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                      18787
   _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 1H-15N HSQC' . . . 18787 1 

   stop_

   loop_
      _Atom_chem_shift.ID
      _Atom_chem_shift.Assembly_atom_ID
      _Atom_chem_shift.Entity_assembly_ID
      _Atom_chem_shift.Entity_ID
      _Atom_chem_shift.Comp_index_ID
      _Atom_chem_shift.Seq_ID
      _Atom_chem_shift.Comp_ID
      _Atom_chem_shift.Atom_ID
      _Atom_chem_shift.Atom_type
      _Atom_chem_shift.Atom_isotope_number
      _Atom_chem_shift.Val
      _Atom_chem_shift.Val_err
      _Atom_chem_shift.Assign_fig_of_merit
      _Atom_chem_shift.Ambiguity_code
      _Atom_chem_shift.Occupancy
      _Atom_chem_shift.Resonance_ID
      _Atom_chem_shift.Auth_entity_assembly_ID
      _Atom_chem_shift.Auth_asym_ID
      _Atom_chem_shift.Auth_seq_ID
      _Atom_chem_shift.Auth_comp_ID
      _Atom_chem_shift.Auth_atom_ID
      _Atom_chem_shift.Details
      _Atom_chem_shift.Entry_ID
      _Atom_chem_shift.Assigned_chem_shift_list_ID

        1 . 1 1  1  1 ALA HA   H  1   3.780 0.004 . 1 . . . A   1 ALA HA   . 18787 1 
        2 . 1 1  1  1 ALA HB1  H  1   1.255 0.004 . 1 . . . A   1 ALA HB1  . 18787 1 
        3 . 1 1  1  1 ALA HB2  H  1   1.255 0.004 . 1 . . . A   1 ALA HB2  . 18787 1 
        4 . 1 1  1  1 ALA HB3  H  1   1.255 0.004 . 1 . . . A   1 ALA HB3  . 18787 1 
        5 . 1 1  2  2 ASP HA   H  1   4.814 0.002 . 1 . . . A   2 ASP HA   . 18787 1 
        6 . 1 1  2  2 ASP HB2  H  1   3.855 0.002 . 1 . . . A   2 ASP HB2  . 18787 1 
        7 . 1 1  2  2 ASP HB3  H  1   2.267 0.004 . 1 . . . A   2 ASP HB3  . 18787 1 
        8 . 1 1  3  3 ASP H    H  1   7.358 0.004 . 1 . . . A   3 ASP H    . 18787 1 
        9 . 1 1  3  3 ASP HA   H  1   4.773 0.001 . 1 . . . A   3 ASP HA   . 18787 1 
       10 . 1 1  3  3 ASP HB2  H  1   2.025 0.005 . 1 . . . A   3 ASP HB2  . 18787 1 
       11 . 1 1  3  3 ASP HB3  H  1   2.099 0.003 . 1 . . . A   3 ASP HB3  . 18787 1 
       12 . 1 1  3  3 ASP N    N 15 117.096 0.000 . 1 . . . A   3 ASP N    . 18787 1 
       13 . 1 1  4  4 ILE H    H  1   8.157 0.005 . 1 . . . A   4 ILE H    . 18787 1 
       14 . 1 1  4  4 ILE HA   H  1   3.950 0.003 . 1 . . . A   4 ILE HA   . 18787 1 
       15 . 1 1  4  4 ILE HB   H  1   1.007 0.003 . 1 . . . A   4 ILE HB   . 18787 1 
       16 . 1 1  4  4 ILE HG12 H  1   0.147 0.008 . 1 . . . A   4 ILE HG12 . 18787 1 
       17 . 1 1  4  4 ILE HG13 H  1  -0.018 0.005 . 1 . . . A   4 ILE HG13 . 18787 1 
       18 . 1 1  4  4 ILE HG21 H  1   0.831 0.004 . 1 . . . A   4 ILE QG2  . 18787 1 
       19 . 1 1  4  4 ILE HG22 H  1   0.831 0.004 . 1 . . . A   4 ILE QG2  . 18787 1 
       20 . 1 1  4  4 ILE HG23 H  1   0.831 0.004 . 1 . . . A   4 ILE HG23 . 18787 1 
       21 . 1 1  4  4 ILE HD11 H  1  -0.893 0.003 . 1 . . . A   4 ILE HD11 . 18787 1 
       22 . 1 1  4  4 ILE HD12 H  1  -0.893 0.003 . 1 . . . A   4 ILE QD1  . 18787 1 
       23 . 1 1  4  4 ILE HD13 H  1  -0.893 0.003 . 1 . . . A   4 ILE QD1  . 18787 1 
       24 . 1 1  4  4 ILE N    N 15 121.741 0.000 . 1 . . . A   4 ILE N    . 18787 1 
       25 . 1 1  5  5 VAL H    H  1   8.678 0.003 . 1 . . . A   5 VAL H    . 18787 1 
       26 . 1 1  5  5 VAL HA   H  1   4.333 0.006 . 1 . . . A   5 VAL HA   . 18787 1 
       27 . 1 1  5  5 VAL HB   H  1   1.952 0.006 . 1 . . . A   5 VAL HB   . 18787 1 
       28 . 1 1  5  5 VAL HG11 H  1   0.752 0.004 . 1 . . . A   5 VAL QG1  . 18787 1 
       29 . 1 1  5  5 VAL HG12 H  1   0.752 0.004 . 1 . . . A   5 VAL QG1  . 18787 1 
       30 . 1 1  5  5 VAL HG13 H  1   0.752 0.004 . 1 . . . A   5 VAL HG13 . 18787 1 
       31 . 1 1  5  5 VAL HG21 H  1   0.828 0.002 . 1 . . . A   5 VAL HG21 . 18787 1 
       32 . 1 1  5  5 VAL HG22 H  1   0.828 0.002 . 1 . . . A   5 VAL QG2  . 18787 1 
       33 . 1 1  5  5 VAL HG23 H  1   0.828 0.002 . 1 . . . A   5 VAL QG2  . 18787 1 
       34 . 1 1  5  5 VAL N    N 15 127.721 0.000 . 1 . . . A   5 VAL N    . 18787 1 
       35 . 1 1  6  6 LEU H    H  1   9.644 0.002 . 1 . . . A   6 LEU H    . 18787 1 
       36 . 1 1  6  6 LEU HA   H  1   4.965 0.005 . 1 . . . A   6 LEU HA   . 18787 1 
       37 . 1 1  6  6 LEU HB2  H  1   2.602 0.003 . 1 . . . A   6 LEU HB2  . 18787 1 
       38 . 1 1  6  6 LEU HB3  H  1   2.256 0.004 . 1 . . . A   6 LEU HB3  . 18787 1 
       39 . 1 1  6  6 LEU HG   H  1   2.169 0.006 . 1 . . . A   6 LEU HG   . 18787 1 
       40 . 1 1  6  6 LEU HD11 H  1   1.819 0.003 . 1 . . . A   6 LEU QD1  . 18787 1 
       41 . 1 1  6  6 LEU HD12 H  1   1.819 0.003 . 1 . . . A   6 LEU QD1  . 18787 1 
       42 . 1 1  6  6 LEU HD13 H  1   1.819 0.003 . 1 . . . A   6 LEU HD13 . 18787 1 
       43 . 1 1  6  6 LEU HD21 H  1   1.485 0.005 . 1 . . . A   6 LEU HD21 . 18787 1 
       44 . 1 1  6  6 LEU HD22 H  1   1.485 0.005 . 1 . . . A   6 LEU QD2  . 18787 1 
       45 . 1 1  6  6 LEU HD23 H  1   1.485 0.005 . 1 . . . A   6 LEU QD2  . 18787 1 
       46 . 1 1  6  6 LEU N    N 15 133.376 0.000 . 1 . . . A   6 LEU N    . 18787 1 
       47 . 1 1  7  7 LYS H    H  1   8.600 0.003 . 1 . . . A   7 LYS H    . 18787 1 
       48 . 1 1  7  7 LYS HA   H  1   4.295 0.003 . 1 . . . A   7 LYS HA   . 18787 1 
       49 . 1 1  7  7 LYS HB2  H  1   1.797 0.003 . 1 . . . A   7 LYS HB2  . 18787 1 
       50 . 1 1  7  7 LYS HB3  H  1   1.914 0.004 . 1 . . . A   7 LYS HB3  . 18787 1 
       51 . 1 1  7  7 LYS HG2  H  1   1.533 0.004 . 1 . . . A   7 LYS HG2  . 18787 1 
       52 . 1 1  7  7 LYS HG3  H  1   1.651 0.003 . 1 . . . A   7 LYS HG3  . 18787 1 
       53 . 1 1  7  7 LYS HD2  H  1   1.709 0.002 . 1 . . . A   7 LYS HD2  . 18787 1 
       54 . 1 1  7  7 LYS HD3  H  1   1.777 0.001 . 1 . . . A   7 LYS HD3  . 18787 1 
       55 . 1 1  7  7 LYS N    N 15 123.987 0.000 . 1 . . . A   7 LYS N    . 18787 1 
       56 . 1 1  8  8 ALA H    H  1   8.640 0.003 . 1 . . . A   8 ALA H    . 18787 1 
       57 . 1 1  8  8 ALA HA   H  1   4.885 0.005 . 1 . . . A   8 ALA HA   . 18787 1 
       58 . 1 1  8  8 ALA HB1  H  1   0.885 0.002 . 1 . . . A   8 ALA HB1  . 18787 1 
