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                      11443
   _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'        1 $sample_1 isotropic 11443 1 
       2 '2D 1H-13C HSQC'        1 $sample_1 isotropic 11443 1 
       3 '3D CBCA(CO)NH'         1 $sample_1 isotropic 11443 1 
       4 '3D HNCACB'             1 $sample_1 isotropic 11443 1 
       5 '3D HNCO'               1 $sample_1 isotropic 11443 1 
       6 '3D HBHA(CO)NH'         1 $sample_1 isotropic 11443 1 
       7 '3D H(CCO)N 3D C(CO)NH' 1 $sample_1 isotropic 11443 1 
       9 '3D 1H-13C NOESY'       1 $sample_1 isotropic 11443 1 
      10 '3D HN(CA)CO'           1 $sample_1 isotropic 11443 1 

   stop_

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

        1 . 1 1  2  2 PRO HA   H  1   4.310 0.004 . 1 . . . A  2 PRO HA   . 11443 1 
        2 . 1 1  2  2 PRO HB2  H  1   2.155 0.007 . 2 . . . A  2 PRO HB2  . 11443 1 
        3 . 1 1  2  2 PRO HB3  H  1   1.787 0.007 . 2 . . . A  2 PRO HB3  . 11443 1 
        4 . 1 1  2  2 PRO HG2  H  1   1.855 0.003 . 2 . . . A  2 PRO HG2  . 11443 1 
        5 . 1 1  2  2 PRO HG3  H  1   1.855 0.003 . 2 . . . A  2 PRO HG3  . 11443 1 
        6 . 1 1  2  2 PRO HD2  H  1   3.416 0.004 . 2 . . . A  2 PRO HD2  . 11443 1 
        7 . 1 1  2  2 PRO HD3  H  1   3.416 0.004 . 2 . . . A  2 PRO HD3  . 11443 1 
        8 . 1 1  2  2 PRO C    C 13 174.394 0.099 . 1 . . . A  2 PRO C    . 11443 1 
        9 . 1 1  2  2 PRO CA   C 13  61.286 0.172 . 1 . . . A  2 PRO CA   . 11443 1 
       10 . 1 1  2  2 PRO CB   C 13  30.469 0.105 . 1 . . . A  2 PRO CB   . 11443 1 
       11 . 1 1  2  2 PRO CG   C 13  25.194 0.122 . 1 . . . A  2 PRO CG   . 11443 1 
       12 . 1 1  2  2 PRO CD   C 13  47.765 0.140 . 1 . . . A  2 PRO CD   . 11443 1 
       13 . 1 1  3  3 LEU H    H  1   8.470 0.003 . 1 . . . A  3 LEU H    . 11443 1 
       14 . 1 1  3  3 LEU HA   H  1   4.208 0.021 . 1 . . . A  3 LEU HA   . 11443 1 
       15 . 1 1  3  3 LEU HB2  H  1   1.514 0.007 . 2 . . . A  3 LEU HB2  . 11443 1 
       16 . 1 1  3  3 LEU HB3  H  1   1.437 0.017 . 2 . . . A  3 LEU HB3  . 11443 1 
       17 . 1 1  3  3 LEU HG   H  1   0.768 0.010 . 1 . . . A  3 LEU HG   . 11443 1 
       18 . 1 1  3  3 LEU HD11 H  1   0.735 0.011 . 1 . . . A  3 LEU HD11 . 11443 1 
       19 . 1 1  3  3 LEU HD12 H  1   0.735 0.011 . 1 . . . A  3 LEU HD12 . 11443 1 
       20 . 1 1  3  3 LEU HD13 H  1   0.735 0.011 . 1 . . . A  3 LEU HD13 . 11443 1 
       21 . 1 1  3  3 LEU HD21 H  1   0.735 0.011 . 1 . . . A  3 LEU HD21 . 11443 1 
       22 . 1 1  3  3 LEU HD22 H  1   0.735 0.011 . 1 . . . A  3 LEU HD22 . 11443 1 
       23 . 1 1  3  3 LEU HD23 H  1   0.735 0.011 . 1 . . . A  3 LEU HD23 . 11443 1 
       24 . 1 1  3  3 LEU C    C 13 175.143 0.067 . 1 . . . A  3 LEU C    . 11443 1 
       25 . 1 1  3  3 LEU CA   C 13  53.541 0.199 . 1 . . . A  3 LEU CA   . 11443 1 
       26 . 1 1  3  3 LEU CB   C 13  40.451 0.202 . 1 . . . A  3 LEU CB   . 11443 1 
       27 . 1 1  3  3 LEU CG   C 13  23.071 0.132 . 1 . . . A  3 LEU CG   . 11443 1 
       28 . 1 1  3  3 LEU CD1  C 13  21.661 0.166 . 2 . . . A  3 LEU CD1  . 11443 1 
       29 . 1 1  3  3 LEU N    N 15 122.410 0.026 . 1 . . . A  3 LEU N    . 11443 1 
       30 . 1 1  4  4 GLY H    H  1   8.426 0.055 . 1 . . . A  4 GLY H    . 11443 1 
       31 . 1 1  4  4 GLY HA2  H  1   3.872 0.009 . 2 . . . A  4 GLY HA2  . 11443 1 
       32 . 1 1  4  4 GLY HA3  H  1   3.831 0.012 . 2 . . . A  4 GLY HA3  . 11443 1 
       33 . 1 1  4  4 GLY C    C 13 171.630 0.002 . 1 . . . A  4 GLY C    . 11443 1 
       34 . 1 1  4  4 GLY CA   C 13  43.421 0.117 . 1 . . . A  4 GLY CA   . 11443 1 
       35 . 1 1  4  4 GLY N    N 15 110.295 0.102 . 1 . . . A  4 GLY N    . 11443 1 
       36 . 1 1  5  5 SER H    H  1   8.124 0.011 . 1 . . . A  5 SER H    . 11443 1 
       37 . 1 1  5  5 SER HA   H  1   4.272 0.006 . 1 . . . A  5 SER HA   . 11443 1 
       38 . 1 1  5  5 SER HB2  H  1   3.773 0.028 . 2 . . . A  5 SER HB2  . 11443 1 
       39 . 1 1  5  5 SER HB3  H  1   3.694 0.019 . 2 . . . A  5 SER HB3  . 11443 1 
       40 . 1 1  5  5 SER C    C 13 171.916 0.098 . 1 . . . A  5 SER C    . 11443 1 
       41 . 1 1  5  5 SER CA   C 13  56.798 0.241 . 1 . . . A  5 SER CA   . 11443 1 
       42 . 1 1  5  5 SER CB   C 13  62.022 0.048 . 1 . . . A  5 SER CB   . 11443 1 
       43 . 1 1  5  5 SER N    N 15 115.493 0.019 . 1 . . . A  5 SER N    . 11443 1 
       44 . 1 1  6  6 GLU H    H  1   8.503 0.005 . 1 . . . A  6 GLU H    . 11443 1 
       45 . 1 1  6  6 GLU HA   H  1   4.111 0.004 . 1 . . . A  6 GLU HA   . 11443 1 
       46 . 1 1  6  6 GLU HB2  H  1   1.909 0.008 . 2 . . . A  6 GLU HB2  . 11443 1 
       47 . 1 1  6  6 GLU HB3  H  1   1.780 0.009 . 2 . . . A  6 GLU HB3  . 11443 1 
       48 . 1 1  6  6 GLU HG2  H  1   2.116 0.010 . 2 . . . A  6 GLU HG2  . 11443 1 
       49 . 1 1  6  6 GLU HG3  H  1   2.097 0.002 . 2 . . . A  6 GLU HG3  . 11443 1 
       50 . 1 1  6  6 GLU C    C 13 173.088 0.009 . 1 . . . A  6 GLU C    . 11443 1 
       51 . 1 1  6  6 GLU CA   C 13  54.811 0.226 . 1 . . . A  6 GLU CA   . 11443 1 
       52 . 1 1  6  6 GLU CB   C 13  28.043 0.204 . 1 . . . A  6 GLU CB   . 11443 1 
       53 . 1 1  6  6 GLU CG   C 13  34.382 0.150 . 1 . . . A  6 GLU CG   . 11443 1 
       54 . 1 1  6  6 GLU N    N 15 122.584 0.015 . 1 . . . A  6 GLU N    . 11443 1 
       55 . 1 1  7  7 ALA H    H  1   7.980 0.005 . 1 . . . A  7 ALA H    . 11443 1 
       56 . 1 1  7  7 ALA HA   H  1   4.106 0.005 . 1 . . . A  7 ALA HA   . 11443 1 
       57 . 1 1  7  7 ALA HB1  H  1   1.149 0.005 . 1 . . . A  7 ALA HB1  . 11443 1 
       58 . 1 1  7  7 ALA HB2  H  1   1.149 0.005 . 1 . . . A  7 ALA HB2  . 11443 1 
       59 . 1 1  7  7 ALA HB3  H  1   1.149 0.005 . 1 . . . A  7 ALA HB3  . 11443 1 
       60 . 1 1  7  7 ALA C    C 13 173.776 0.005 . 1 . . . A  7 ALA C    . 11443 1 
       61 . 1 1  7  7 ALA CA   C 13  49.819 0.135 . 1 . . . A  7 ALA CA   . 11443 1 
       62 . 1 1  7  7 ALA CB   C 13  17.636 0.149 . 1 . . . A  7 ALA CB   . 11443 1 
       63 . 1 1  7  7 ALA N    N 15 124.015 0.019 . 1 . . . A  7 ALA N    . 11443 1 
       64 . 1 1  8  8 ASP H    H  1   8.181 0.005 . 1 . . . A  8 ASP H    . 11443 1 
       65 . 1 1  8  8 ASP HA   H  1   4.548 0.066 . 1 . . . A  8 ASP HA   . 11443 1 
       66 . 1 1  8  8 ASP HB2  H  1   2.455 0.020 . 2 . . . A  8 ASP HB2  . 11443 1 
       67 . 1 1  8  8 ASP HB3  H  1   2.393 0.018 . 2 . . . A  8 ASP HB3  . 11443 1 
       68 . 1 1  8  8 ASP C    C 13 173.010 0.000 . 1 . . . A  8 ASP C    . 11443 1 
       69 . 1 1  8  8 ASP CA   C 13  50.200 0.190 . 1 . . . A  8 ASP CA   . 11443 1 
       70 . 1 1  8  8 ASP CB   C 13  40.559 0.062 . 1 . . . A  8 ASP CB   . 11443 1 
       71 . 1 1  8  8 ASP N    N 15 122.946 0.023 . 1 . . . A  8 ASP N    . 11443 1 
