=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 21 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    -0.883  27.632  64.355  -99.200  -91.000
       PHE  2     1.000    -0.296  27.929  70.073  -99.200  -91.000
       TYR  9     0.840     9.569  32.442  76.940  -99.200  -91.000
       TYR 16     0.840    20.222  17.161  80.059  -99.200  -91.000
       HIS 22     0.900    26.755  16.215  74.378  -99.200  -91.000
       PHE 23     1.000    24.084  21.309  80.545  -99.200  -91.000
       HIS 42     0.900    31.462  31.152  75.083  -99.200  -91.000
       TYR 56     0.840    13.252  36.960  68.004  -99.200  -91.000
       TYR 65     0.840    19.045  37.929  69.432  -99.200  -91.000
       TYR 75     0.840    23.072  31.708  60.989  -99.200  -91.000
       PHE 86     1.000    15.127  28.452  66.078  -99.200  -91.000
       HIS 94     0.900     9.678  15.920  81.316  -99.200  -91.000
       TYR 95     0.840    12.085  15.087  77.303  -99.200  -91.000
       TYR 98     0.840    13.222  25.587  72.122  -99.200  -91.000
       HIS 103     0.900    14.017  27.114  56.327  -99.200  -91.000
       TRP 108     1.040    14.391  21.243  57.580  -99.200  -91.000
      TRP6 108     1.020    15.532  22.810  56.224  -99.200  -91.000
       PHE 109     1.000    11.092  18.900  65.110  -99.200  -91.000
       HIS 125     0.900    12.860  11.457  62.261  -99.200  -91.000
       TYR 126     0.840     6.641  16.856  65.153  -99.200  -91.000
       PHE 133     1.000    17.530  20.909  72.608  -99.200  -91.000