       59 . 1 1  8  8 ALA HB2  H  1   0.885 0.002 . 1 . . . A   8 ALA HB2  . 18787 1 
       60 . 1 1  8  8 ALA HB3  H  1   0.885 0.002 . 1 . . . A   8 ALA HB3  . 18787 1 
       61 . 1 1  8  8 ALA N    N 15 124.059 0.000 . 1 . . . A   8 ALA N    . 18787 1 
       62 . 1 1  9  9 LYS H    H  1  10.291 0.004 . 1 . . . A   9 LYS H    . 18787 1 
       63 . 1 1  9  9 LYS HA   H  1   4.010 0.003 . 1 . . . A   9 LYS HA   . 18787 1 
       64 . 1 1  9  9 LYS HB2  H  1   1.919 0.002 . 1 . . . A   9 LYS HB2  . 18787 1 
       65 . 1 1  9  9 LYS HB3  H  1   1.894 0.002 . 1 . . . A   9 LYS HB3  . 18787 1 
       66 . 1 1  9  9 LYS HG2  H  1   1.600 0.002 . 1 . . . A   9 LYS HG2  . 18787 1 
       67 . 1 1  9  9 LYS N    N 15 125.221 0.000 . 1 . . . A   9 LYS N    . 18787 1 
       68 . 1 1 10 10 ASN H    H  1   8.848 0.002 . 1 . . . A  10 ASN H    . 18787 1 
       69 . 1 1 10 10 ASN HA   H  1   4.291 0.004 . 1 . . . A  10 ASN HA   . 18787 1 
       70 . 1 1 10 10 ASN HB2  H  1   1.868 0.004 . 1 . . . A  10 ASN HB2  . 18787 1 
       71 . 1 1 10 10 ASN HB3  H  1   2.138 0.004 . 1 . . . A  10 ASN HB3  . 18787 1 
       72 . 1 1 10 10 ASN HD21 H  1   1.127 0.010 . 1 . . . A  10 ASN HD21 . 18787 1 
       73 . 1 1 10 10 ASN HD22 H  1   5.424 0.003 . 1 . . . A  10 ASN HD22 . 18787 1 
       74 . 1 1 10 10 ASN N    N 15 114.013 0.000 . 1 . . . A  10 ASN N    . 18787 1 
       75 . 1 1 10 10 ASN ND2  N 15 108.979 0.024 . 1 . . . A  10 ASN ND2  . 18787 1 
       76 . 1 1 11 11 GLY H    H  1   6.961 0.004 . 1 . . . A  11 GLY H    . 18787 1 
       77 . 1 1 11 11 GLY HA2  H  1   3.464 0.002 . 1 . . . A  11 GLY HA2  . 18787 1 
       78 . 1 1 11 11 GLY HA3  H  1   3.095 0.004 . 1 . . . A  11 GLY HA3  . 18787 1 
       79 . 1 1 11 11 GLY N    N 15 110.695 0.000 . 1 . . . A  11 GLY N    . 18787 1 
       80 . 1 1 12 12 ASP H    H  1   8.062 0.003 . 1 . . . A  12 ASP H    . 18787 1 
       81 . 1 1 12 12 ASP HA   H  1   4.310 0.004 . 1 . . . A  12 ASP HA   . 18787 1 
       82 . 1 1 12 12 ASP HB2  H  1   2.366 0.005 . 1 . . . A  12 ASP HB2  . 18787 1 
       83 . 1 1 12 12 ASP HB3  H  1   2.288 0.005 . 1 . . . A  12 ASP HB3  . 18787 1 
       84 . 1 1 12 12 ASP N    N 15 129.394 0.000 . 1 . . . A  12 ASP N    . 18787 1 
       85 . 1 1 13 13 VAL H    H  1   8.586 0.004 . 1 . . . A  13 VAL H    . 18787 1 
       86 . 1 1 13 13 VAL HA   H  1   4.182 0.002 . 1 . . . A  13 VAL HA   . 18787 1 
       87 . 1 1 13 13 VAL HB   H  1   2.314 0.006 . 1 . . . A  13 VAL HB   . 18787 1 
       88 . 1 1 13 13 VAL HG11 H  1   1.566 0.002 . 1 . . . A  13 VAL QG1  . 18787 1 
       89 . 1 1 13 13 VAL HG12 H  1   1.566 0.002 . 1 . . . A  13 VAL QG1  . 18787 1 
       90 . 1 1 13 13 VAL HG13 H  1   1.566 0.002 . 1 . . . A  13 VAL HG13 . 18787 1 
       91 . 1 1 13 13 VAL HG21 H  1  -0.891 0.002 . 1 . . . A  13 VAL HG21 . 18787 1 
       92 . 1 1 13 13 VAL HG22 H  1  -0.891 0.002 . 1 . . . A  13 VAL QG2  . 18787 1 
       93 . 1 1 13 13 VAL HG23 H  1  -0.891 0.002 . 1 . . . A  13 VAL QG2  . 18787 1 
       94 . 1 1 13 13 VAL N    N 15 121.995 0.000 . 1 . . . A  13 VAL N    . 18787 1 
       95 . 1 1 14 14 LYS H    H  1   9.015 0.004 . 1 . . . A  14 LYS H    . 18787 1 
       96 . 1 1 14 14 LYS HA   H  1   4.757 0.002 . 1 . . . A  14 LYS HA   . 18787 1 
       97 . 1 1 14 14 LYS HB2  H  1   1.695 0.004 . 1 . . . A  14 LYS HB2  . 18787 1 
       98 . 1 1 14 14 LYS HB3  H  1   1.851 0.006 . 1 . . . A  14 LYS HB3  . 18787 1 
       99 . 1 1 14 14 LYS HG2  H  1   0.993 0.005 . 1 . . . A  14 LYS HG2  . 18787 1 
      100 . 1 1 14 14 LYS HG3  H  1   1.175 0.004 . 1 . . . A  14 LYS HG3  . 18787 1 
      101 . 1 1 14 14 LYS HD2  H  1   1.862 0.002 . 1 . . . A  14 LYS HD2  . 18787 1 
      102 . 1 1 14 14 LYS N    N 15 129.052 0.000 . 1 . . . A  14 LYS N    . 18787 1 
      103 . 1 1 15 15 LEU H    H  1   9.237 0.003 . 1 . . . A  15 LEU H    . 18787 1 
      104 . 1 1 15 15 LEU HA   H  1   4.734 0.004 . 1 . . . A  15 LEU HA   . 18787 1 
      105 . 1 1 15 15 LEU HB2  H  1   1.437 0.004 . 1 . . . A  15 LEU HB2  . 18787 1 
      106 . 1 1 15 15 LEU HB3  H  1   1.834 0.005 . 1 . . . A  15 LEU HB3  . 18787 1 
      107 . 1 1 15 15 LEU HG   H  1  -0.362 0.004 . 1 . . . A  15 LEU HG   . 18787 1 
      108 . 1 1 15 15 LEU HD11 H  1  -1.315 0.003 . 1 . . . A  15 LEU QD1  . 18787 1 
      109 . 1 1 15 15 LEU HD12 H  1  -1.315 0.003 . 1 . . . A  15 LEU QD1  . 18787 1 
      110 . 1 1 15 15 LEU HD13 H  1  -1.315 0.003 . 1 . . . A  15 LEU HD13 . 18787 1 
      111 . 1 1 15 15 LEU HD21 H  1   0.142 0.003 . 1 . . . A  15 LEU HD21 . 18787 1 
      112 . 1 1 15 15 LEU HD22 H  1   0.142 0.003 . 1 . . . A  15 LEU QD2  . 18787 1 
      113 . 1 1 15 15 LEU HD23 H  1   0.142 0.003 . 1 . . . A  15 LEU QD2  . 18787 1 
      114 . 1 1 15 15 LEU N    N 15 128.888 0.000 . 1 . . . A  15 LEU N    . 18787 1 
      115 . 1 1 16 16 PRO HA   H  1   4.837 0.003 . 1 . . . A  16 PRO HA   . 18787 1 
      116 . 1 1 16 16 PRO HB2  H  1   1.726 0.003 . 1 . . . A  16 PRO HB2  . 18787 1 
      117 . 1 1 16 16 PRO HB3  H  1   1.774 0.004 . 1 . . . A  16 PRO HB3  . 18787 1 
      118 . 1 1 16 16 PRO HG2  H  1   1.112 0.005 . 1 . . . A  16 PRO HG2  . 18787 1 
      119 . 1 1 16 16 PRO HG3  H  1   1.880 0.004 . 1 . . . A  16 PRO HG3  . 18787 1 
      120 . 1 1 16 16 PRO HD2  H  1   2.385 0.004 . 1 . . . A  16 PRO HD2  . 18787 1 
      121 . 1 1 16 16 PRO HD3  H  1   4.409 0.003 . 1 . . . A  16 PRO HD3  . 18787 1 
      122 . 1 1 17 17 HIS H    H  1   7.135 0.002 . 1 . . . A  17 HIS H    . 18787 1 
      123 . 1 1 17 17 HIS HA   H  1   1.649 0.005 . 1 . . . A  17 HIS HA   . 18787 1 
      124 . 1 1 17 17 HIS HB2  H  1   0.789 0.005 . 1 . . . A  17 HIS HB2  . 18787 1 
      125 . 1 1 17 17 HIS HB3  H  1   1.424 0.005 . 1 . . . A  17 HIS HB3  . 18787 1 
      126 . 1 1 17 17 HIS HD1  H  1   8.713 0.004 . 1 . . . A  17 HIS HD1  . 18787 1 
      127 . 1 1 17 17 HIS HD2  H  1   0.514 0.003 . 1 . . . A  17 HIS HD2  . 18787 1 
      128 . 1 1 17 17 HIS HE1  H  1   1.173 0.002 . 1 . . . A  17 HIS HE1  . 18787 1 
      129 . 1 1 17 17 HIS N    N 15 132.791 0.000 . 1 . . . A  17 HIS N    . 18787 1 