       72 . 1 1  9  9 PRO HA   H  1   4.022 0.006 . 1 . . . A  9 PRO HA   . 11443 1 
       73 . 1 1  9  9 PRO HB2  H  1   2.203 0.009 . 2 . . . A  9 PRO HB2  . 11443 1 
       74 . 1 1  9  9 PRO HB3  H  1   1.796 0.009 . 2 . . . A  9 PRO HB3  . 11443 1 
       75 . 1 1  9  9 PRO HG2  H  1   1.886 0.015 . 2 . . . A  9 PRO HG2  . 11443 1 
       76 . 1 1  9  9 PRO HG3  H  1   1.886 0.015 . 2 . . . A  9 PRO HG3  . 11443 1 
       77 . 1 1  9  9 PRO HD2  H  1   3.628 0.010 . 2 . . . A  9 PRO HD2  . 11443 1 
       78 . 1 1  9  9 PRO HD3  H  1   3.777 0.010 . 2 . . . A  9 PRO HD3  . 11443 1 
       79 . 1 1  9  9 PRO C    C 13 175.980 0.027 . 1 . . . A  9 PRO C    . 11443 1 
       80 . 1 1  9  9 PRO CA   C 13  63.226 0.083 . 1 . . . A  9 PRO CA   . 11443 1 
       81 . 1 1  9  9 PRO CB   C 13  30.286 0.099 . 1 . . . A  9 PRO CB   . 11443 1 
       82 . 1 1  9  9 PRO CG   C 13  25.600 0.159 . 1 . . . A  9 PRO CG   . 11443 1 
       83 . 1 1  9  9 PRO CD   C 13  49.259 0.094 . 1 . . . A  9 PRO CD   . 11443 1 
       84 . 1 1 10 10 ARG H    H  1   8.647 0.007 . 1 . . . A 10 ARG H    . 11443 1 
       85 . 1 1 10 10 ARG HA   H  1   3.837 0.009 . 1 . . . A 10 ARG HA   . 11443 1 
       86 . 1 1 10 10 ARG HB2  H  1   1.231 0.005 . 2 . . . A 10 ARG HB2  . 11443 1 
       87 . 1 1 10 10 ARG HB3  H  1   0.904 0.009 . 2 . . . A 10 ARG HB3  . 11443 1 
       88 . 1 1 10 10 ARG HG2  H  1   1.446 0.012 . 2 . . . A 10 ARG HG2  . 11443 1 
       89 . 1 1 10 10 ARG HG3  H  1   1.473 0.027 . 2 . . . A 10 ARG HG3  . 11443 1 
       90 . 1 1 10 10 ARG HD2  H  1   3.119 0.006 . 2 . . . A 10 ARG HD2  . 11443 1 
       91 . 1 1 10 10 ARG HD3  H  1   2.961 0.013 . 2 . . . A 10 ARG HD3  . 11443 1 
       92 . 1 1 10 10 ARG C    C 13 177.064 0.056 . 1 . . . A 10 ARG C    . 11443 1 
       93 . 1 1 10 10 ARG CA   C 13  56.339 0.090 . 1 . . . A 10 ARG CA   . 11443 1 
       94 . 1 1 10 10 ARG CB   C 13  29.027 4.684 . 1 . . . A 10 ARG CB   . 11443 1 
       95 . 1 1 10 10 ARG CG   C 13  24.792 0.514 . 1 . . . A 10 ARG CG   . 11443 1 
       96 . 1 1 10 10 ARG CD   C 13  41.711 0.090 . 1 . . . A 10 ARG CD   . 11443 1 
       97 . 1 1 10 10 ARG N    N 15 116.991 0.021 . 1 . . . A 10 ARG N    . 11443 1 
       98 . 1 1 11 11 LEU H    H  1   7.073 0.006 . 1 . . . A 11 LEU H    . 11443 1 
       99 . 1 1 11 11 LEU HA   H  1   3.705 0.013 . 1 . . . A 11 LEU HA   . 11443 1 
      100 . 1 1 11 11 LEU HB2  H  1   1.379 0.016 . 2 . . . A 11 LEU HB2  . 11443 1 
      101 . 1 1 11 11 LEU HB3  H  1   1.898 0.007 . 2 . . . A 11 LEU HB3  . 11443 1 
      102 . 1 1 11 11 LEU HG   H  1   0.912 0.006 . 1 . . . A 11 LEU HG   . 11443 1 
      103 . 1 1 11 11 LEU HD11 H  1   0.933 0.005 . 1 . . . A 11 LEU HD11 . 11443 1 
      104 . 1 1 11 11 LEU HD12 H  1   0.933 0.005 . 1 . . . A 11 LEU HD12 . 11443 1 
      105 . 1 1 11 11 LEU HD13 H  1   0.933 0.005 . 1 . . . A 11 LEU HD13 . 11443 1 
      106 . 1 1 11 11 LEU HD21 H  1   0.933 0.005 . 1 . . . A 11 LEU HD21 . 11443 1 
      107 . 1 1 11 11 LEU HD22 H  1   0.933 0.005 . 1 . . . A 11 LEU HD22 . 11443 1 
      108 . 1 1 11 11 LEU HD23 H  1   0.933 0.005 . 1 . . . A 11 LEU HD23 . 11443 1 
      109 . 1 1 11 11 LEU C    C 13 174.074 0.028 . 1 . . . A 11 LEU C    . 11443 1 
      110 . 1 1 11 11 LEU CA   C 13  55.558 0.229 . 1 . . . A 11 LEU CA   . 11443 1 
      111 . 1 1 11 11 LEU CB   C 13  38.359 0.123 . 1 . . . A 11 LEU CB   . 11443 1 
      112 . 1 1 11 11 LEU CG   C 13  24.201 0.103 . 1 . . . A 11 LEU CG   . 11443 1 
      113 . 1 1 11 11 LEU CD1  C 13  21.436 0.088 . 2 . . . A 11 LEU CD1  . 11443 1 
      114 . 1 1 11 11 LEU N    N 15 121.323 0.029 . 1 . . . A 11 LEU N    . 11443 1 
      115 . 1 1 12 12 ILE H    H  1   7.239 0.012 . 1 . . . A 12 ILE H    . 11443 1 
      116 . 1 1 12 12 ILE HA   H  1   3.378 0.012 . 1 . . . A 12 ILE HA   . 11443 1 
      117 . 1 1 12 12 ILE HB   H  1   1.661 0.006 . 1 . . . A 12 ILE HB   . 11443 1 
      118 . 1 1 12 12 ILE HG12 H  1   1.027 0.006 . 2 . . . A 12 ILE HG12 . 11443 1 
      119 . 1 1 12 12 ILE HG13 H  1   1.315 0.010 . 2 . . . A 12 ILE HG13 . 11443 1 
      120 . 1 1 12 12 ILE HG21 H  1   0.608 0.008 . 1 . . . A 12 ILE HG21 . 11443 1 
      121 . 1 1 12 12 ILE HG22 H  1   0.608 0.008 . 1 . . . A 12 ILE HG22 . 11443 1 
      122 . 1 1 12 12 ILE HG23 H  1   0.608 0.008 . 1 . . . A 12 ILE HG23 . 11443 1 
      123 . 1 1 12 12 ILE HD11 H  1   0.727 0.005 . 1 . . . A 12 ILE HD11 . 11443 1 
      124 . 1 1 12 12 ILE HD12 H  1   0.727 0.005 . 1 . . . A 12 ILE HD12 . 11443 1 
      125 . 1 1 12 12 ILE HD13 H  1   0.727 0.005 . 1 . . . A 12 ILE HD13 . 11443 1 
      126 . 1 1 12 12 ILE C    C 13 176.369 0.022 . 1 . . . A 12 ILE C    . 11443 1 
      127 . 1 1 12 12 ILE CA   C 13  62.389 0.154 . 1 . . . A 12 ILE CA   . 11443 1 
      128 . 1 1 12 12 ILE CB   C 13  35.615 0.123 . 1 . . . A 12 ILE CB   . 11443 1 
      129 . 1 1 12 12 ILE CG1  C 13  26.440 0.070 . 1 . . . A 12 ILE CG1  . 11443 1 
      130 . 1 1 12 12 ILE CG2  C 13  10.202 0.103 . 1 . . . A 12 ILE CG2  . 11443 1 
      131 . 1 1 12 12 ILE CD1  C 13  15.123 0.157 . 1 . . . A 12 ILE CD1  . 11443 1 
      132 . 1 1 12 12 ILE N    N 15 116.804 0.034 . 1 . . . A 12 ILE N    . 11443 1 
      133 . 1 1 13 13 GLU H    H  1   7.703 0.008 . 1 . . . A 13 GLU H    . 11443 1 
      134 . 1 1 13 13 GLU HA   H  1   3.919 0.005 . 1 . . . A 13 GLU HA   . 11443 1 
      135 . 1 1 13 13 GLU HB2  H  1   1.868 0.016 . 2 . . . A 13 GLU HB2  . 11443 1 
      136 . 1 1 13 13 GLU HB3  H  1   1.828 0.016 . 2 . . . A 13 GLU HB3  . 11443 1 
      137 . 1 1 13 13 GLU HG2  H  1   2.035 0.018 . 2 . . . A 13 GLU HG2  . 11443 1 
      138 . 1 1 13 13 GLU HG3  H  1   2.062 0.005 . 2 . . . A 13 GLU HG3  . 11443 1 
      139 . 1 1 13 13 GLU C    C 13 175.525 0.043 . 1 . . . A 13 GLU C    . 11443 1 
      140 . 1 1 13 13 GLU CA   C 13  57.658 0.245 . 1 . . . A 13 GLU CA   . 11443 1 
      141 . 1 1 13 13 GLU CB   C 13  28.228 0.226 . 1 . . . A 13 GLU CB   . 11443 1 
      142 . 1 1 13 13 GLU CG   C 13  33.942 0.106 . 1 . . . A 13 GLU CG   . 11443 1 
      143 . 1 1 13 13 GLU N    N 15 119.057 0.023 . 1 . . . A 13 GLU N    . 11443 1 
      144 . 1 1 14 14 SER H    H  1   7.745 0.011 . 1 . . . A 14 SER H    . 11443 1 
      145 . 1 1 14 14 SER HA   H  1   4.147 0.015 . 1 . . . A 14 SER HA   . 11443 1 
      146 . 1 1 14 14 SER HB2  H  1   3.869 0.009 . 2 . . . A 14 SER HB2  . 11443 1 
      147 . 1 1 14 14 SER HB3  H  1   3.651 0.011 . 2 . . . A 14 SER HB3  . 11443 1 
      148 . 1 1 14 14 SER C    C 13 174.649 0.893 . 1 . . . A 14 SER C    . 11443 1 
      149 . 1 1 14 14 SER CA   C 13  60.151 0.532 . 1 . . . A 14 SER CA   . 11443 1 
      150 . 1 1 14 14 SER CB   C 13  60.985 0.209 . 1 . . . A 14 SER CB   . 11443 1 
