1   6.924 0.001 . 2 . . . .  98 GLN HE22 . 15622 1 
      672 . 1 1  98  98 GLN HG2  H  1   2.588 0.001 . 2 . . . .  98 GLN HG2  . 15622 1 
      673 . 1 1  98  98 GLN HG3  H  1   2.483 0.001 . 2 . . . .  98 GLN HG3  . 15622 1 
      674 . 1 1  98  98 GLN N    N 15 119.99  0.01  . 1 . . . .  98 GLN N    . 15622 1 
      675 . 1 1  98  98 GLN NE2  N 15 112.36  0.01  . 1 . . . .  98 GLN NE2  . 15622 1 
      676 . 1 1  99  99 TRP H    H  1   8.261 0.001 . 1 . . . .  99 TRP H    . 15622 1 
      677 . 1 1  99  99 TRP HA   H  1   4.440 0.001 . 1 . . . .  99 TRP HA   . 15622 1 
      678 . 1 1  99  99 TRP HB2  H  1   3.431 0.001 . 2 . . . .  99 TRP HB2  . 15622 1 
      679 . 1 1  99  99 TRP HB3  H  1   3.542 0.001 . 2 . . . .  99 TRP HB3  . 15622 1 
      680 . 1 1  99  99 TRP HD1  H  1   7.582 0.001 . 1 . . . .  99 TRP HD1  . 15622 1 
      681 . 1 1  99  99 TRP HE1  H  1  11.328 0.001 . 1 . . . .  99 TRP HE1  . 15622 1 
      682 . 1 1  99  99 TRP HE3  H  1   7.507 0.001 . 1 . . . .  99 TRP HE3  . 15622 1 
      683 . 1 1  99  99 TRP HH2  H  1   7.262 0.001 . 1 . . . .  99 TRP HH2  . 15622 1 
      684 . 1 1  99  99 TRP HZ2  H  1   7.675 0.001 . 1 . . . .  99 TRP HZ2  . 15622 1 
      685 . 1 1  99  99 TRP HZ3  H  1   7.454 0.001 . 1 . . . .  99 TRP HZ3  . 15622 1 
      686 . 1 1  99  99 TRP N    N 15 122.15  0.01  . 1 . . . .  99 TRP N    . 15622 1 
      687 . 1 1  99  99 TRP NE1  N 15 132.92  0.01  . 1 . . . .  99 TRP NE1  . 15622 1 
      688 . 1 1 100 100 LEU H    H  1   8.367 0.001 . 1 . . . . 100 LEU H    . 15622 1 
      689 . 1 1 100 100 LEU HA   H  1   3.751 0.001 . 1 . . . . 100 LEU HA   . 15622 1 
      690 . 1 1 100 100 LEU HB2  H  1   2.101 0.001 . 2 . . . . 100 LEU HB2  . 15622 1 
      691 . 1 1 100 100 LEU HB3  H  1   2.172 0.001 . 2 . . . . 100 LEU HB3  . 15622 1 
      692 . 1 1 100 100 LEU HD11 H  1   1.071 0.001 . 2 . . . . 100 LEU HD1  . 15622 1 
      693 . 1 1 100 100 LEU HD12 H  1   1.071 0.001 . 2 . . . . 100 LEU HD1  . 15622 1 
      694 . 1 1 100 100 LEU HD13 H  1   1.071 0.001 . 2 . . . . 100 LEU HD1  . 15622 1 
      695 . 1 1 100 100 LEU HD21 H  1   0.909 0.001 . 2 . . . . 100 LEU HD2  . 15622 1 
      696 . 1 1 100 100 LEU HD22 H  1   0.909 0.001 . 2 . . . . 100 LEU HD2  . 15622 1 
      697 . 1 1 100 100 LEU HD23 H  1   0.909 0.001 . 2 . . . . 100 LEU HD2  . 15622 1 
      698 . 1 1 100 100 LEU HG   H  1   1.633 0.001 . 1 . . . . 100 LEU HG   . 15622 1 
      699 . 1 1 100 100 LEU N    N 15 118.16  0.01  . 1 . . . . 100 LEU N    . 15622 1 
      700 . 1 1 101 101 SER H    H  1   7.462 0.001 . 1 . . . . 101 SER H    . 15622 1 
      701 . 1 1 101 101 SER HA   H  1   4.483 0.001 . 1 . . . . 101 SER HA   . 15622 1 
      702 . 1 1 101 101 SER HB2  H  1   4.031 0.001 . 2 . . . . 101 SER HB2  . 15622 1 
      703 . 1 1 101 101 SER HB3  H  1   4.010 0.001 . 2 . . . . 101 SER HB3  . 15622 1 
      704 . 1 1 101 101 SER N    N 15 113.49  0.001 . 1 . . . . 101 SER N    . 15622 1 
      705 . 1 1 102 102 SER H    H  1   7.373 0.001 . 1 . . . . 102 SER H    . 15622 1 
      706 . 1 1 102 102 SER HA   H  1   4.271 0.001 . 1 . . . . 102 SER HA   . 15622 1 
      707 . 1 1 102 102 SER HB2  H  1   3.888 0.001 . 2 . . . . 102 SER HB2  . 15622 1 
      708 . 1 1 102 102 SER HB3  H  1   3.888 0.001 . 2 . . . . 102 SER HB3  . 15622 1 
      709 . 1 1 102 102 SER N    N 15 122.70  0.01  . 1 . . . . 102 SER N    . 15622 1 

   stop_

save_