      130 . 1 1 17 17 HIS ND1  N 15 166.378 0.000 . 1 . . . A  17 HIS ND1  . 18787 1 
      131 . 1 1 18 18 LYS H    H  1   7.446 0.003 . 1 . . . A  18 LYS H    . 18787 1 
      132 . 1 1 18 18 LYS HA   H  1   2.956 0.002 . 1 . . . A  18 LYS HA   . 18787 1 
      133 . 1 1 18 18 LYS HB2  H  1   1.125 0.002 . 1 . . . A  18 LYS HB2  . 18787 1 
      134 . 1 1 18 18 LYS HB3  H  1   1.297 0.004 . 1 . . . A  18 LYS HB3  . 18787 1 
      135 . 1 1 18 18 LYS HG2  H  1   0.812 0.003 . 1 . . . A  18 LYS HG2  . 18787 1 
      136 . 1 1 18 18 LYS HG3  H  1   0.868 0.001 . 1 . . . A  18 LYS HG3  . 18787 1 
      137 . 1 1 18 18 LYS HE2  H  1   2.576 0.003 . 1 . . . A  18 LYS HE2  . 18787 1 
      138 . 1 1 18 18 LYS N    N 15 119.290 0.000 . 1 . . . A  18 LYS N    . 18787 1 
      139 . 1 1 19 19 ALA H    H  1   7.305 0.003 . 1 . . . A  19 ALA H    . 18787 1 
      140 . 1 1 19 19 ALA HA   H  1   3.485 0.002 . 1 . . . A  19 ALA HA   . 18787 1 
      141 . 1 1 19 19 ALA HB1  H  1   0.775 0.003 . 1 . . . A  19 ALA HB1  . 18787 1 
      142 . 1 1 19 19 ALA HB2  H  1   0.775 0.003 . 1 . . . A  19 ALA HB2  . 18787 1 
      143 . 1 1 19 19 ALA HB3  H  1   0.775 0.003 . 1 . . . A  19 ALA HB3  . 18787 1 
      144 . 1 1 19 19 ALA N    N 15 120.287 0.000 . 1 . . . A  19 ALA N    . 18787 1 
      145 . 1 1 20 20 HIS H    H  1   6.618 0.002 . 1 . . . A  20 HIS H    . 18787 1 
      146 . 1 1 20 20 HIS HA   H  1   2.573 0.003 . 1 . . . A  20 HIS HA   . 18787 1 
      147 . 1 1 20 20 HIS HB2  H  1   1.046 0.004 . 1 . . . A  20 HIS HB2  . 18787 1 
      148 . 1 1 20 20 HIS HB3  H  1   1.424 0.005 . 1 . . . A  20 HIS HB3  . 18787 1 
      149 . 1 1 20 20 HIS HD1  H  1   8.255 0.003 . 1 . . . A  20 HIS HD1  . 18787 1 
      150 . 1 1 20 20 HIS HD2  H  1   1.000 0.003 . 1 . . . A  20 HIS HD2  . 18787 1 
      151 . 1 1 20 20 HIS HE1  H  1   1.096 0.005 . 1 . . . A  20 HIS HE1  . 18787 1 
      152 . 1 1 20 20 HIS N    N 15 116.668 0.000 . 1 . . . A  20 HIS N    . 18787 1 
      153 . 1 1 20 20 HIS ND1  N 15 161.858 0.000 . 1 . . . A  20 HIS ND1  . 18787 1 
      154 . 1 1 21 21 GLN H    H  1   7.026 0.004 . 1 . . . A  21 GLN H    . 18787 1 
      155 . 1 1 21 21 GLN HA   H  1   4.026 0.005 . 1 . . . A  21 GLN HA   . 18787 1 
      156 . 1 1 21 21 GLN HB2  H  1   1.691 0.003 . 1 . . . A  21 GLN HB2  . 18787 1 
      157 . 1 1 21 21 GLN HB3  H  1   1.480 0.004 . 1 . . . A  21 GLN HB3  . 18787 1 
      158 . 1 1 21 21 GLN HG2  H  1   0.544 0.003 . 1 . . . A  21 GLN HG2  . 18787 1 
      159 . 1 1 21 21 GLN HE21 H  1   2.041 0.005 . 1 . . . A  21 GLN HE21 . 18787 1 
      160 . 1 1 21 21 GLN HE22 H  1   5.082 0.004 . 1 . . . A  21 GLN HE22 . 18787 1 
      161 . 1 1 21 21 GLN N    N 15 117.664 0.000 . 1 . . . A  21 GLN N    . 18787 1 
      162 . 1 1 21 21 GLN NE2  N 15 106.875 0.004 . 1 . . . A  21 GLN NE2  . 18787 1 
      163 . 1 1 22 22 LYS H    H  1   6.749 0.007 . 1 . . . A  22 LYS H    . 18787 1 
      164 . 1 1 22 22 LYS HA   H  1   4.013 0.003 . 1 . . . A  22 LYS HA   . 18787 1 
      165 . 1 1 22 22 LYS HB2  H  1   1.575 0.004 . 1 . . . A  22 LYS HB2  . 18787 1 
      166 . 1 1 22 22 LYS HB3  H  1   1.658 0.004 . 1 . . . A  22 LYS HB3  . 18787 1 
      167 . 1 1 22 22 LYS HG2  H  1   1.246 0.005 . 1 . . . A  22 LYS HG2  . 18787 1 
      168 . 1 1 22 22 LYS HG3  H  1   1.328 0.003 . 1 . . . A  22 LYS HG3  . 18787 1 
      169 . 1 1 22 22 LYS HD2  H  1   1.499 0.002 . 1 . . . A  22 LYS HD2  . 18787 1 
      170 . 1 1 22 22 LYS HE2  H  1   2.763 0.006 . 1 . . . A  22 LYS HE2  . 18787 1 
      171 . 1 1 22 22 LYS N    N 15 115.540 0.000 . 1 . . . A  22 LYS N    . 18787 1 
      172 . 1 1 23 23 ALA H    H  1   7.009 0.005 . 1 . . . A  23 ALA H    . 18787 1 
      173 . 1 1 23 23 ALA HA   H  1   4.246 0.003 . 1 . . . A  23 ALA HA   . 18787 1 
      174 . 1 1 23 23 ALA HB1  H  1   1.240 0.003 . 1 . . . A  23 ALA HB1  . 18787 1 
      175 . 1 1 23 23 ALA HB2  H  1   1.240 0.003 . 1 . . . A  23 ALA HB2  . 18787 1 
      176 . 1 1 23 23 ALA HB3  H  1   1.240 0.003 . 1 . . . A  23 ALA HB3  . 18787 1 
      177 . 1 1 23 23 ALA N    N 15 120.162 0.000 . 1 . . . A  23 ALA N    . 18787 1 
      178 . 1 1 24 24 VAL H    H  1   8.228 0.004 . 1 . . . A  24 VAL H    . 18787 1 
      179 . 1 1 24 24 VAL HA   H  1   4.614 0.003 . 1 . . . A  24 VAL HA   . 18787 1 
      180 . 1 1 24 24 VAL HB   H  1   2.632 0.003 . 1 . . . A  24 VAL HB   . 18787 1 
      181 . 1 1 24 24 VAL HG11 H  1   1.474 0.003 . 1 . . . A  24 VAL QG1  . 18787 1 
      182 . 1 1 24 24 VAL HG12 H  1   1.474 0.003 . 1 . . . A  24 VAL QG1  . 18787 1 
      183 . 1 1 24 24 VAL HG13 H  1   1.474 0.003 . 1 . . . A  24 VAL HG13 . 18787 1 
      184 . 1 1 24 24 VAL HG21 H  1   1.199 0.002 . 1 . . . A  24 VAL HG21 . 18787 1 
      185 . 1 1 24 24 VAL HG22 H  1   1.199 0.002 . 1 . . . A  24 VAL QG2  . 18787 1 
      186 . 1 1 24 24 VAL HG23 H  1   1.199 0.002 . 1 . . . A  24 VAL QG2  . 18787 1 
      187 . 1 1 24 24 VAL N    N 15 120.084 0.000 . 1 . . . A  24 VAL N    . 18787 1 
      188 . 1 1 25 25 PRO HA   H  1   4.755 0.000 . 1 . . . A  25 PRO HA   . 18787 1 
      189 . 1 1 25 25 PRO HB2  H  1   2.169 0.004 . 1 . . . A  25 PRO HB2  . 18787 1 
      190 . 1 1 25 25 PRO HB3  H  1   2.410 0.003 . 1 . . . A  25 PRO HB3  . 18787 1 
      191 . 1 1 25 25 PRO HG2  H  1   2.107 0.003 . 1 . . . A  25 PRO HG2  . 18787 1 
      192 . 1 1 25 25 PRO HD2  H  1   3.663 0.003 . 1 . . . A  25 PRO HD2  . 18787 1 
      193 . 1 1 25 25 PRO HD3  H  1   3.890 0.002 . 1 . . . A  25 PRO HD3  . 18787 1 
      194 . 1 1 26 26 ASP H    H  1   7.790 0.002 . 1 . . . A  26 ASP H    . 18787 1 
      195 . 1 1 26 26 ASP HA   H  1   5.084 0.007 . 1 . . . A  26 ASP HA   . 18787 1 
      196 . 1 1 26 26 ASP HB2  H  1   2.795 0.010 . 1 . . . A  26 ASP HB2  . 18787 1 
      197 . 1 1 26 26 ASP HB3  H  1   2.971 0.005 . 1 . . . A  26 ASP HB3  . 18787 1 
      198 . 1 1 26 26 ASP N    N 15 116.823 0.000 . 1 . . . A  26 ASP N    . 18787 1 
      199 . 1 1 27 27 CYS H    H  1   8.561 0.012 . 1 . . . A  27 CYS H    . 18787 1 