      151 . 1 1 14 14 SER N    N 15 115.399 0.028 . 1 . . . A 14 SER N    . 11443 1 
      152 . 1 1 15 15 LEU H    H  1   8.774 0.009 . 1 . . . A 15 LEU H    . 11443 1 
      153 . 1 1 15 15 LEU HA   H  1   3.578 0.013 . 1 . . . A 15 LEU HA   . 11443 1 
      154 . 1 1 15 15 LEU HB2  H  1   1.244 0.008 . 2 . . . A 15 LEU HB2  . 11443 1 
      155 . 1 1 15 15 LEU HB3  H  1   1.544 0.009 . 2 . . . A 15 LEU HB3  . 11443 1 
      156 . 1 1 15 15 LEU HG   H  1   0.554 0.010 . 1 . . . A 15 LEU HG   . 11443 1 
      157 . 1 1 15 15 LEU HD11 H  1   0.441 0.011 . 1 . . . A 15 LEU HD11 . 11443 1 
      158 . 1 1 15 15 LEU HD12 H  1   0.441 0.011 . 1 . . . A 15 LEU HD12 . 11443 1 
      159 . 1 1 15 15 LEU HD13 H  1   0.441 0.011 . 1 . . . A 15 LEU HD13 . 11443 1 
      160 . 1 1 15 15 LEU HD21 H  1   0.441 0.011 . 1 . . . A 15 LEU HD21 . 11443 1 
      161 . 1 1 15 15 LEU HD22 H  1   0.441 0.011 . 1 . . . A 15 LEU HD22 . 11443 1 
      162 . 1 1 15 15 LEU HD23 H  1   0.441 0.011 . 1 . . . A 15 LEU HD23 . 11443 1 
      163 . 1 1 15 15 LEU C    C 13 175.916 0.005 . 1 . . . A 15 LEU C    . 11443 1 
      164 . 1 1 15 15 LEU CA   C 13  56.503 0.258 . 1 . . . A 15 LEU CA   . 11443 1 
      165 . 1 1 15 15 LEU CB   C 13  40.469 0.202 . 1 . . . A 15 LEU CB   . 11443 1 
      166 . 1 1 15 15 LEU CG   C 13  23.419 0.120 . 1 . . . A 15 LEU CG   . 11443 1 
      167 . 1 1 15 15 LEU CD1  C 13  21.606 0.146 . 2 . . . A 15 LEU CD1  . 11443 1 
      168 . 1 1 15 15 LEU N    N 15 124.126 0.022 . 1 . . . A 15 LEU N    . 11443 1 
      169 . 1 1 16 16 SER H    H  1   7.793 0.008 . 1 . . . A 16 SER H    . 11443 1 
      170 . 1 1 16 16 SER HA   H  1   3.897 0.011 . 1 . . . A 16 SER HA   . 11443 1 
      171 . 1 1 16 16 SER HB2  H  1   3.892 0.007 . 2 . . . A 16 SER HB2  . 11443 1 
      172 . 1 1 16 16 SER HB3  H  1   3.892 0.007 . 2 . . . A 16 SER HB3  . 11443 1 
      173 . 1 1 16 16 SER C    C 13 175.353 0.000 . 1 . . . A 16 SER C    . 11443 1 
      174 . 1 1 16 16 SER CA   C 13  60.282 0.327 . 1 . . . A 16 SER CA   . 11443 1 
      175 . 1 1 16 16 SER CB   C 13  59.852 0.407 . 1 . . . A 16 SER CB   . 11443 1 
      176 . 1 1 16 16 SER N    N 15 112.904 0.031 . 1 . . . A 16 SER N    . 11443 1 
      177 . 1 1 17 17 GLN H    H  1   7.845 0.006 . 1 . . . A 17 GLN H    . 11443 1 
      178 . 1 1 17 17 GLN HA   H  1   3.923 0.007 . 1 . . . A 17 GLN HA   . 11443 1 
      179 . 1 1 17 17 GLN HB2  H  1   2.251 0.010 . 2 . . . A 17 GLN HB2  . 11443 1 
      180 . 1 1 17 17 GLN HB3  H  1   1.658 0.008 . 2 . . . A 17 GLN HB3  . 11443 1 
      181 . 1 1 17 17 GLN HG2  H  1   2.456 0.010 . 2 . . . A 17 GLN HG2  . 11443 1 
      182 . 1 1 17 17 GLN HG3  H  1   2.274 0.011 . 2 . . . A 17 GLN HG3  . 11443 1 
      183 . 1 1 17 17 GLN C    C 13 176.798 0.034 . 1 . . . A 17 GLN C    . 11443 1 
      184 . 1 1 17 17 GLN CA   C 13  57.130 0.180 . 1 . . . A 17 GLN CA   . 11443 1 
      185 . 1 1 17 17 GLN CB   C 13  26.282 0.132 . 1 . . . A 17 GLN CB   . 11443 1 
      186 . 1 1 17 17 GLN CG   C 13  32.146 0.114 . 1 . . . A 17 GLN CG   . 11443 1 
      187 . 1 1 17 17 GLN N    N 15 120.895 0.026 . 1 . . . A 17 GLN N    . 11443 1 
      188 . 1 1 18 18 MET H    H  1   8.026 0.014 . 1 . . . A 18 MET H    . 11443 1 
      189 . 1 1 18 18 MET HA   H  1   4.115 0.009 . 1 . . . A 18 MET HA   . 11443 1 
      190 . 1 1 18 18 MET HB2  H  1   1.871 0.009 . 2 . . . A 18 MET HB2  . 11443 1 
      191 . 1 1 18 18 MET HB3  H  1   1.635 0.019 . 2 . . . A 18 MET HB3  . 11443 1 
      192 . 1 1 18 18 MET HG2  H  1   2.050 0.006 . 2 . . . A 18 MET HG2  . 11443 1 
      193 . 1 1 18 18 MET HG3  H  1   2.486 0.010 . 2 . . . A 18 MET HG3  . 11443 1 
      194 . 1 1 18 18 MET HE1  H  1   0.865 0.005 . 1 . . . A 18 MET HE1  . 11443 1 
      195 . 1 1 18 18 MET HE2  H  1   0.865 0.005 . 1 . . . A 18 MET HE2  . 11443 1 
      196 . 1 1 18 18 MET HE3  H  1   0.865 0.005 . 1 . . . A 18 MET HE3  . 11443 1 
      197 . 1 1 18 18 MET C    C 13 176.657 0.043 . 1 . . . A 18 MET C    . 11443 1 
      198 . 1 1 18 18 MET CA   C 13  57.899 0.144 . 1 . . . A 18 MET CA   . 11443 1 
      199 . 1 1 18 18 MET CB   C 13  30.329 0.121 . 1 . . . A 18 MET CB   . 11443 1 
      200 . 1 1 18 18 MET CG   C 13  32.244 0.098 . 1 . . . A 18 MET CG   . 11443 1 
      201 . 1 1 18 18 MET CE   C 13  14.753 0.008 . 1 . . . A 18 MET CE   . 11443 1 
      202 . 1 1 18 18 MET N    N 15 118.135 0.026 . 1 . . . A 18 MET N    . 11443 1 
      203 . 1 1 19 19 LEU H    H  1   8.954 0.009 . 1 . . . A 19 LEU H    . 11443 1 
      204 . 1 1 19 19 LEU HA   H  1   4.301 0.007 . 1 . . . A 19 LEU HA   . 11443 1 
      205 . 1 1 19 19 LEU HB2  H  1   1.660 0.009 . 2 . . . A 19 LEU HB2  . 11443 1 
      206 . 1 1 19 19 LEU HB3  H  1   1.403 0.009 . 2 . . . A 19 LEU HB3  . 11443 1 
      207 . 1 1 19 19 LEU HG   H  1   0.616 0.006 . 1 . . . A 19 LEU HG   . 11443 1 
      208 . 1 1 19 19 LEU HD11 H  1   0.602 0.003 . 1 . . . A 19 LEU HD11 . 11443 1 
      209 . 1 1 19 19 LEU HD12 H  1   0.602 0.003 . 1 . . . A 19 LEU HD12 . 11443 1 
      210 . 1 1 19 19 LEU HD13 H  1   0.602 0.003 . 1 . . . A 19 LEU HD13 . 11443 1 
      211 . 1 1 19 19 LEU HD21 H  1   0.602 0.003 . 1 . . . A 19 LEU HD21 . 11443 1 
      212 . 1 1 19 19 LEU HD22 H  1   0.602 0.003 . 1 . . . A 19 LEU HD22 . 11443 1 
      213 . 1 1 19 19 LEU HD23 H  1   0.602 0.003 . 1 . . . A 19 LEU HD23 . 11443 1 
      214 . 1 1 19 19 LEU C    C 13 179.539 0.015 . 1 . . . A 19 LEU C    . 11443 1 
      215 . 1 1 19 19 LEU CA   C 13  56.180 0.236 . 1 . . . A 19 LEU CA   . 11443 1 
      216 . 1 1 19 19 LEU CB   C 13  38.422 0.175 . 1 . . . A 19 LEU CB   . 11443 1 
      217 . 1 1 19 19 LEU CG   C 13  23.249 0.125 . 1 . . . A 19 LEU CG   . 11443 1 
      218 . 1 1 19 19 LEU CD1  C 13  21.206 0.186 . 2 . . . A 19 LEU CD1  . 11443 1 
      219 . 1 1 19 19 LEU N    N 15 122.635 0.021 . 1 . . . A 19 LEU N    . 11443 1 
      220 . 1 1 20 20 SER H    H  1   7.834 0.008 . 1 . . . A 20 SER H    . 11443 1 
      221 . 1 1 20 20 SER HA   H  1   4.121 0.012 . 1 . . . A 20 SER HA   . 11443 1 
      222 . 1 1 20 20 SER HB2  H  1   3.877 0.012 . 2 . . . A 20 SER HB2  . 11443 1 
      223 . 1 1 20 20 SER HB3  H  1   3.877 0.012 . 2 . . . A 20 SER HB3  . 11443 1 
      224 . 1 1 20 20 SER C    C 13 172.271 0.000 . 1 . . . A 20 SER C    . 11443 1 
      225 . 1 1 20 20 SER CA   C 13  59.883 0.419 . 1 . . . A 20 SER CA   . 11443 1 
      226 . 1 1 20 20 SER CB   C 13  60.761 0.175 . 1 . . . A 20 SER CB   . 11443 1 
      227 . 1 1 20 20 SER N    N 15 116.895 0.033 . 1 . . . A 20 SER N    . 11443 1 
      228 . 1 1 21 21 MET H    H  1   7.084 0.017 . 1 . . . A 21 MET H    . 11443 1 
      229 . 1 1 21 21 MET HA   H  1   3.491 0.007 . 1 . . . A 21 MET HA   . 11443 1 