      200 . 1 1 27 27 CYS HA   H  1   4.955 0.048 . 1 . . . A  27 CYS HA   . 18787 1 
      201 . 1 1 27 27 CYS HB2  H  1   2.562 0.003 . 1 . . . A  27 CYS HB2  . 18787 1 
      202 . 1 1 27 27 CYS HB3  H  1   2.452 0.008 . 1 . . . A  27 CYS HB3  . 18787 1 
      203 . 1 1 27 27 CYS N    N 15 123.015 0.000 . 1 . . . A  27 CYS N    . 18787 1 
      204 . 1 1 28 28 LYS H    H  1   8.139 0.002 . 1 . . . A  28 LYS H    . 18787 1 
      205 . 1 1 28 28 LYS HA   H  1   3.517 0.002 . 1 . . . A  28 LYS HA   . 18787 1 
      206 . 1 1 28 28 LYS HB2  H  1   1.252 0.003 . 1 . . . A  28 LYS HB2  . 18787 1 
      207 . 1 1 28 28 LYS HB3  H  1   1.728 0.003 . 1 . . . A  28 LYS HB3  . 18787 1 
      208 . 1 1 28 28 LYS HG2  H  1   1.622 0.003 . 1 . . . A  28 LYS HG2  . 18787 1 
      209 . 1 1 28 28 LYS HG3  H  1   1.337 0.002 . 1 . . . A  28 LYS HG3  . 18787 1 
      210 . 1 1 28 28 LYS HD2  H  1   1.647 0.003 . 1 . . . A  28 LYS HD2  . 18787 1 
      211 . 1 1 28 28 LYS HE2  H  1   2.915 0.005 . 1 . . . A  28 LYS HE2  . 18787 1 
      212 . 1 1 28 28 LYS N    N 15 115.314 0.000 . 1 . . . A  28 LYS N    . 18787 1 
      213 . 1 1 29 29 LYS H    H  1   7.727 0.004 . 1 . . . A  29 LYS H    . 18787 1 
      214 . 1 1 29 29 LYS HA   H  1   4.081 0.003 . 1 . . . A  29 LYS HA   . 18787 1 
      215 . 1 1 29 29 LYS HB2  H  1   1.916 0.001 . 1 . . . A  29 LYS HB2  . 18787 1 
      216 . 1 1 29 29 LYS HB3  H  1   2.158 0.005 . 1 . . . A  29 LYS HB3  . 18787 1 
      217 . 1 1 29 29 LYS HG2  H  1   1.822 0.000 . 1 . . . A  29 LYS HG2  . 18787 1 
      218 . 1 1 29 29 LYS HG3  H  1   2.234 0.005 . 1 . . . A  29 LYS HG3  . 18787 1 
      219 . 1 1 29 29 LYS HD2  H  1   2.006 0.003 . 1 . . . A  29 LYS HD2  . 18787 1 
      220 . 1 1 29 29 LYS HD3  H  1   2.077 0.002 . 1 . . . A  29 LYS HD3  . 18787 1 
      221 . 1 1 29 29 LYS N    N 15 118.227 0.000 . 1 . . . A  29 LYS N    . 18787 1 
      222 . 1 1 30 30 CYS H    H  1   6.391 0.004 . 1 . . . A  30 CYS H    . 18787 1 
      223 . 1 1 30 30 CYS HA   H  1   4.716 0.002 . 1 . . . A  30 CYS HA   . 18787 1 
      224 . 1 1 30 30 CYS HB2  H  1   1.105 0.004 . 1 . . . A  30 CYS HB2  . 18787 1 
      225 . 1 1 30 30 CYS HB3  H  1   2.203 0.002 . 1 . . . A  30 CYS HB3  . 18787 1 
      226 . 1 1 30 30 CYS N    N 15 111.351 0.000 . 1 . . . A  30 CYS N    . 18787 1 
      227 . 1 1 31 31 HIS H    H  1   7.187 0.002 . 1 . . . A  31 HIS H    . 18787 1 
      228 . 1 1 31 31 HIS HA   H  1   3.143 0.005 . 1 . . . A  31 HIS HA   . 18787 1 
      229 . 1 1 31 31 HIS HB2  H  1   0.923 0.010 . 1 . . . A  31 HIS HB2  . 18787 1 
      230 . 1 1 31 31 HIS HB3  H  1   0.861 0.005 . 1 . . . A  31 HIS HB3  . 18787 1 
      231 . 1 1 31 31 HIS HD1  H  1   8.429 0.003 . 1 . . . A  31 HIS HD1  . 18787 1 
      232 . 1 1 31 31 HIS HD2  H  1   0.446 0.021 . 1 . . . A  31 HIS HD2  . 18787 1 
      233 . 1 1 31 31 HIS HE1  H  1   1.310 0.002 . 1 . . . A  31 HIS HE1  . 18787 1 
      234 . 1 1 31 31 HIS N    N 15 118.380 0.000 . 1 . . . A  31 HIS N    . 18787 1 
      235 . 1 1 31 31 HIS ND1  N 15 163.742 0.000 . 1 . . . A  31 HIS ND1  . 18787 1 
      236 . 1 1 32 32 GLU H    H  1   7.993 0.004 . 1 . . . A  32 GLU H    . 18787 1 
      237 . 1 1 32 32 GLU HA   H  1   3.742 0.003 . 1 . . . A  32 GLU HA   . 18787 1 
      238 . 1 1 32 32 GLU HB2  H  1   1.753 0.005 . 1 . . . A  32 GLU HB2  . 18787 1 
      239 . 1 1 32 32 GLU HB3  H  1   1.843 0.028 . 1 . . . A  32 GLU HB3  . 18787 1 
      240 . 1 1 32 32 GLU HG2  H  1   2.076 0.004 . 1 . . . A  32 GLU HG2  . 18787 1 
      241 . 1 1 32 32 GLU N    N 15 125.425 0.000 . 1 . . . A  32 GLU N    . 18787 1 
      242 . 1 1 33 33 LYS H    H  1   8.269 0.003 . 1 . . . A  33 LYS H    . 18787 1 
      243 . 1 1 33 33 LYS HA   H  1   4.238 0.004 . 1 . . . A  33 LYS HA   . 18787 1 
      244 . 1 1 33 33 LYS HB2  H  1   1.446 0.005 . 1 . . . A  33 LYS HB2  . 18787 1 
      245 . 1 1 33 33 LYS HB3  H  1   1.891 0.003 . 1 . . . A  33 LYS HB3  . 18787 1 
      246 . 1 1 33 33 LYS HG2  H  1   1.198 0.002 . 1 . . . A  33 LYS HG2  . 18787 1 
      247 . 1 1 33 33 LYS HG3  H  1   1.311 0.002 . 1 . . . A  33 LYS HG3  . 18787 1 
      248 . 1 1 33 33 LYS HD2  H  1   1.534 0.002 . 1 . . . A  33 LYS HD2  . 18787 1 
      249 . 1 1 33 33 LYS HE2  H  1   2.869 0.002 . 1 . . . A  33 LYS HE2  . 18787 1 
      250 . 1 1 33 33 LYS N    N 15 114.958 0.000 . 1 . . . A  33 LYS N    . 18787 1 
      251 . 1 1 34 34 GLY H    H  1   6.687 0.004 . 1 . . . A  34 GLY H    . 18787 1 
      252 . 1 1 34 34 GLY HA2  H  1   4.031 0.007 . 1 . . . A  34 GLY HA2  . 18787 1 
      253 . 1 1 34 34 GLY HA3  H  1   3.356 0.005 . 1 . . . A  34 GLY HA3  . 18787 1 
      254 . 1 1 34 34 GLY N    N 15 107.549 0.000 . 1 . . . A  34 GLY N    . 18787 1 
      255 . 1 1 35 35 PRO HA   H  1   0.774 0.005 . 1 . . . A  35 PRO HA   . 18787 1 
      256 . 1 1 35 35 PRO HB2  H  1   1.651 0.001 . 1 . . . A  35 PRO HB2  . 18787 1 
      257 . 1 1 35 35 PRO HB3  H  1   1.669 0.001 . 1 . . . A  35 PRO HB3  . 18787 1 
      258 . 1 1 35 35 PRO HG2  H  1   1.169 0.006 . 1 . . . A  35 PRO HG2  . 18787 1 
      259 . 1 1 35 35 PRO HG3  H  1   2.054 0.002 . 1 . . . A  35 PRO HG3  . 18787 1 
      260 . 1 1 35 35 PRO HD2  H  1   3.115 0.005 . 1 . . . A  35 PRO HD2  . 18787 1 
      261 . 1 1 35 35 PRO HD3  H  1   3.215 0.006 . 1 . . . A  35 PRO HD3  . 18787 1 
      262 . 1 1 36 36 GLY H    H  1   3.990 0.004 . 1 . . . A  36 GLY H    . 18787 1 
      263 . 1 1 36 36 GLY HA2  H  1   3.992 0.003 . 1 . . . A  36 GLY HA2  . 18787 1 
      264 . 1 1 36 36 GLY HA3  H  1   3.276 0.013 . 1 . . . A  36 GLY HA3  . 18787 1 
      265 . 1 1 36 36 GLY N    N 15 108.941 0.000 . 1 . . . A  36 GLY N    . 18787 1 
      266 . 1 1 37 37 LYS H    H  1   7.939 0.002 . 1 . . . A  37 LYS H    . 18787 1 
      267 . 1 1 37 37 LYS HA   H  1   4.080 0.003 . 1 . . . A  37 LYS HA   . 18787 1 
      268 . 1 1 37 37 LYS HB2  H  1   1.681 0.004 . 1 . . . A  37 LYS HB2  . 18787 1 
      269 . 1 1 37 37 LYS HG2  H  1   1.596 0.005 . 1 . . . A  37 LYS HG2  . 18787 1 
      270 . 1 1 37 37 LYS HG3  H  1   1.759 0.004 . 1 . . . A  37 LYS HG3  . 18787 1 