      230 . 1 1 21 21 MET HB2  H  1   2.126 0.008 . 2 . . . A 21 MET HB2  . 11443 1 
      231 . 1 1 21 21 MET HB3  H  1   1.805 0.008 . 2 . . . A 21 MET HB3  . 11443 1 
      232 . 1 1 21 21 MET HG2  H  1   1.482 0.011 . 2 . . . A 21 MET HG2  . 11443 1 
      233 . 1 1 21 21 MET HG3  H  1   2.408 0.009 . 2 . . . A 21 MET HG3  . 11443 1 
      234 . 1 1 21 21 MET HE1  H  1   1.780 0.003 . 1 . . . A 21 MET HE1  . 11443 1 
      235 . 1 1 21 21 MET HE2  H  1   1.780 0.003 . 1 . . . A 21 MET HE2  . 11443 1 
      236 . 1 1 21 21 MET HE3  H  1   1.780 0.003 . 1 . . . A 21 MET HE3  . 11443 1 
      237 . 1 1 21 21 MET C    C 13 172.373 0.010 . 1 . . . A 21 MET C    . 11443 1 
      238 . 1 1 21 21 MET CA   C 13  54.323 0.031 . 1 . . . A 21 MET CA   . 11443 1 
      239 . 1 1 21 21 MET CB   C 13  31.861 0.111 . 1 . . . A 21 MET CB   . 11443 1 
      240 . 1 1 21 21 MET CG   C 13  29.635 0.086 . 1 . . . A 21 MET CG   . 11443 1 
      241 . 1 1 21 21 MET CE   C 13  15.985 0.006 . 1 . . . A 21 MET CE   . 11443 1 
      242 . 1 1 21 21 MET N    N 15 117.996 0.018 . 1 . . . A 21 MET N    . 11443 1 
      243 . 1 1 22 22 GLY H    H  1   7.521 0.005 . 1 . . . A 22 GLY H    . 11443 1 
      244 . 1 1 22 22 GLY HA2  H  1   3.643 0.007 . 2 . . . A 22 GLY HA2  . 11443 1 
      245 . 1 1 22 22 GLY HA3  H  1   3.453 0.016 . 2 . . . A 22 GLY HA3  . 11443 1 
      246 . 1 1 22 22 GLY C    C 13 172.251 0.023 . 1 . . . A 22 GLY C    . 11443 1 
      247 . 1 1 22 22 GLY CA   C 13  43.153 0.130 . 1 . . . A 22 GLY CA   . 11443 1 
      248 . 1 1 22 22 GLY N    N 15 103.645 0.026 . 1 . . . A 22 GLY N    . 11443 1 
      249 . 1 1 23 23 PHE H    H  1   7.264 0.006 . 1 . . . A 23 PHE H    . 11443 1 
      250 . 1 1 23 23 PHE HA   H  1   4.391 0.020 . 1 . . . A 23 PHE HA   . 11443 1 
      251 . 1 1 23 23 PHE HB2  H  1   2.326 0.015 . 2 . . . A 23 PHE HB2  . 11443 1 
      252 . 1 1 23 23 PHE HB3  H  1   3.039 0.007 . 2 . . . A 23 PHE HB3  . 11443 1 
      253 . 1 1 23 23 PHE HD1  H  1   7.500 0.006 . 3 . . . A 23 PHE HD1  . 11443 1 
      254 . 1 1 23 23 PHE HD2  H  1   7.500 0.006 . 3 . . . A 23 PHE HD2  . 11443 1 
      255 . 1 1 23 23 PHE HE1  H  1   7.133 0.034 . 3 . . . A 23 PHE HE1  . 11443 1 
      256 . 1 1 23 23 PHE HE2  H  1   7.133 0.034 . 3 . . . A 23 PHE HE2  . 11443 1 
      257 . 1 1 23 23 PHE HZ   H  1   6.703 0.024 . 1 . . . A 23 PHE HZ   . 11443 1 
      258 . 1 1 23 23 PHE C    C 13 170.274 0.004 . 1 . . . A 23 PHE C    . 11443 1 
      259 . 1 1 23 23 PHE CA   C 13  57.390 0.114 . 1 . . . A 23 PHE CA   . 11443 1 
      260 . 1 1 23 23 PHE CB   C 13  38.044 0.189 . 1 . . . A 23 PHE CB   . 11443 1 
      261 . 1 1 23 23 PHE CD1  C 13 131.638 0.071 . 3 . . . A 23 PHE CD1  . 11443 1 
      262 . 1 1 23 23 PHE CE1  C 13 131.560 0.058 . 3 . . . A 23 PHE CE1  . 11443 1 
      263 . 1 1 23 23 PHE CZ   C 13 128.799 0.069 . 1 . . . A 23 PHE CZ   . 11443 1 
      264 . 1 1 23 23 PHE N    N 15 118.321 0.019 . 1 . . . A 23 PHE N    . 11443 1 
      265 . 1 1 24 24 SER H    H  1   8.613 0.010 . 1 . . . A 24 SER H    . 11443 1 
      266 . 1 1 24 24 SER HA   H  1   4.477 0.014 . 1 . . . A 24 SER HA   . 11443 1 
      267 . 1 1 24 24 SER HB2  H  1   3.935 0.009 . 2 . . . A 24 SER HB2  . 11443 1 
      268 . 1 1 24 24 SER HB3  H  1   3.760 0.009 . 2 . . . A 24 SER HB3  . 11443 1 
      269 . 1 1 24 24 SER C    C 13 169.045 0.012 . 1 . . . A 24 SER C    . 11443 1 
      270 . 1 1 24 24 SER CA   C 13  55.129 0.269 . 1 . . . A 24 SER CA   . 11443 1 
      271 . 1 1 24 24 SER CB   C 13  63.648 0.230 . 1 . . . A 24 SER CB   . 11443 1 
      272 . 1 1 24 24 SER N    N 15 114.210 0.025 . 1 . . . A 24 SER N    . 11443 1 
      273 . 1 1 25 25 ASP H    H  1   8.463 0.007 . 1 . . . A 25 ASP H    . 11443 1 
      274 . 1 1 25 25 ASP HA   H  1   4.771 0.048 . 1 . . . A 25 ASP HA   . 11443 1 
      275 . 1 1 25 25 ASP HB2  H  1   1.749 0.010 . 2 . . . A 25 ASP HB2  . 11443 1 
      276 . 1 1 25 25 ASP HB3  H  1   2.466 0.007 . 2 . . . A 25 ASP HB3  . 11443 1 
      277 . 1 1 25 25 ASP C    C 13 174.976 0.013 . 1 . . . A 25 ASP C    . 11443 1 
      278 . 1 1 25 25 ASP CA   C 13  50.399 0.311 . 1 . . . A 25 ASP CA   . 11443 1 
      279 . 1 1 25 25 ASP CB   C 13  40.454 0.236 . 1 . . . A 25 ASP CB   . 11443 1 
      280 . 1 1 25 25 ASP N    N 15 119.009 0.029 . 1 . . . A 25 ASP N    . 11443 1 
      281 . 1 1 26 26 GLU H    H  1   8.892 0.006 . 1 . . . A 26 GLU H    . 11443 1 
      282 . 1 1 26 26 GLU HA   H  1   4.097 0.006 . 1 . . . A 26 GLU HA   . 11443 1 
      283 . 1 1 26 26 GLU HB2  H  1   2.008 0.007 . 2 . . . A 26 GLU HB2  . 11443 1 
      284 . 1 1 26 26 GLU HB3  H  1   2.008 0.007 . 2 . . . A 26 GLU HB3  . 11443 1 
      285 . 1 1 26 26 GLU HG2  H  1   2.322 0.014 . 2 . . . A 26 GLU HG2  . 11443 1 
      286 . 1 1 26 26 GLU HG3  H  1   2.254 0.021 . 2 . . . A 26 GLU HG3  . 11443 1 
      287 . 1 1 26 26 GLU C    C 13 176.937 0.014 . 1 . . . A 26 GLU C    . 11443 1 
      288 . 1 1 26 26 GLU CA   C 13  56.852 0.086 . 1 . . . A 26 GLU CA   . 11443 1 
      289 . 1 1 26 26 GLU CB   C 13  26.957 0.087 . 1 . . . A 26 GLU CB   . 11443 1 
      290 . 1 1 26 26 GLU CG   C 13  34.045 0.081 . 1 . . . A 26 GLU CG   . 11443 1 
      291 . 1 1 26 26 GLU N    N 15 123.976 0.023 . 1 . . . A 26 GLU N    . 11443 1 
      292 . 1 1 27 27 GLY H    H  1   9.241 0.022 . 1 . . . A 27 GLY H    . 11443 1 
      293 . 1 1 27 27 GLY HA2  H  1   3.803 0.006 . 2 . . . A 27 GLY HA2  . 11443 1 
      294 . 1 1 27 27 GLY HA3  H  1   4.056 0.003 . 2 . . . A 27 GLY HA3  . 11443 1 
      295 . 1 1 27 27 GLY C    C 13 172.518 0.004 . 1 . . . A 27 GLY C    . 11443 1 
      296 . 1 1 27 27 GLY CA   C 13  44.493 0.212 . 1 . . . A 27 GLY CA   . 11443 1 
      297 . 1 1 27 27 GLY N    N 15 116.280 0.037 . 1 . . . A 27 GLY N    . 11443 1 
      298 . 1 1 28 28 GLY H    H  1   8.306 0.009 . 1 . . . A 28 GLY H    . 11443 1 
      299 . 1 1 28 28 GLY HA2  H  1   3.991 0.047 . 2 . . . A 28 GLY HA2  . 11443 1 
      300 . 1 1 28 28 GLY HA3  H  1   3.856 0.033 . 2 . . . A 28 GLY HA3  . 11443 1 
      301 . 1 1 28 28 GLY C    C 13 173.304 0.058 . 1 . . . A 28 GLY C    . 11443 1 
      302 . 1 1 28 28 GLY CA   C 13  44.613 0.173 . 1 . . . A 28 GLY CA   . 11443 1 
      303 . 1 1 28 28 GLY N    N 15 108.517 0.028 . 1 . . . A 28 GLY N    . 11443 1 
      304 . 1 1 29 29 TRP H    H  1   6.933 0.006 . 1 . . . A 29 TRP H    . 11443 1 
      305 . 1 1 29 29 TRP HA   H  1   3.997 0.007 . 1 . . . A 29 TRP HA   . 11443 1 
      306 . 1 1 29 29 TRP HB2  H  1   3.409 0.014 . 2 . . . A 29 TRP HB2  . 11443 1 
      307 . 1 1 29 29 TRP HB3  H  1   3.085 0.009 . 2 . . . A 29 TRP HB3  . 11443 1 
      308 . 1 1 29 29 TRP HD1  H  1   8.050 0.007 . 1 . . . A 29 TRP HD1  . 11443 1 
      309 . 1 1 29 29 TRP HE1  H  1  10.026 0.011 . 1 . . . A 29 TRP HE1  . 11443 1 