      271 . 1 1 37 37 LYS N    N 15 117.153 0.000 . 1 . . . A  37 LYS N    . 18787 1 
      272 . 1 1 38 38 ILE H    H  1  10.189 0.005 . 1 . . . A  38 ILE H    . 18787 1 
      273 . 1 1 38 38 ILE HA   H  1   3.731 0.004 . 1 . . . A  38 ILE HA   . 18787 1 
      274 . 1 1 38 38 ILE HB   H  1   1.593 0.004 . 1 . . . A  38 ILE HB   . 18787 1 
      275 . 1 1 38 38 ILE HG12 H  1  -0.216 0.003 . 1 . . . A  38 ILE HG12 . 18787 1 
      276 . 1 1 38 38 ILE HG13 H  1   0.625 0.004 . 1 . . . A  38 ILE HG13 . 18787 1 
      277 . 1 1 38 38 ILE HG21 H  1   0.849 0.003 . 1 . . . A  38 ILE QG2  . 18787 1 
      278 . 1 1 38 38 ILE HG22 H  1   0.849 0.003 . 1 . . . A  38 ILE QG2  . 18787 1 
      279 . 1 1 38 38 ILE HG23 H  1   0.849 0.003 . 1 . . . A  38 ILE HG23 . 18787 1 
      280 . 1 1 38 38 ILE HD11 H  1  -0.560 0.003 . 1 . . . A  38 ILE HD11 . 18787 1 
      281 . 1 1 38 38 ILE HD12 H  1  -0.560 0.003 . 1 . . . A  38 ILE QD1  . 18787 1 
      282 . 1 1 38 38 ILE HD13 H  1  -0.560 0.003 . 1 . . . A  38 ILE QD1  . 18787 1 
      283 . 1 1 38 38 ILE N    N 15 128.347 0.000 . 1 . . . A  38 ILE N    . 18787 1 
      284 . 1 1 39 39 GLU H    H  1   8.648 0.002 . 1 . . . A  39 GLU H    . 18787 1 
      285 . 1 1 39 39 GLU HA   H  1   4.091 0.002 . 1 . . . A  39 GLU HA   . 18787 1 
      286 . 1 1 39 39 GLU HB2  H  1   1.910 0.005 . 1 . . . A  39 GLU HB2  . 18787 1 
      287 . 1 1 39 39 GLU HG2  H  1   2.206 0.003 . 1 . . . A  39 GLU HG2  . 18787 1 
      288 . 1 1 39 39 GLU N    N 15 130.732 0.000 . 1 . . . A  39 GLU N    . 18787 1 
      289 . 1 1 40 40 GLY H    H  1   9.180 0.003 . 1 . . . A  40 GLY H    . 18787 1 
      290 . 1 1 40 40 GLY HA2  H  1   4.110 0.023 . 1 . . . A  40 GLY HA2  . 18787 1 
      291 . 1 1 40 40 GLY HA3  H  1   3.831 0.002 . 1 . . . A  40 GLY HA3  . 18787 1 
      292 . 1 1 40 40 GLY N    N 15 113.178 0.000 . 1 . . . A  40 GLY N    . 18787 1 
      293 . 1 1 41 41 PHE H    H  1   8.009 0.003 . 1 . . . A  41 PHE H    . 18787 1 
      294 . 1 1 41 41 PHE HA   H  1   4.484 0.005 . 1 . . . A  41 PHE HA   . 18787 1 
      295 . 1 1 41 41 PHE HB2  H  1   3.326 0.003 . 1 . . . A  41 PHE HB2  . 18787 1 
      296 . 1 1 41 41 PHE HB3  H  1   3.372 0.003 . 1 . . . A  41 PHE HB3  . 18787 1 
      297 . 1 1 41 41 PHE HD1  H  1   7.751 0.002 . 1 . . . A  41 PHE HD1  . 18787 1 
      298 . 1 1 41 41 PHE HE1  H  1   8.155 0.004 . 1 . . . A  41 PHE HE1  . 18787 1 
      299 . 1 1 41 41 PHE HZ   H  1   8.434 0.003 . 1 . . . A  41 PHE HZ   . 18787 1 
      300 . 1 1 41 41 PHE N    N 15 121.641 0.000 . 1 . . . A  41 PHE N    . 18787 1 
      301 . 1 1 42 42 GLY H    H  1   5.985 0.001 . 1 . . . A  42 GLY H    . 18787 1 
      302 . 1 1 42 42 GLY HA2  H  1   1.795 0.001 . 1 . . . A  42 GLY HA2  . 18787 1 
      303 . 1 1 42 42 GLY HA3  H  1   4.330 0.005 . 1 . . . A  42 GLY HA3  . 18787 1 
      304 . 1 1 42 42 GLY N    N 15 114.323 0.000 . 1 . . . A  42 GLY N    . 18787 1 
      305 . 1 1 43 43 LYS H    H  1   8.990 0.004 . 1 . . . A  43 LYS H    . 18787 1 
      306 . 1 1 43 43 LYS HA   H  1   2.366 0.003 . 1 . . . A  43 LYS HA   . 18787 1 
      307 . 1 1 43 43 LYS HB2  H  1   1.376 0.004 . 1 . . . A  43 LYS HB2  . 18787 1 
      308 . 1 1 43 43 LYS HB3  H  1   1.224 0.005 . 1 . . . A  43 LYS HB3  . 18787 1 
      309 . 1 1 43 43 LYS HG2  H  1  -1.292 0.005 . 1 . . . A  43 LYS HG2  . 18787 1 
      310 . 1 1 43 43 LYS HG3  H  1   1.538 0.003 . 1 . . . A  43 LYS HG3  . 18787 1 
      311 . 1 1 43 43 LYS HD2  H  1   1.281 0.003 . 1 . . . A  43 LYS HD2  . 18787 1 
      312 . 1 1 43 43 LYS HD3  H  1  -0.517 0.004 . 1 . . . A  43 LYS HD3  . 18787 1 
      313 . 1 1 43 43 LYS HE2  H  1   2.227 0.007 . 1 . . . A  43 LYS HE2  . 18787 1 
      314 . 1 1 43 43 LYS HE3  H  1   2.309 0.005 . 1 . . . A  43 LYS HE3  . 18787 1 
      315 . 1 1 43 43 LYS N    N 15 122.849 0.000 . 1 . . . A  43 LYS N    . 18787 1 
      316 . 1 1 44 44 GLU H    H  1   8.112 0.003 . 1 . . . A  44 GLU H    . 18787 1 
      317 . 1 1 44 44 GLU HA   H  1   3.154 0.004 . 1 . . . A  44 GLU HA   . 18787 1 
      318 . 1 1 44 44 GLU HB2  H  1   1.650 0.003 . 1 . . . A  44 GLU HB2  . 18787 1 
      319 . 1 1 44 44 GLU HB3  H  1   1.701 0.002 . 1 . . . A  44 GLU HB3  . 18787 1 
      320 . 1 1 44 44 GLU HG2  H  1   1.986 0.003 . 1 . . . A  44 GLU HG2  . 18787 1 
      321 . 1 1 44 44 GLU HG3  H  1   2.033 0.004 . 1 . . . A  44 GLU HG3  . 18787 1 
      322 . 1 1 44 44 GLU N    N 15 115.299 0.000 . 1 . . . A  44 GLU N    . 18787 1 
      323 . 1 1 45 45 MET H    H  1   7.584 0.002 . 1 . . . A  45 MET H    . 18787 1 
      324 . 1 1 45 45 MET HA   H  1   3.998 0.003 . 1 . . . A  45 MET HA   . 18787 1 
      325 . 1 1 45 45 MET HB2  H  1   2.490 0.002 . 1 . . . A  45 MET HB2  . 18787 1 
      326 . 1 1 45 45 MET HB3  H  1   1.793 0.006 . 1 . . . A  45 MET HB3  . 18787 1 
      327 . 1 1 45 45 MET HG2  H  1   2.659 0.002 . 1 . . . A  45 MET HG2  . 18787 1 
      328 . 1 1 45 45 MET N    N 15 117.944 0.000 . 1 . . . A  45 MET N    . 18787 1 
      329 . 1 1 46 46 ALA H    H  1   7.902 0.003 . 1 . . . A  46 ALA H    . 18787 1 
      330 . 1 1 46 46 ALA HA   H  1   4.186 0.003 . 1 . . . A  46 ALA HA   . 18787 1 
      331 . 1 1 46 46 ALA HB1  H  1   0.902 0.003 . 1 . . . A  46 ALA HB1  . 18787 1 
      332 . 1 1 46 46 ALA HB2  H  1   0.902 0.003 . 1 . . . A  46 ALA HB2  . 18787 1 
      333 . 1 1 46 46 ALA HB3  H  1   0.902 0.003 . 1 . . . A  46 ALA HB3  . 18787 1 
      334 . 1 1 46 46 ALA N    N 15 121.955 0.000 . 1 . . . A  46 ALA N    . 18787 1 
      335 . 1 1 47 47 HIS H    H  1   7.104 0.003 . 1 . . . A  47 HIS H    . 18787 1 
      336 . 1 1 47 47 HIS HA   H  1   2.787 0.006 . 1 . . . A  47 HIS HA   . 18787 1 
      337 . 1 1 47 47 HIS HB2  H  1   1.453 0.005 . 1 . . . A  47 HIS HB2  . 18787 1 
      338 . 1 1 47 47 HIS HB3  H  1   1.571 0.004 . 1 . . . A  47 HIS HB3  . 18787 1 
      339 . 1 1 47 47 HIS HD1  H  1   9.473 0.003 . 1 . . . A  47 HIS HD1  . 18787 1 
      340 . 1 1 47 47 HIS HD2  H  1   0.723 0.003 . 1 . . . A  47 HIS HD2  . 18787 1 