      310 . 1 1 29 29 TRP HE3  H  1   7.228 0.016 . 1 . . . A 29 TRP HE3  . 11443 1 
      311 . 1 1 29 29 TRP HZ2  H  1   7.751 0.007 . 1 . . . A 29 TRP HZ2  . 11443 1 
      312 . 1 1 29 29 TRP HZ3  H  1   6.730 0.010 . 1 . . . A 29 TRP HZ3  . 11443 1 
      313 . 1 1 29 29 TRP HH2  H  1   6.889 0.008 . 1 . . . A 29 TRP HH2  . 11443 1 
      314 . 1 1 29 29 TRP C    C 13 173.708 0.050 . 1 . . . A 29 TRP C    . 11443 1 
      315 . 1 1 29 29 TRP CA   C 13  58.381 0.103 . 1 . . . A 29 TRP CA   . 11443 1 
      316 . 1 1 29 29 TRP CB   C 13  25.740 0.127 . 1 . . . A 29 TRP CB   . 11443 1 
      317 . 1 1 29 29 TRP CD1  C 13 127.373 0.064 . 1 . . . A 29 TRP CD1  . 11443 1 
      318 . 1 1 29 29 TRP CE3  C 13 120.071 0.090 . 1 . . . A 29 TRP CE3  . 11443 1 
      319 . 1 1 29 29 TRP CZ2  C 13 115.722 0.035 . 1 . . . A 29 TRP CZ2  . 11443 1 
      320 . 1 1 29 29 TRP CZ3  C 13 121.157 0.092 . 1 . . . A 29 TRP CZ3  . 11443 1 
      321 . 1 1 29 29 TRP CH2  C 13 123.552 0.029 . 1 . . . A 29 TRP CH2  . 11443 1 
      322 . 1 1 29 29 TRP N    N 15 118.304 0.020 . 1 . . . A 29 TRP N    . 11443 1 
      323 . 1 1 29 29 TRP NE1  N 15 132.001 0.021 . 1 . . . A 29 TRP NE1  . 11443 1 
      324 . 1 1 30 30 LEU H    H  1   7.482 0.008 . 1 . . . A 30 LEU H    . 11443 1 
      325 . 1 1 30 30 LEU HA   H  1   3.126 0.007 . 1 . . . A 30 LEU HA   . 11443 1 
      326 . 1 1 30 30 LEU HB2  H  1  -0.311 0.012 . 2 . . . A 30 LEU HB2  . 11443 1 
      327 . 1 1 30 30 LEU HB3  H  1   0.938 0.016 . 2 . . . A 30 LEU HB3  . 11443 1 
      328 . 1 1 30 30 LEU HG   H  1   0.766 0.017 . 1 . . . A 30 LEU HG   . 11443 1 
      329 . 1 1 30 30 LEU HD11 H  1   0.164 0.008 . 1 . . . A 30 LEU HD11 . 11443 1 
      330 . 1 1 30 30 LEU HD12 H  1   0.164 0.008 . 1 . . . A 30 LEU HD12 . 11443 1 
      331 . 1 1 30 30 LEU HD13 H  1   0.164 0.008 . 1 . . . A 30 LEU HD13 . 11443 1 
      332 . 1 1 30 30 LEU HD21 H  1   0.192 0.005 . 1 . . . A 30 LEU HD21 . 11443 1 
      333 . 1 1 30 30 LEU HD22 H  1   0.192 0.005 . 1 . . . A 30 LEU HD22 . 11443 1 
      334 . 1 1 30 30 LEU HD23 H  1   0.192 0.005 . 1 . . . A 30 LEU HD23 . 11443 1 
      335 . 1 1 30 30 LEU C    C 13 175.686 0.039 . 1 . . . A 30 LEU C    . 11443 1 
      336 . 1 1 30 30 LEU CA   C 13  54.768 0.294 . 1 . . . A 30 LEU CA   . 11443 1 
      337 . 1 1 30 30 LEU CB   C 13  38.414 0.247 . 1 . . . A 30 LEU CB   . 11443 1 
      338 . 1 1 30 30 LEU CG   C 13  24.426 0.322 . 1 . . . A 30 LEU CG   . 11443 1 
      339 . 1 1 30 30 LEU CD1  C 13  20.403 0.102 . 2 . . . A 30 LEU CD1  . 11443 1 
      340 . 1 1 30 30 LEU CD2  C 13  24.045 0.030 . 2 . . . A 30 LEU CD2  . 11443 1 
      341 . 1 1 30 30 LEU N    N 15 128.965 0.032 . 1 . . . A 30 LEU N    . 11443 1 
      342 . 1 1 31 31 THR H    H  1   8.664 0.008 . 1 . . . A 31 THR H    . 11443 1 
      343 . 1 1 31 31 THR HA   H  1   3.992 0.006 . 1 . . . A 31 THR HA   . 11443 1 
      344 . 1 1 31 31 THR HB   H  1   3.318 0.005 . 1 . . . A 31 THR HB   . 11443 1 
      345 . 1 1 31 31 THR HG21 H  1   0.927 0.003 . 1 . . . A 31 THR HG21 . 11443 1 
      346 . 1 1 31 31 THR HG22 H  1   0.927 0.003 . 1 . . . A 31 THR HG22 . 11443 1 
      347 . 1 1 31 31 THR HG23 H  1   0.927 0.003 . 1 . . . A 31 THR HG23 . 11443 1 
      348 . 1 1 31 31 THR C    C 13 173.511 0.000 . 1 . . . A 31 THR C    . 11443 1 
      349 . 1 1 31 31 THR CA   C 13  66.161 0.043 . 1 . . . A 31 THR CA   . 11443 1 
      350 . 1 1 31 31 THR CB   C 13  67.256 0.034 . 1 . . . A 31 THR CB   . 11443 1 
      351 . 1 1 31 31 THR CG2  C 13  19.309 0.087 . 1 . . . A 31 THR CG2  . 11443 1 
      352 . 1 1 31 31 THR N    N 15 121.296 0.039 . 1 . . . A 31 THR N    . 11443 1 
      353 . 1 1 32 32 ARG H    H  1   7.763 0.006 . 1 . . . A 32 ARG H    . 11443 1 
      354 . 1 1 32 32 ARG HA   H  1   3.977 0.006 . 1 . . . A 32 ARG HA   . 11443 1 
      355 . 1 1 32 32 ARG HB2  H  1   1.718 0.021 . 2 . . . A 32 ARG HB2  . 11443 1 
      356 . 1 1 32 32 ARG HB3  H  1   1.627 0.017 . 2 . . . A 32 ARG HB3  . 11443 1 
      357 . 1 1 32 32 ARG HG2  H  1   1.770 0.018 . 2 . . . A 32 ARG HG2  . 11443 1 
      358 . 1 1 32 32 ARG HG3  H  1   1.348 0.010 . 2 . . . A 32 ARG HG3  . 11443 1 
      359 . 1 1 32 32 ARG HD2  H  1   3.226 0.018 . 2 . . . A 32 ARG HD2  . 11443 1 
      360 . 1 1 32 32 ARG HD3  H  1   3.027 0.016 . 2 . . . A 32 ARG HD3  . 11443 1 
      361 . 1 1 32 32 ARG C    C 13 176.428 0.012 . 1 . . . A 32 ARG C    . 11443 1 
      362 . 1 1 32 32 ARG CA   C 13  57.950 0.097 . 1 . . . A 32 ARG CA   . 11443 1 
      363 . 1 1 32 32 ARG CB   C 13  28.322 0.144 . 1 . . . A 32 ARG CB   . 11443 1 
      364 . 1 1 32 32 ARG CG   C 13  26.481 0.116 . 1 . . . A 32 ARG CG   . 11443 1 
      365 . 1 1 32 32 ARG CD   C 13  41.508 0.096 . 1 . . . A 32 ARG CD   . 11443 1 
      366 . 1 1 32 32 ARG N    N 15 117.024 0.016 . 1 . . . A 32 ARG N    . 11443 1 
      367 . 1 1 33 33 LEU H    H  1   7.731 0.005 . 1 . . . A 33 LEU H    . 11443 1 
      368 . 1 1 33 33 LEU HA   H  1   3.967 0.006 . 1 . . . A 33 LEU HA   . 11443 1 
      369 . 1 1 33 33 LEU HB2  H  1   1.664 0.010 . 2 . . . A 33 LEU HB2  . 11443 1 
      370 . 1 1 33 33 LEU HB3  H  1   1.495 0.009 . 2 . . . A 33 LEU HB3  . 11443 1 
      371 . 1 1 33 33 LEU HG   H  1   1.052 0.025 . 1 . . . A 33 LEU HG   . 11443 1 
      372 . 1 1 33 33 LEU HD11 H  1   0.816 0.005 . 1 . . . A 33 LEU HD11 . 11443 1 
      373 . 1 1 33 33 LEU HD12 H  1   0.816 0.005 . 1 . . . A 33 LEU HD12 . 11443 1 
      374 . 1 1 33 33 LEU HD13 H  1   0.816 0.005 . 1 . . . A 33 LEU HD13 . 11443 1 
      375 . 1 1 33 33 LEU HD21 H  1   0.824 0.005 . 1 . . . A 33 LEU HD21 . 11443 1 
      376 . 1 1 33 33 LEU HD22 H  1   0.824 0.005 . 1 . . . A 33 LEU HD22 . 11443 1 
      377 . 1 1 33 33 LEU HD23 H  1   0.824 0.005 . 1 . . . A 33 LEU HD23 . 11443 1 
      378 . 1 1 33 33 LEU C    C 13 176.382 0.001 . 1 . . . A 33 LEU C    . 11443 1 
      379 . 1 1 33 33 LEU CA   C 13  56.212 0.177 . 1 . . . A 33 LEU CA   . 11443 1 
      380 . 1 1 33 33 LEU CB   C 13  39.681 0.132 . 1 . . . A 33 LEU CB   . 11443 1 
      381 . 1 1 33 33 LEU CG   C 13  25.538 0.039 . 1 . . . A 33 LEU CG   . 11443 1 
      382 . 1 1 33 33 LEU CD1  C 13  21.708 0.098 . 2 . . . A 33 LEU CD1  . 11443 1 
      383 . 1 1 33 33 LEU CD2  C 13  24.804 0.062 . 2 . . . A 33 LEU CD2  . 11443 1 
      384 . 1 1 33 33 LEU N    N 15 121.830 0.035 . 1 . . . A 33 LEU N    . 11443 1 
      385 . 1 1 34 34 LEU H    H  1   8.583 0.009 . 1 . . . A 34 LEU H    . 11443 1 
      386 . 1 1 34 34 LEU HA   H  1   3.340 0.007 . 1 . . . A 34 LEU HA   . 11443 1 
      387 . 1 1 34 34 LEU HB2  H  1   1.810 0.007 . 2 . . . A 34 LEU HB2  . 11443 1 
      388 . 1 1 34 34 LEU HB3  H  1   0.858 0.017 . 2 . . . A 34 LEU HB3  . 11443 1 
      389 . 1 1 34 34 LEU HG   H  1   1.215 0.010 . 1 . . . A 34 LEU HG   . 11443 1 
      390 . 1 1 34 34 LEU HD11 H  1   0.464 0.007 . 1 . . . A 34 LEU HD11 . 11443 1 
      391 . 1 1 34 34 LEU HD12 H  1   0.464 0.007 . 1 . . . A 34 LEU HD12 . 11443 1 
      392 . 1 1 34 34 LEU HD13 H  1   0.464 0.007 . 1 . . . A 34 LEU HD13 . 11443 1 
      393 . 1 1 34 34 LEU HD21 H  1   0.381 0.010 . 1 . . . A 34 LEU HD21 . 11443 1 
      394 . 1 1 34 34 LEU HD22 H  1   0.381 0.010 . 1 . . . A 34 LEU HD22 . 11443 1 
      395 . 1 1 34 34 LEU HD23 H  1   0.381 0.010 . 1 . . . A 34 LEU HD23 . 11443 1 
      396 . 1 1 34 34 LEU C    C 13 176.750 0.015 . 1 . . . A 34 LEU C    . 11443 1 
      397 . 1 1 34 34 LEU CA   C 13  56.615 0.183 . 1 . . . A 34 LEU CA   . 11443 1 
      398 . 1 1 34 34 LEU CB   C 13  40.189 0.103 . 1 . . . A 34 LEU CB   . 11443 1 
      399 . 1 1 34 34 LEU CG   C 13  25.789 0.055 . 1 . . . A 34 LEU CG   . 11443 1 
      400 . 1 1 34 34 LEU CD1  C 13  23.099 0.073 . 2 . . . A 34 LEU CD1  . 11443 1 
      401 . 1 1 34 34 LEU CD2  C 13  20.332 0.164 . 2 . . . A 34 LEU CD2  . 11443 1 
      402 . 1 1 34 34 LEU N    N 15 118.663 0.034 . 1 . . . A 34 LEU N    . 11443 1 
      403 . 1 1 35 35 GLN H    H  1   7.973 0.005 . 1 . . . A 35 GLN H    . 11443 1 
      404 . 1 1 35 35 GLN HA   H  1   3.368 0.007 . 1 . . . A 35 GLN HA   . 11443 1 
      405 . 1 1 35 35 GLN HB2  H  1   2.224 0.010 . 2 . . . A 35 GLN HB2  . 11443 1 
      406 . 1 1 35 35 GLN HB3  H  1   1.851 0.005 . 2 . . . A 35 GLN HB3  . 11443 1 
      407 . 1 1 35 35 GLN HG2  H  1   2.573 0.009 . 2 . . . A 35 GLN HG2  . 11443 1 
      408 . 1 1 35 35 GLN HG3  H  1   2.360 0.007 . 2 . . . A 35 GLN HG3  . 11443 1 
      409 . 1 1 35 35 GLN C    C 13 177.016 0.078 . 1 . . . A 35 GLN C    . 11443 1 
      410 . 1 1 35 35 GLN CA   C 13  57.907 0.068 . 1 . . . A 35 GLN CA   . 11443 1 
      411 . 1 1 35 35 GLN CB   C 13  26.501 0.145 . 1 . . . A 35 GLN CB   . 11443 1 
      412 . 1 1 35 35 GLN CG   C 13  32.760 0.084 . 1 . . . A 35 GLN CG   . 11443 1 
      413 . 1 1 35 35 GLN N    N 15 117.731 0.028 . 1 . . . A 35 GLN N    . 11443 1 
      414 . 1 1 36 36 THR H    H  1   8.005 0.005 . 1 . . . A 36 THR H    . 11443 1 
      415 . 1 1 36 36 THR HA   H  1   4.204 0.009 . 1 . . . A 36 THR HA   . 11443 1 
      416 . 1 1 36 36 THR HB   H  1   3.936 0.010 . 1 . . . A 36 THR HB   . 11443 1 
      417 . 1 1 36 36 THR HG21 H  1   1.169 0.005 . 1 . . . A 36 THR HG21 . 11443 1 
      418 . 1 1 36 36 THR HG22 H  1   1.169 0.005 . 1 . . . A 36 THR HG22 . 11443 1 
      419 . 1 1 36 36 THR HG23 H  1   1.169 0.005 . 1 . . . A 36 THR HG23 . 11443 1 
      420 . 1 1 36 36 THR C    C 13 172.652 0.017 . 1 . . . A 36 THR C    . 11443 1 
      421 . 1 1 36 36 THR CA   C 13  67.617 0.015 . 1 . . . A 36 THR CA   . 11443 1 
      422 . 1 1 36 36 THR CB   C 13  63.521 0.047 . 1 . . . A 36 THR CB   . 11443 1 
      423 . 1 1 36 36 THR CG2  C 13  19.490 0.158 . 1 . . . A 36 THR CG2  . 11443 1 
      424 . 1 1 36 36 THR N    N 15 114.193 0.029 . 1 . . . A 36 THR N    . 11443 1 
      425 . 1 1 37 37 LYS H    H  1   7.337 0.020 . 1 . . . A 37 LYS H    . 11443 1 
      426 . 1 1 37 37 LYS HA   H  1   4.337 0.009 . 1 . . . A 37 LYS HA   . 11443 1 
      427 . 1 1 37 37 LYS HB2  H  1   1.374 0.012 . 2 . . . A 37 LYS HB2  . 11443 1 
      428 . 1 1 37 37 LYS HB3  H  1   2.040 0.008 . 2 . . . A 37 LYS HB3  . 11443 1 
      429 . 1 1 37 37 LYS HG2  H  1   0.766 0.010 . 2 . . . A 37 LYS HG2  . 11443 1 
      430 . 1 1 37 37 LYS HG3  H  1   0.766 0.010 . 2 . . . A 37 LYS HG3  . 11443 1 
      431 . 1 1 37 37 LYS HD2  H  1   1.204 0.012 . 2 . . . A 37 LYS HD2  . 11443 1 
      432 . 1 1 37 37 LYS HD3  H  1   1.370 0.006 . 2 . . . A 37 LYS HD3  . 11443 1 
      433 . 1 1 37 37 LYS HE2  H  1   2.555 0.017 . 2 . . . A 37 LYS HE2  . 11443 1 
      434 . 1 1 37 37 LYS HE3  H  1   2.759 0.004 . 2 . . . A 37 LYS HE3  . 11443 1 
      435 . 1 1 37 37 LYS C    C 13 173.688 0.094 . 1 . . . A 37 LYS C    . 11443 1 
      436 . 1 1 37 37 LYS CA   C 13  50.910 0.120 . 1 . . . A 37 LYS CA   . 11443 1 
      437 . 1 1 37 37 LYS CB   C 13  28.557 0.180 . 1 . . . A 37 LYS CB   . 11443 1 
      438 . 1 1 37 37 LYS CG   C 13  21.579 0.059 . 1 . . . A 37 LYS CG   . 11443 1 
      439 . 1 1 37 37 LYS CD   C 13  25.466 0.098 . 1 . . . A 37 LYS CD   . 11443 1 
      440 . 1 1 37 37 LYS CE   C 13  40.652 0.093 . 1 . . . A 37 LYS CE   . 11443 1 
      441 . 1 1 37 37 LYS N    N 15 117.440 0.013 . 1 . . . A 37 LYS N    . 11443 1 
      442 . 1 1 38 38 ASN H    H  1   7.618 0.012 . 1 . . . A 38 ASN H    . 11443 1 
      443 . 1 1 38 38 ASN HA   H  1   3.501 0.005 . 1 . . . A 38 ASN HA   . 11443 1 
      444 . 1 1 38 38 ASN HB2  H  1   2.866 0.005 . 2 . . . A 38 ASN HB2  . 11443 1 
      445 . 1 1 38 38 ASN HB3  H  1   2.350 0.006 . 2 . . . A 38 ASN HB3  . 11443 1 
      446 . 1 1 38 38 ASN C    C 13 171.468 0.042 . 1 . . . A 38 ASN C    . 11443 1 
      447 . 1 1 38 38 ASN CA   C 13  52.836 0.175 . 1 . . . A 38 ASN CA   . 11443 1 
      448 . 1 1 38 38 ASN CB   C 13  35.361 0.140 . 1 . . . A 38 ASN CB   . 11443 1 
      449 . 1 1 38 38 ASN N    N 15 118.754 0.031 . 1 . . . A 38 ASN N    . 11443 1 
      450 . 1 1 39 39 TYR H    H  1   8.294 0.007 . 1 . . . A 39 TYR H    . 11443 1 
      451 . 1 1 39 39 TYR HA   H  1   3.288 0.010 . 1 . . . A 39 TYR HA   . 11443 1 
      452 . 1 1 39 39 TYR HB2  H  1   2.928 0.005 . 2 . . . A 39 TYR HB2  . 11443 1 
      453 . 1 1 39 39 TYR HB3  H  1   2.928 0.005 . 2 . . . A 39 TYR HB3  . 11443 1 
      454 . 1 1 39 39 TYR HD1  H  1   6.494 0.018 . 3 . . . A 39 TYR HD1  . 11443 1 
      455 . 1 1 39 39 TYR HD2  H  1   6.494 0.018 . 3 . . . A 39 TYR HD2  . 11443 1 
      456 . 1 1 39 39 TYR HE1  H  1   6.544 0.043 . 3 . . . A 39 TYR HE1  . 11443 1 
      457 . 1 1 39 39 TYR HE2  H  1   6.544 0.043 . 3 . . . A 39 TYR HE2  . 11443 1 
      458 . 1 1 39 39 TYR C    C 13 170.161 0.010 . 1 . . . A 39 TYR C    . 11443 1 
      459 . 1 1 39 39 TYR CA   C 13  57.016 0.106 . 1 . . . A 39 TYR CA   . 11443 1 
      460 . 1 1 39 39 TYR CB   C 13  33.028 0.200 . 1 . . . A 39 TYR CB   . 11443 1 
      461 . 1 1 39 39 TYR CD1  C 13 132.180 0.050 . 3 . . . A 39 TYR CD1  . 11443 1 
      462 . 1 1 39 39 TYR CE1  C 13 118.196 0.049 . 3 . . . A 39 TYR CE1  . 11443 1 
      463 . 1 1 39 39 TYR N    N 15 107.599 0.029 . 1 . . . A 39 TYR N    . 11443 1 
      464 . 1 1 40 40 ASP H    H  1   6.920 0.006 . 1 . . . A 40 ASP H    . 11443 1 
      465 . 1 1 40 40 ASP HA   H  1   4.492 0.011 . 1 . . . A 40 ASP HA   . 11443 1 
      466 . 1 1 40 40 ASP HB2  H  1   2.366 0.010 . 2 . . . A 40 ASP HB2  . 11443 1 
      467 . 1 1 40 40 ASP HB3  H  1   2.902 0.015 . 2 . . . A 40 ASP HB3  . 11443 1 
      468 . 1 1 40 40 ASP C    C 13 172.777 0.009 . 1 . . . A 40 ASP C    . 11443 1 