      341 . 1 1 47 47 HIS N    N 15 113.351 0.000 . 1 . . . A  47 HIS N    . 18787 1 
      342 . 1 1 47 47 HIS ND1  N 15 164.618 0.000 . 1 . . . A  47 HIS ND1  . 18787 1 
      343 . 1 1 48 48 GLY H    H  1   6.696 0.004 . 1 . . . A  48 GLY H    . 18787 1 
      344 . 1 1 48 48 GLY HA2  H  1   4.060 0.007 . 1 . . . A  48 GLY HA2  . 18787 1 
      345 . 1 1 48 48 GLY HA3  H  1   3.384 0.006 . 1 . . . A  48 GLY HA3  . 18787 1 
      346 . 1 1 48 48 GLY N    N 15 109.160 0.000 . 1 . . . A  48 GLY N    . 18787 1 
      347 . 1 1 49 49 LYS H    H  1   8.734 0.003 . 1 . . . A  49 LYS H    . 18787 1 
      348 . 1 1 49 49 LYS HA   H  1   3.761 0.003 . 1 . . . A  49 LYS HA   . 18787 1 
      349 . 1 1 49 49 LYS HB2  H  1   1.895 0.004 . 1 . . . A  49 LYS HB2  . 18787 1 
      350 . 1 1 49 49 LYS HG2  H  1   1.490 0.004 . 1 . . . A  49 LYS HG2  . 18787 1 
      351 . 1 1 49 49 LYS HD2  H  1   1.665 0.001 . 1 . . . A  49 LYS HD2  . 18787 1 
      352 . 1 1 49 49 LYS N    N 15 124.625 0.000 . 1 . . . A  49 LYS N    . 18787 1 
      353 . 1 1 50 50 GLY H    H  1   8.456 0.004 . 1 . . . A  50 GLY H    . 18787 1 
      354 . 1 1 50 50 GLY HA2  H  1   4.448 0.008 . 1 . . . A  50 GLY HA2  . 18787 1 
      355 . 1 1 50 50 GLY HA3  H  1   3.865 0.003 . 1 . . . A  50 GLY HA3  . 18787 1 
      356 . 1 1 50 50 GLY N    N 15 105.576 0.000 . 1 . . . A  50 GLY N    . 18787 1 
      357 . 1 1 51 51 CYS H    H  1   6.733 0.004 . 1 . . . A  51 CYS H    . 18787 1 
      358 . 1 1 51 51 CYS HA   H  1   5.596 0.003 . 1 . . . A  51 CYS HA   . 18787 1 
      359 . 1 1 51 51 CYS HB2  H  1   3.674 0.008 . 1 . . . A  51 CYS HB2  . 18787 1 
      360 . 1 1 51 51 CYS HB3  H  1   2.658 0.004 . 1 . . . A  51 CYS HB3  . 18787 1 
      361 . 1 1 51 51 CYS N    N 15 111.492 0.000 . 1 . . . A  51 CYS N    . 18787 1 
      362 . 1 1 52 52 LYS H    H  1   7.982 0.002 . 1 . . . A  52 LYS H    . 18787 1 
      363 . 1 1 52 52 LYS HA   H  1   2.538 0.005 . 1 . . . A  52 LYS HA   . 18787 1 
      364 . 1 1 52 52 LYS HB2  H  1   1.311 0.004 . 1 . . . A  52 LYS HB2  . 18787 1 
      365 . 1 1 52 52 LYS HG2  H  1   1.064 0.002 . 1 . . . A  52 LYS HG2  . 18787 1 
      366 . 1 1 52 52 LYS HG3  H  1   1.101 0.005 . 1 . . . A  52 LYS HG3  . 18787 1 
      367 . 1 1 52 52 LYS N    N 15 120.106 0.000 . 1 . . . A  52 LYS N    . 18787 1 
      368 . 1 1 53 53 GLY H    H  1   8.436 0.004 . 1 . . . A  53 GLY H    . 18787 1 
      369 . 1 1 53 53 GLY HA2  H  1   3.440 0.085 . 1 . . . A  53 GLY HA2  . 18787 1 
      370 . 1 1 53 53 GLY HA3  H  1   3.547 0.086 . 1 . . . A  53 GLY HA3  . 18787 1 
      371 . 1 1 53 53 GLY N    N 15 102.100 0.000 . 1 . . . A  53 GLY N    . 18787 1 
      372 . 1 1 54 54 CYS H    H  1   6.596 0.004 . 1 . . . A  54 CYS H    . 18787 1 
      373 . 1 1 54 54 CYS HA   H  1   4.416 0.004 . 1 . . . A  54 CYS HA   . 18787 1 
      374 . 1 1 54 54 CYS HB2  H  1   2.401 0.002 . 1 . . . A  54 CYS HB2  . 18787 1 
      375 . 1 1 54 54 CYS HB3  H  1   3.640 0.006 . 1 . . . A  54 CYS HB3  . 18787 1 
      376 . 1 1 54 54 CYS N    N 15 121.145 0.000 . 1 . . . A  54 CYS N    . 18787 1 
      377 . 1 1 55 55 HIS H    H  1   5.393 0.004 . 1 . . . A  55 HIS H    . 18787 1 
      378 . 1 1 55 55 HIS HA   H  1   3.725 0.003 . 1 . . . A  55 HIS HA   . 18787 1 
      379 . 1 1 55 55 HIS HB2  H  1   1.620 0.003 . 1 . . . A  55 HIS HB2  . 18787 1 
      380 . 1 1 55 55 HIS HB3  H  1   1.388 0.006 . 1 . . . A  55 HIS HB3  . 18787 1 
      381 . 1 1 55 55 HIS HD1  H  1   9.478 0.004 . 1 . . . A  55 HIS HD1  . 18787 1 
      382 . 1 1 55 55 HIS HD2  H  1   0.980 0.003 . 1 . . . A  55 HIS HD2  . 18787 1 
      383 . 1 1 55 55 HIS HE1  H  1   1.506 0.006 . 1 . . . A  55 HIS HE1  . 18787 1 
      384 . 1 1 55 55 HIS N    N 15 117.698 0.000 . 1 . . . A  55 HIS N    . 18787 1 
      385 . 1 1 55 55 HIS ND1  N 15 164.667 0.000 . 1 . . . A  55 HIS ND1  . 18787 1 
      386 . 1 1 56 56 GLU H    H  1   8.000 0.003 . 1 . . . A  56 GLU H    . 18787 1 
      387 . 1 1 56 56 GLU HA   H  1   3.653 0.003 . 1 . . . A  56 GLU HA   . 18787 1 
      388 . 1 1 56 56 GLU HB2  H  1   1.960 0.004 . 1 . . . A  56 GLU HB2  . 18787 1 
      389 . 1 1 56 56 GLU HB3  H  1   1.792 0.007 . 1 . . . A  56 GLU HB3  . 18787 1 
      390 . 1 1 56 56 GLU HG2  H  1   1.873 0.002 . 1 . . . A  56 GLU HG2  . 18787 1 
      391 . 1 1 56 56 GLU HG3  H  1   2.111 0.002 . 1 . . . A  56 GLU HG3  . 18787 1 
      392 . 1 1 56 56 GLU N    N 15 117.010 0.000 . 1 . . . A  56 GLU N    . 18787 1 
      393 . 1 1 57 57 GLU H    H  1   7.584 0.003 . 1 . . . A  57 GLU H    . 18787 1 
      394 . 1 1 57 57 GLU HA   H  1   4.032 0.002 . 1 . . . A  57 GLU HA   . 18787 1 
      395 . 1 1 57 57 GLU HB2  H  1   2.214 0.002 . 1 . . . A  57 GLU HB2  . 18787 1 
      396 . 1 1 57 57 GLU HG2  H  1   2.331 0.002 . 1 . . . A  57 GLU HG2  . 18787 1 
      397 . 1 1 57 57 GLU HG3  H  1   2.400 0.002 . 1 . . . A  57 GLU HG3  . 18787 1 
      398 . 1 1 57 57 GLU N    N 15 120.653 0.000 . 1 . . . A  57 GLU N    . 18787 1 
      399 . 1 1 58 58 MET H    H  1   8.807 0.002 . 1 . . . A  58 MET H    . 18787 1 
      400 . 1 1 58 58 MET HA   H  1   4.404 0.006 . 1 . . . A  58 MET HA   . 18787 1 
      401 . 1 1 58 58 MET HB2  H  1   2.281 0.004 . 1 . . . A  58 MET HB2  . 18787 1 
      402 . 1 1 58 58 MET HB3  H  1   2.405 0.006 . 1 . . . A  58 MET HB3  . 18787 1 
      403 . 1 1 58 58 MET HG2  H  1   3.003 0.008 . 1 . . . A  58 MET HG2  . 18787 1 
      404 . 1 1 58 58 MET HG3  H  1   3.426 0.003 . 1 . . . A  58 MET HG3  . 18787 1 
      405 . 1 1 58 58 MET HE1  H  1   2.647 0.001 . 1 . . . A  58 MET HE1  . 18787 1 
      406 . 1 1 58 58 MET HE2  H  1   2.647 0.001 . 1 . . . A  58 MET HE2  . 18787 1 
      407 . 1 1 58 58 MET HE3  H  1   2.647 0.001 . 1 . . . A  58 MET HE3  . 18787 1 
      408 . 1 1 58 58 MET N    N 15 115.249 0.000 . 1 . . . A  58 MET N    . 18787 1 
      409 . 1 1 59 59 LYS H    H  1   7.700 0.003 . 1 . . . A  59 LYS H    . 18787 1 
      410 . 1 1 59 59 LYS HA   H  1   3.736 0.003 . 1 . . . A  59 LYS HA   . 18787 1 