      469 . 1 1 40 40 ASP CA   C 13  51.503 0.205 . 1 . . . A 40 ASP CA   . 11443 1 
      470 . 1 1 40 40 ASP CB   C 13  40.230 0.308 . 1 . . . A 40 ASP CB   . 11443 1 
      471 . 1 1 40 40 ASP N    N 15 119.841 0.024 . 1 . . . A 40 ASP N    . 11443 1 
      472 . 1 1 41 41 ILE H    H  1   8.383 0.005 . 1 . . . A 41 ILE H    . 11443 1 
      473 . 1 1 41 41 ILE HA   H  1   3.320 0.006 . 1 . . . A 41 ILE HA   . 11443 1 
      474 . 1 1 41 41 ILE HB   H  1   1.628 0.007 . 1 . . . A 41 ILE HB   . 11443 1 
      475 . 1 1 41 41 ILE HG12 H  1   0.975 0.012 . 2 . . . A 41 ILE HG12 . 11443 1 
      476 . 1 1 41 41 ILE HG13 H  1   0.975 0.012 . 2 . . . A 41 ILE HG13 . 11443 1 
      477 . 1 1 41 41 ILE HG21 H  1   0.776 0.009 . 1 . . . A 41 ILE HG21 . 11443 1 
      478 . 1 1 41 41 ILE HG22 H  1   0.776 0.009 . 1 . . . A 41 ILE HG22 . 11443 1 
      479 . 1 1 41 41 ILE HG23 H  1   0.776 0.009 . 1 . . . A 41 ILE HG23 . 11443 1 
      480 . 1 1 41 41 ILE HD11 H  1   0.693 0.010 . 1 . . . A 41 ILE HD11 . 11443 1 
      481 . 1 1 41 41 ILE HD12 H  1   0.693 0.010 . 1 . . . A 41 ILE HD12 . 11443 1 
      482 . 1 1 41 41 ILE HD13 H  1   0.693 0.010 . 1 . . . A 41 ILE HD13 . 11443 1 
      483 . 1 1 41 41 ILE C    C 13 174.785 0.014 . 1 . . . A 41 ILE C    . 11443 1 
      484 . 1 1 41 41 ILE CA   C 13  63.305 0.099 . 1 . . . A 41 ILE CA   . 11443 1 
      485 . 1 1 41 41 ILE CB   C 13  36.289 0.130 . 1 . . . A 41 ILE CB   . 11443 1 
      486 . 1 1 41 41 ILE CG1  C 13  26.511 0.110 . 1 . . . A 41 ILE CG1  . 11443 1 
      487 . 1 1 41 41 ILE CG2  C 13  12.739 0.364 . 1 . . . A 41 ILE CG2  . 11443 1 
      488 . 1 1 41 41 ILE CD1  C 13  14.998 0.034 . 1 . . . A 41 ILE CD1  . 11443 1 
      489 . 1 1 41 41 ILE N    N 15 126.792 0.024 . 1 . . . A 41 ILE N    . 11443 1 
      490 . 1 1 42 42 GLY H    H  1   8.191 0.021 . 1 . . . A 42 GLY H    . 11443 1 
      491 . 1 1 42 42 GLY HA2  H  1   3.707 0.008 . 2 . . . A 42 GLY HA2  . 11443 1 
      492 . 1 1 42 42 GLY HA3  H  1   3.265 0.013 . 2 . . . A 42 GLY HA3  . 11443 1 
      493 . 1 1 42 42 GLY C    C 13 172.198 0.010 . 1 . . . A 42 GLY C    . 11443 1 
      494 . 1 1 42 42 GLY CA   C 13  45.906 0.151 . 1 . . . A 42 GLY CA   . 11443 1 
      495 . 1 1 42 42 GLY N    N 15 108.098 0.035 . 1 . . . A 42 GLY N    . 11443 1 
      496 . 1 1 43 43 ALA H    H  1   7.891 0.006 . 1 . . . A 43 ALA H    . 11443 1 
      497 . 1 1 43 43 ALA HA   H  1   4.029 0.012 . 1 . . . A 43 ALA HA   . 11443 1 
      498 . 1 1 43 43 ALA HB1  H  1   1.330 0.014 . 1 . . . A 43 ALA HB1  . 11443 1 
      499 . 1 1 43 43 ALA HB2  H  1   1.330 0.014 . 1 . . . A 43 ALA HB2  . 11443 1 
      500 . 1 1 43 43 ALA HB3  H  1   1.330 0.014 . 1 . . . A 43 ALA HB3  . 11443 1 
      501 . 1 1 43 43 ALA C    C 13 178.782 0.008 . 1 . . . A 43 ALA C    . 11443 1 
      502 . 1 1 43 43 ALA CA   C 13  52.476 0.101 . 1 . . . A 43 ALA CA   . 11443 1 
      503 . 1 1 43 43 ALA CB   C 13  16.823 0.250 . 1 . . . A 43 ALA CB   . 11443 1 
      504 . 1 1 43 43 ALA N    N 15 123.513 0.028 . 1 . . . A 43 ALA N    . 11443 1 
      505 . 1 1 44 44 ALA H    H  1   8.089 0.009 . 1 . . . A 44 ALA H    . 11443 1 
      506 . 1 1 44 44 ALA HA   H  1   3.649 0.007 . 1 . . . A 44 ALA HA   . 11443 1 
      507 . 1 1 44 44 ALA HB1  H  1   1.022 0.006 . 1 . . . A 44 ALA HB1  . 11443 1 
      508 . 1 1 44 44 ALA HB2  H  1   1.022 0.006 . 1 . . . A 44 ALA HB2  . 11443 1 
      509 . 1 1 44 44 ALA HB3  H  1   1.022 0.006 . 1 . . . A 44 ALA HB3  . 11443 1 
      510 . 1 1 44 44 ALA C    C 13 176.379 0.012 . 1 . . . A 44 ALA C    . 11443 1 
      511 . 1 1 44 44 ALA CA   C 13  54.090 0.122 . 1 . . . A 44 ALA CA   . 11443 1 
      512 . 1 1 44 44 ALA CB   C 13  15.110 0.077 . 1 . . . A 44 ALA CB   . 11443 1 
      513 . 1 1 44 44 ALA N    N 15 121.634 0.019 . 1 . . . A 44 ALA N    . 11443 1 
      514 . 1 1 45 45 LEU H    H  1   8.611 0.007 . 1 . . . A 45 LEU H    . 11443 1 
      515 . 1 1 45 45 LEU HA   H  1   3.675 0.008 . 1 . . . A 45 LEU HA   . 11443 1 
      516 . 1 1 45 45 LEU HB2  H  1   1.845 0.013 . 2 . . . A 45 LEU HB2  . 11443 1 
      517 . 1 1 45 45 LEU HB3  H  1   1.221 0.008 . 2 . . . A 45 LEU HB3  . 11443 1 
      518 . 1 1 45 45 LEU HG   H  1   1.645 0.014 . 1 . . . A 45 LEU HG   . 11443 1 
      519 . 1 1 45 45 LEU HD11 H  1   0.575 0.014 . 1 . . . A 45 LEU HD11 . 11443 1 
      520 . 1 1 45 45 LEU HD12 H  1   0.575 0.014 . 1 . . . A 45 LEU HD12 . 11443 1 
      521 . 1 1 45 45 LEU HD13 H  1   0.575 0.014 . 1 . . . A 45 LEU HD13 . 11443 1 
      522 . 1 1 45 45 LEU HD21 H  1   0.575 0.014 . 1 . . . A 45 LEU HD21 . 11443 1 
      523 . 1 1 45 45 LEU HD22 H  1   0.575 0.014 . 1 . . . A 45 LEU HD22 . 11443 1 
      524 . 1 1 45 45 LEU HD23 H  1   0.575 0.014 . 1 . . . A 45 LEU HD23 . 11443 1 
      525 . 1 1 45 45 LEU C    C 13 176.858 0.010 . 1 . . . A 45 LEU C    . 11443 1 
      526 . 1 1 45 45 LEU CA   C 13  56.184 0.071 . 1 . . . A 45 LEU CA   . 11443 1 
      527 . 1 1 45 45 LEU CB   C 13  39.037 0.225 . 1 . . . A 45 LEU CB   . 11443 1 
      528 . 1 1 45 45 LEU CG   C 13  24.885 0.259 . 1 . . . A 45 LEU CG   . 11443 1 
      529 . 1 1 45 45 LEU CD1  C 13  25.252 0.044 . 2 . . . A 45 LEU CD1  . 11443 1 
      530 . 1 1 45 45 LEU N    N 15 118.503 0.022 . 1 . . . A 45 LEU N    . 11443 1 
      531 . 1 1 46 46 ASP H    H  1   8.087 0.004 . 1 . . . A 46 ASP H    . 11443 1 
      532 . 1 1 46 46 ASP HA   H  1   4.286 0.008 . 1 . . . A 46 ASP HA   . 11443 1 
      533 . 1 1 46 46 ASP HB2  H  1   2.626 0.022 . 2 . . . A 46 ASP HB2  . 11443 1 
      534 . 1 1 46 46 ASP HB3  H  1   2.703 0.027 . 2 . . . A 46 ASP HB3  . 11443 1 
      535 . 1 1 46 46 ASP C    C 13 175.189 0.038 . 1 . . . A 46 ASP C    . 11443 1 
      536 . 1 1 46 46 ASP CA   C 13  55.360 0.194 . 1 . . . A 46 ASP CA   . 11443 1 
      537 . 1 1 46 46 ASP CB   C 13  37.955 0.235 . 1 . . . A 46 ASP CB   . 11443 1 
      538 . 1 1 46 46 ASP N    N 15 119.712 0.033 . 1 . . . A 46 ASP N    . 11443 1 
      539 . 1 1 47 47 THR H    H  1   7.581 0.014 . 1 . . . A 47 THR H    . 11443 1 
      540 . 1 1 47 47 THR HA   H  1   4.171 0.011 . 1 . . . A 47 THR HA   . 11443 1 
      541 . 1 1 47 47 THR HB   H  1   3.955 0.007 . 1 . . . A 47 THR HB   . 11443 1 
      542 . 1 1 47 47 THR HG21 H  1   1.131 0.020 . 1 . . . A 47 THR HG21 . 11443 1 
      543 . 1 1 47 47 THR HG22 H  1   1.131 0.020 . 1 . . . A 47 THR HG22 . 11443 1 
      544 . 1 1 47 47 THR HG23 H  1   1.131 0.020 . 1 . . . A 47 THR HG23 . 11443 1 
      545 . 1 1 47 47 THR C    C 13 173.577 0.012 . 1 . . . A 47 THR C    . 11443 1 
      546 . 1 1 47 47 THR CA   C 13  67.465 0.033 . 1 . . . A 47 THR CA   . 11443 1 
      547 . 1 1 47 47 THR CB   C 13  65.159 1.190 . 1 . . . A 47 THR CB   . 11443 1 