      411 . 1 1 59 59 LYS HB2  H  1   2.173 0.005 . 1 . . . A  59 LYS HB2  . 18787 1 
      412 . 1 1 59 59 LYS HB3  H  1   1.393 0.005 . 1 . . . A  59 LYS HB3  . 18787 1 
      413 . 1 1 59 59 LYS HG2  H  1   1.353 0.005 . 1 . . . A  59 LYS HG2  . 18787 1 
      414 . 1 1 59 59 LYS HD2  H  1   1.963 0.004 . 1 . . . A  59 LYS HD2  . 18787 1 
      415 . 1 1 59 59 LYS N    N 15 114.434 0.000 . 1 . . . A  59 LYS N    . 18787 1 
      416 . 1 1 60 60 LYS H    H  1   7.631 0.004 . 1 . . . A  60 LYS H    . 18787 1 
      417 . 1 1 60 60 LYS HA   H  1   4.315 0.003 . 1 . . . A  60 LYS HA   . 18787 1 
      418 . 1 1 60 60 LYS HB2  H  1   1.686 0.006 . 1 . . . A  60 LYS HB2  . 18787 1 
      419 . 1 1 60 60 LYS HB3  H  1   2.099 0.005 . 1 . . . A  60 LYS HB3  . 18787 1 
      420 . 1 1 60 60 LYS HG2  H  1   1.650 0.003 . 1 . . . A  60 LYS HG2  . 18787 1 
      421 . 1 1 60 60 LYS HD2  H  1   1.956 0.001 . 1 . . . A  60 LYS HD2  . 18787 1 
      422 . 1 1 60 60 LYS HE2  H  1   3.287 0.001 . 1 . . . A  60 LYS HE2  . 18787 1 
      423 . 1 1 60 60 LYS N    N 15 118.674 0.000 . 1 . . . A  60 LYS N    . 18787 1 
      424 . 1 1 61 61 GLY H    H  1   7.600 0.006 . 1 . . . A  61 GLY H    . 18787 1 
      425 . 1 1 61 61 GLY HA2  H  1   2.622 0.007 . 1 . . . A  61 GLY HA2  . 18787 1 
      426 . 1 1 61 61 GLY HA3  H  1   1.314 0.004 . 1 . . . A  61 GLY HA3  . 18787 1 
      427 . 1 1 61 61 GLY N    N 15 104.053 0.000 . 1 . . . A  61 GLY N    . 18787 1 
      428 . 1 1 62 62 PRO HA   H  1   3.968 0.005 . 1 . . . A  62 PRO HA   . 18787 1 
      429 . 1 1 62 62 PRO HB2  H  1   1.966 0.004 . 1 . . . A  62 PRO HB2  . 18787 1 
      430 . 1 1 62 62 PRO HG2  H  1   0.917 0.003 . 1 . . . A  62 PRO HG2  . 18787 1 
      431 . 1 1 62 62 PRO HG3  H  1   1.803 0.004 . 1 . . . A  62 PRO HG3  . 18787 1 
      432 . 1 1 62 62 PRO HD2  H  1  -0.905 0.004 . 1 . . . A  62 PRO HD2  . 18787 1 
      433 . 1 1 62 62 PRO HD3  H  1   2.420 0.003 . 1 . . . A  62 PRO HD3  . 18787 1 
      434 . 1 1 63 63 THR H    H  1   8.296 0.005 . 1 . . . A  63 THR H    . 18787 1 
      435 . 1 1 63 63 THR HA   H  1   4.411 0.005 . 1 . . . A  63 THR HA   . 18787 1 
      436 . 1 1 63 63 THR HB   H  1   4.247 0.002 . 1 . . . A  63 THR HB   . 18787 1 
      437 . 1 1 63 63 THR HG21 H  1   0.694 0.003 . 1 . . . A  63 THR HG21 . 18787 1 
      438 . 1 1 63 63 THR HG22 H  1   0.694 0.003 . 1 . . . A  63 THR QG2  . 18787 1 
      439 . 1 1 63 63 THR HG23 H  1   0.694 0.003 . 1 . . . A  63 THR QG2  . 18787 1 
      440 . 1 1 63 63 THR N    N 15 108.819 0.000 . 1 . . . A  63 THR N    . 18787 1 
      441 . 1 1 64 64 LYS H    H  1   8.449 0.003 . 1 . . . A  64 LYS H    . 18787 1 
      442 . 1 1 64 64 LYS HA   H  1   5.172 0.002 . 1 . . . A  64 LYS HA   . 18787 1 
      443 . 1 1 64 64 LYS HB2  H  1   1.688 0.005 . 1 . . . A  64 LYS HB2  . 18787 1 
      444 . 1 1 64 64 LYS HB3  H  1   2.148 0.004 . 1 . . . A  64 LYS HB3  . 18787 1 
      445 . 1 1 64 64 LYS HG2  H  1   1.544 0.006 . 1 . . . A  64 LYS HG2  . 18787 1 
      446 . 1 1 64 64 LYS HG3  H  1   1.578 0.004 . 1 . . . A  64 LYS HG3  . 18787 1 
      447 . 1 1 64 64 LYS HD2  H  1   1.686 0.005 . 1 . . . A  64 LYS HD2  . 18787 1 
      448 . 1 1 64 64 LYS N    N 15 124.202 0.000 . 1 . . . A  64 LYS N    . 18787 1 
      449 . 1 1 65 65 CYS H    H  1   8.751 0.006 . 1 . . . A  65 CYS H    . 18787 1 
      450 . 1 1 65 65 CYS HA   H  1   4.840 0.010 . 1 . . . A  65 CYS HA   . 18787 1 
      451 . 1 1 65 65 CYS HB2  H  1   2.743 0.007 . 1 . . . A  65 CYS HB2  . 18787 1 
      452 . 1 1 65 65 CYS HB3  H  1   2.852 0.008 . 1 . . . A  65 CYS HB3  . 18787 1 
      453 . 1 1 65 65 CYS N    N 15 117.905 0.000 . 1 . . . A  65 CYS N    . 18787 1 
      454 . 1 1 66 66 GLY H    H  1   8.859 0.003 . 1 . . . A  66 GLY H    . 18787 1 
      455 . 1 1 66 66 GLY HA2  H  1   3.950 0.002 . 1 . . . A  66 GLY HA2  . 18787 1 
      456 . 1 1 66 66 GLY HA3  H  1   3.524 0.004 . 1 . . . A  66 GLY HA3  . 18787 1 
      457 . 1 1 66 66 GLY N    N 15 101.931 0.000 . 1 . . . A  66 GLY N    . 18787 1 
      458 . 1 1 67 67 GLU H    H  1   7.711 0.004 . 1 . . . A  67 GLU H    . 18787 1 
      459 . 1 1 67 67 GLU HA   H  1   4.173 0.003 . 1 . . . A  67 GLU HA   . 18787 1 
      460 . 1 1 67 67 GLU HB2  H  1   2.399 0.005 . 1 . . . A  67 GLU HB2  . 18787 1 
      461 . 1 1 67 67 GLU HB3  H  1   2.302 0.004 . 1 . . . A  67 GLU HB3  . 18787 1 
      462 . 1 1 67 67 GLU HG2  H  1   2.138 0.005 . 1 . . . A  67 GLU HG2  . 18787 1 
      463 . 1 1 67 67 GLU HG3  H  1   2.225 0.004 . 1 . . . A  67 GLU HG3  . 18787 1 
      464 . 1 1 67 67 GLU N    N 15 116.570 0.000 . 1 . . . A  67 GLU N    . 18787 1 
      465 . 1 1 68 68 CYS H    H  1   6.445 0.004 . 1 . . . A  68 CYS H    . 18787 1 
      466 . 1 1 68 68 CYS HA   H  1   4.682 0.004 . 1 . . . A  68 CYS HA   . 18787 1 
      467 . 1 1 68 68 CYS HB2  H  1   1.359 0.003 . 1 . . . A  68 CYS HB2  . 18787 1 
      468 . 1 1 68 68 CYS HB3  H  1   2.135 0.004 . 1 . . . A  68 CYS HB3  . 18787 1 
      469 . 1 1 68 68 CYS N    N 15 114.622 0.000 . 1 . . . A  68 CYS N    . 18787 1 
      470 . 1 1 69 69 HIS H    H  1   6.882 0.003 . 1 . . . A  69 HIS H    . 18787 1 
      471 . 1 1 69 69 HIS HA   H  1   2.758 0.004 . 1 . . . A  69 HIS HA   . 18787 1 
      472 . 1 1 69 69 HIS HB2  H  1   1.252 0.004 . 1 . . . A  69 HIS HB2  . 18787 1 
      473 . 1 1 69 69 HIS HB3  H  1   1.034 0.005 . 1 . . . A  69 HIS HB3  . 18787 1 
      474 . 1 1 69 69 HIS HD1  H  1   9.066 0.005 . 1 . . . A  69 HIS HD1  . 18787 1 
      475 . 1 1 69 69 HIS HD2  H  1   0.770 0.003 . 1 . . . A  69 HIS HD2  . 18787 1 
      476 . 1 1 69 69 HIS HE1  H  1   0.942 0.002 . 1 . . . A  69 HIS HE1  . 18787 1 
      477 . 1 1 69 69 HIS N    N 15 117.976 0.000 . 1 . . . A  69 HIS N    . 18787 1 
      478 . 1 1 69 69 HIS ND1  N 15 166.650 0.000 . 1 . . . A  69 HIS ND1  . 18787 1 
      479 . 1 1 70 70 LYS H    H  1   7.073 0.005 . 1 . . . A  70 LYS H    . 18787 1 
      480 . 1 1 70 70 LYS HA   H  1   4.241 0.003 . 1 . . . A  70 LYS HA   . 18787 1 
      481 . 1 1 70 70 LYS HB2  H  1   1.640 0.005 . 1 . . . A  70 LYS HB2  . 18787 1 
      482 . 1 1 70 70 LYS HG2  H  1   1.145 0.012 . 1 . . . A  70 LYS HG2  . 18787 1 
      483 . 1 1 70 70 LYS HG3  H  1   1.166 0.008 . 1 . . . A  70 LYS HG3  . 18787 1 
      484 . 1 1 70 70 LYS HD2  H  1   1.522 0.048 . 1 . . . A  70 LYS HD2  . 18787 1 
      485 . 1 1 70 70 LYS HE2  H  1   2.953 0.003 . 1 . . . A  70 LYS HE2  . 18787 1 
      486 . 1 1 70 70 LYS N    N 15 123.658 0.000 . 1 . . . A  70 LYS N    . 18787 1 
      487 . 1 1 71 71 LYS H    H  1   7.857 0.002 . 1 . . . A  71 LYS H    . 18787 1 
      488 . 1 1 71 71 LYS HA   H  1   3.937 0.003 . 1 . . . A  71 LYS HA   . 18787 1 
      489 . 1 1 71 71 LYS HB2  H  1   1.523 0.005 . 1 . . . A  71 LYS HB2  . 18787 1 
      490 . 1 1 71 71 LYS HB3  H  1   1.635 0.004 . 1 . . . A  71 LYS HB3  . 18787 1 
      491 . 1 1 71 71 LYS HG2  H  1   1.223 0.003 . 1 . . . A  71 LYS HG2  . 18787 1 
      492 . 1 1 71 71 LYS N    N 15 128.299 0.000 . 1 . . . A  71 LYS N    . 18787 1 
      493 . 2 2  1  1 HEM HA62 H  1   3.448 0.003 . 1 . . . . 130 HEM HA62 . 18787 1 
      494 . 2 2  1  1 HEM HA63 H  1   4.240 0.005 . 1 . . . . 130 HEM HA63 . 18787 1 
      495 . 2 2  1  1 HEM HA72 H  1   3.912 0.008 . 1 . . . . 130 HEM HA72 . 18787 1 
      496 . 2 2  1  1 HEM HA73 H  1   3.927 0.003 . 1 . . . . 130 HEM HA73 . 18787 1 
      497 . 2 2  1  1 HEM HAM  H  1   9.446 0.003 . 1 . . . . 130 HEM HAM  . 18787 1 
      498 . 2 2  1  1 HEM HB62 H  1   2.474 0.004 . 1 . . . . 130 HEM HB62 . 18787 1 
      499 . 2 2  1  1 HEM HB63 H  1   3.065 0.003 . 1 . . . . 130 HEM HB63 . 18787 1 
      500 . 2 2  1  1 HEM HB72 H  1   2.809 0.001 . 1 . . . . 130 HEM HB72 . 18787 1 
      501 . 2 2  1  1 HEM HB73 H  1   2.922 0.007 . 1 . . . . 130 HEM HB73 . 18787 1 
      502 . 2 2  1  1 HEM HBM  H  1   8.879 0.002 . 1 . . . . 130 HEM HBM  . 18787 1 
      503 . 2 2  1  1 HEM HDM  H  1   9.449 0.001 . 1 . . . . 130 HEM HDM  . 18787 1 
      504 . 2 2  1  1 HEM HGM  H  1   9.235 0.002 . 1 . . . . 130 HEM HGM  . 18787 1 
      505 . 2 2  1  1 HEM HT2A H  1   6.119 0.003 . 1 . . . . 130 HEM HT2A . 18787 1 
      506 . 2 2  1  1 HEM HT4A H  1   6.063 0.004 . 1 . . . . 130 HEM HT4A . 18787 1 
      507 . 2 2  1  1 HEM CMB  H  1   3.525 0.002 . 1 . . . . 130 HEM QM1  . 18787 1 
      508 . 2 2  1  1 HEM CMC  H  1   3.384 0.002 . 1 . . . . 130 HEM QM3  . 18787 1 
      509 . 2 2  1  1 HEM CMD  H  1   2.813 0.004 . 1 . . . . 130 HEM QM5  . 18787 1 
      510 . 2 2  1  1 HEM CMA  H  1   3.295 0.004 . 1 . . . . 130 HEM QM8  . 18787 1 
      511 . 2 2  1  1 HEM CBB  H  1   2.126 0.001 . 1 . . . . 130 HEM QT2  . 18787 1 
      512 . 2 2  1  1 HEM CBC  H  1   1.388 0.002 . 1 . . . . 130 HEM QT4  . 18787 1 
      513 . 3 2  1  1 HEM HA62 H  1   3.773 0.006 . 1 . . . . 154 HEM HA62 . 18787 1 
      514 . 3 2  1  1 HEM HA63 H  1   4.130 0.005 . 1 . . . . 154 HEM HA63 . 18787 1 
      515 . 3 2  1  1 HEM HA72 H  1   4.117 0.000 . 1 . . . . 154 HEM HA72 . 18787 1 
      516 . 3 2  1  1 HEM HA73 H  1   4.153 0.005 . 1 . . . . 154 HEM HA73 . 18787 1 
      517 . 3 2  1  1 HEM HAM  H  1  10.583 0.001 . 1 . . . . 154 HEM HAM  . 18787 1 
      518 . 3 2  1  1 HEM HB62 H  1   2.849 0.003 . 1 . . . . 154 HEM HB62 . 18787 1 
      519 . 3 2  1  1 HEM HB63 H  1   2.977 0.002 . 1 . . . . 154 HEM HB63 . 18787 1 
      520 . 3 2  1  1 HEM HB72 H  1   3.242 0.003 . 1 . . . . 154 HEM HB72 . 18787 1 
      521 . 3 2  1  1 HEM HBM  H  1   9.737 0.002 . 1 . . . . 154 HEM HBM  . 18787 1 
      522 . 3 2  1  1 HEM HDM  H  1   9.927 0.002 . 1 . . . . 154 HEM HDM  . 18787 1 
      523 . 3 2  1  1 HEM HGM  H  1   9.420 0.001 . 1 . . . . 154 HEM HGM  . 18787 1 
      524 . 3 2  1  1 HEM HT2A H  1   7.292 0.003 . 1 . . . . 154 HEM HT2A . 18787 1 
      525 . 3 2  1  1 HEM HT4A H  1   6.518 0.002 . 1 . . . . 154 HEM HT4A . 18787 1 
      526 . 3 2  1  1 HEM CMB  H  1   4.361 0.002 . 1 . . . . 154 HEM QM1  . 18787 1 
      527 . 3 2  1  1 HEM CMC  H  1   4.087 0.002 . 1 . . . . 154 HEM QM3  . 18787 1 
      528 . 3 2  1  1 HEM CMD  H  1   3.431 0.003 . 1 . . . . 154 HEM QM5  . 18787 1 
      529 . 3 2  1  1 HEM CMA  H  1   3.767 0.003 . 1 . . . . 154 HEM QM8  . 18787 1 
      530 . 3 2  1  1 HEM CBB  H  1   2.943 0.002 . 1 . . . . 154 HEM QT2  . 18787 1 
      531 . 3 2  1  1 HEM CBC  H  1   2.872 0.005 . 1 . . . . 154 HEM QT4  . 18787 1 
      532 . 4 2  1  1 HEM HA62 H  1   3.872 0.003 . 1 . . . . 168 HEM HA62 . 18787 1 
      533 . 4 2  1  1 HEM HA63 H  1   4.192 0.003 . 1 . . . . 168 HEM HA63 . 18787 1 
      534 . 4 2  1  1 HEM HA72 H  1   4.444 0.002 . 1 . . . . 168 HEM HA72 . 18787 1 
      535 . 4 2  1  1 HEM HA73 H  1   3.970 0.004 . 1 . . . . 168 HEM HA73 . 18787 1 
      536 . 4 2  1  1 HEM HAM  H  1   8.987 0.002 . 1 . . . . 168 HEM HAM  . 18787 1 
      537 . 4 2  1  1 HEM HB62 H  1   3.119 0.003 . 1 . . . . 168 HEM HB62 . 18787 1 
      538 . 4 2  1  1 HEM HB63 H  1   3.723 0.003 . 1 . . . . 168 HEM HB63 . 18787 1 
      539 . 4 2  1  1 HEM HB72 H  1   3.111 0.004 . 1 . . . . 168 HEM HB72 . 18787 1 
      540 . 4 2  1  1 HEM HB73 H  1   3.474 0.002 . 1 . . . . 168 HEM HB73 . 18787 1 
      541 . 4 2  1  1 HEM HBM  H  1   9.322 0.002 . 1 . . . . 168 HEM HBM  . 18787 1 
      542 . 4 2  1  1 HEM HDM  H  1   9.363 0.002 . 1 . . . . 168 HEM HDM  . 18787 1 
      543 . 4 2  1  1 HEM HGM  H  1   9.466 0.005 . 1 . . . . 168 HEM HGM  . 18787 1 
      544 . 4 2  1  1 HEM HT2A H  1   6.006 0.003 . 1 . . . . 168 HEM HT2A . 18787 1 
      545 . 4 2  1  1 HEM HT4A H  1   6.237 0.002 . 1 . . . . 168 HEM HT4A . 18787 1 
      546 . 4 2  1  1 HEM CMB  H  1   3.588 0.002 . 1 . . . . 168 HEM QM1  . 18787 1 
      547 . 4 2  1  1 HEM CMC  H  1   2.977 0.005 . 1 . . . . 168 HEM QM3  . 18787 1 
      548 . 4 2  1  1 HEM CMD  H  1   3.983 0.003 . 1 . . . . 168 HEM QM5  . 18787 1 
      549 . 4 2  1  1 HEM CMA  H  1   3.317 0.003 . 1 . . . . 168 HEM QM8  . 18787 1 
      550 . 4 2  1  1 HEM CBB  H  1   2.030 0.002 . 1 . . . . 168 HEM QT2  . 18787 1 
      551 . 4 2  1  1 HEM CBC  H  1   1.491 0.007 . 1 . . . . 168 HEM QT4  . 18787 1 

   stop_

save_