      548 . 1 1 47 47 THR CG2  C 13  19.969 0.091 . 1 . . . A 47 THR CG2  . 11443 1 
      549 . 1 1 47 47 THR N    N 15 116.324 0.028 . 1 . . . A 47 THR N    . 11443 1 
      550 . 1 1 48 48 ILE H    H  1   7.931 0.007 . 1 . . . A 48 ILE H    . 11443 1 
      551 . 1 1 48 48 ILE HA   H  1   3.611 0.018 . 1 . . . A 48 ILE HA   . 11443 1 
      552 . 1 1 48 48 ILE HB   H  1   1.697 0.014 . 1 . . . A 48 ILE HB   . 11443 1 
      553 . 1 1 48 48 ILE HG12 H  1   1.042 0.014 . 2 . . . A 48 ILE HG12 . 11443 1 
      554 . 1 1 48 48 ILE HG13 H  1   1.659 0.007 . 2 . . . A 48 ILE HG13 . 11443 1 
      555 . 1 1 48 48 ILE HG21 H  1   0.474 0.007 . 1 . . . A 48 ILE HG21 . 11443 1 
      556 . 1 1 48 48 ILE HG22 H  1   0.474 0.007 . 1 . . . A 48 ILE HG22 . 11443 1 
      557 . 1 1 48 48 ILE HG23 H  1   0.474 0.007 . 1 . . . A 48 ILE HG23 . 11443 1 
      558 . 1 1 48 48 ILE HD11 H  1   0.916 0.007 . 1 . . . A 48 ILE HD11 . 11443 1 
      559 . 1 1 48 48 ILE HD12 H  1   0.916 0.007 . 1 . . . A 48 ILE HD12 . 11443 1 
      560 . 1 1 48 48 ILE HD13 H  1   0.916 0.007 . 1 . . . A 48 ILE HD13 . 11443 1 
      561 . 1 1 48 48 ILE C    C 13 174.639 0.008 . 1 . . . A 48 ILE C    . 11443 1 
      562 . 1 1 48 48 ILE CA   C 13  62.933 0.220 . 1 . . . A 48 ILE CA   . 11443 1 
      563 . 1 1 48 48 ILE CB   C 13  37.196 0.152 . 1 . . . A 48 ILE CB   . 11443 1 
      564 . 1 1 48 48 ILE CG1  C 13  27.517 0.056 . 1 . . . A 48 ILE CG1  . 11443 1 
      565 . 1 1 48 48 ILE CG2  C 13  12.437 0.056 . 1 . . . A 48 ILE CG2  . 11443 1 
      566 . 1 1 48 48 ILE CD1  C 13  15.615 0.075 . 1 . . . A 48 ILE CD1  . 11443 1 
      567 . 1 1 48 48 ILE N    N 15 122.853 0.020 . 1 . . . A 48 ILE N    . 11443 1 
      568 . 1 1 49 49 GLN H    H  1   7.936 0.008 . 1 . . . A 49 GLN H    . 11443 1 
      569 . 1 1 49 49 GLN HA   H  1   3.909 0.008 . 1 . . . A 49 GLN HA   . 11443 1 
      570 . 1 1 49 49 GLN HB2  H  1   1.948 0.013 . 2 . . . A 49 GLN HB2  . 11443 1 
      571 . 1 1 49 49 GLN HB3  H  1   1.774 0.012 . 2 . . . A 49 GLN HB3  . 11443 1 
      572 . 1 1 49 49 GLN HG2  H  1   1.966 0.003 . 2 . . . A 49 GLN HG2  . 11443 1 
      573 . 1 1 49 49 GLN HG3  H  1   2.019 0.019 . 2 . . . A 49 GLN HG3  . 11443 1 
      574 . 1 1 49 49 GLN C    C 13 174.094 0.047 . 1 . . . A 49 GLN C    . 11443 1 
      575 . 1 1 49 49 GLN CA   C 13  55.694 0.276 . 1 . . . A 49 GLN CA   . 11443 1 
      576 . 1 1 49 49 GLN CB   C 13  26.619 0.183 . 1 . . . A 49 GLN CB   . 11443 1 
      577 . 1 1 49 49 GLN CG   C 13  31.369 0.126 . 1 . . . A 49 GLN CG   . 11443 1 
      578 . 1 1 49 49 GLN N    N 15 119.037 0.034 . 1 . . . A 49 GLN N    . 11443 1 
      579 . 1 1 50 50 TYR H    H  1   7.852 0.004 . 1 . . . A 50 TYR H    . 11443 1 
      580 . 1 1 50 50 TYR HA   H  1   4.539 0.026 . 1 . . . A 50 TYR HA   . 11443 1 
      581 . 1 1 50 50 TYR HB2  H  1   2.858 0.020 . 2 . . . A 50 TYR HB2  . 11443 1 
      582 . 1 1 50 50 TYR HB3  H  1   3.114 0.012 . 2 . . . A 50 TYR HB3  . 11443 1 
      583 . 1 1 50 50 TYR HD1  H  1   7.057 0.006 . 3 . . . A 50 TYR HD1  . 11443 1 
      584 . 1 1 50 50 TYR HD2  H  1   7.057 0.006 . 3 . . . A 50 TYR HD2  . 11443 1 
      585 . 1 1 50 50 TYR HE1  H  1   6.676 0.005 . 3 . . . A 50 TYR HE1  . 11443 1 
      586 . 1 1 50 50 TYR HE2  H  1   6.676 0.005 . 3 . . . A 50 TYR HE2  . 11443 1 
      587 . 1 1 50 50 TYR C    C 13 173.578 0.037 . 1 . . . A 50 TYR C    . 11443 1 
      588 . 1 1 50 50 TYR CA   C 13  56.662 0.190 . 1 . . . A 50 TYR CA   . 11443 1 
      589 . 1 1 50 50 TYR CB   C 13  36.538 0.179 . 1 . . . A 50 TYR CB   . 11443 1 
      590 . 1 1 50 50 TYR CD1  C 13 133.183 0.005 . 3 . . . A 50 TYR CD1  . 11443 1 
      591 . 1 1 50 50 TYR CE1  C 13 118.113 0.045 . 3 . . . A 50 TYR CE1  . 11443 1 
      592 . 1 1 50 50 TYR N    N 15 118.145 0.030 . 1 . . . A 50 TYR N    . 11443 1 
      593 . 1 1 51 51 SER H    H  1   7.843 0.004 . 1 . . . A 51 SER H    . 11443 1 
      594 . 1 1 51 51 SER HA   H  1   4.317 0.007 . 1 . . . A 51 SER HA   . 11443 1 
      595 . 1 1 51 51 SER HB2  H  1   3.782 0.010 . 2 . . . A 51 SER HB2  . 11443 1 
      596 . 1 1 51 51 SER HB3  H  1   3.782 0.010 . 2 . . . A 51 SER HB3  . 11443 1 
      597 . 1 1 51 51 SER C    C 13 171.224 0.011 . 1 . . . A 51 SER C    . 11443 1 
      598 . 1 1 51 51 SER CA   C 13  56.959 0.216 . 1 . . . A 51 SER CA   . 11443 1 
      599 . 1 1 51 51 SER CB   C 13  62.172 0.337 . 1 . . . A 51 SER CB   . 11443 1 
      600 . 1 1 51 51 SER N    N 15 115.717 0.024 . 1 . . . A 51 SER N    . 11443 1 
      601 . 1 1 52 52 LYS H    H  1   8.030 0.004 . 1 . . . A 52 LYS H    . 11443 1 
      602 . 1 1 52 52 LYS HA   H  1   4.169 0.007 . 1 . . . A 52 LYS HA   . 11443 1 
      603 . 1 1 52 52 LYS HB2  H  1   1.681 0.011 . 2 . . . A 52 LYS HB2  . 11443 1 
      604 . 1 1 52 52 LYS HB3  H  1   1.591 0.013 . 2 . . . A 52 LYS HB3  . 11443 1 
      605 . 1 1 52 52 LYS HG2  H  1   1.253 0.011 . 2 . . . A 52 LYS HG2  . 11443 1 
      606 . 1 1 52 52 LYS HG3  H  1   1.276 0.007 . 2 . . . A 52 LYS HG3  . 11443 1 
      607 . 1 1 52 52 LYS HD2  H  1   1.504 0.005 . 2 . . . A 52 LYS HD2  . 11443 1 
      608 . 1 1 52 52 LYS HD3  H  1   1.504 0.005 . 2 . . . A 52 LYS HD3  . 11443 1 
      609 . 1 1 52 52 LYS HE2  H  1   2.802 0.003 . 2 . . . A 52 LYS HE2  . 11443 1 
      610 . 1 1 52 52 LYS C    C 13 172.719 0.032 . 1 . . . A 52 LYS C    . 11443 1 
      611 . 1 1 52 52 LYS CA   C 13  54.464 0.239 . 1 . . . A 52 LYS CA   . 11443 1 
      612 . 1 1 52 52 LYS CB   C 13  30.954 0.154 . 1 . . . A 52 LYS CB   . 11443 1 
      613 . 1 1 52 52 LYS CG   C 13  22.795 0.139 . 1 . . . A 52 LYS CG   . 11443 1 
      614 . 1 1 52 52 LYS CD   C 13  27.133 0.124 . 1 . . . A 52 LYS CD   . 11443 1 
      615 . 1 1 52 52 LYS CE   C 13  40.276 0.145 . 1 . . . A 52 LYS CE   . 11443 1 
      616 . 1 1 52 52 LYS N    N 15 122.914 0.021 . 1 . . . A 52 LYS N    . 11443 1 
      617 . 1 1 53 53 HIS H    H  1   7.868 0.004 . 1 . . . A 53 HIS H    . 11443 1 
      618 . 1 1 53 53 HIS HA   H  1   4.236 0.014 . 1 . . . A 53 HIS HA   . 11443 1 
      619 . 1 1 53 53 HIS HB2  H  1   2.972 0.010 . 2 . . . A 53 HIS HB2  . 11443 1 
      620 . 1 1 53 53 HIS HB3  H  1   2.839 0.007 . 2 . . . A 53 HIS HB3  . 11443 1 
      621 . 1 1 53 53 HIS HD2  H  1   6.876 0.052 . 1 . . . A 53 HIS HD2  . 11443 1 
      622 . 1 1 53 53 HIS C    C 13 176.420 0.000 . 1 . . . A 53 HIS C    . 11443 1 
      623 . 1 1 53 53 HIS CA   C 13  55.404 0.025 . 1 . . . A 53 HIS CA   . 11443 1 
      624 . 1 1 53 53 HIS CB   C 13  28.645 0.024 . 1 . . . A 53 HIS CB   . 11443 1 
      625 . 1 1 53 53 HIS CD2  C 13 119.820 0.097 . 1 . . . A 53 HIS CD2  . 11443 1 
      626 . 1 1 53 53 HIS N    N 15 125.249 0.024 . 1 . . . A 53 HIS N    . 11443 1 

   stop_

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