=============================================================================
          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    -0.769  27.769  64.922  -99.200  -91.000
       PHE  2     1.000    -0.195  28.004  70.634  -99.200  -91.000
       TYR  9     0.840     9.419  32.721  77.675  -99.200  -91.000
       TYR 16     0.840    20.515  17.513  81.153  -99.200  -91.000
       HIS 22     0.900    26.782  16.629  75.255  -99.200  -91.000
       PHE 23     1.000    23.915  21.691  81.493  -99.200  -91.000
       HIS 42     0.900    31.259  31.595  76.259  -99.200  -91.000
       TYR 56     0.840    12.953  37.096  68.729  -99.200  -91.000
       TYR 65     0.840    18.925  38.201  69.860  -99.200  -91.000
       TYR 75     0.840    23.166  32.018  61.711  -99.200  -91.000
       PHE 86     1.000    15.354  28.793  66.843  -99.200  -91.000
       HIS 94     0.900     9.759  16.248  82.255  -99.200  -91.000
       TYR 95     0.840    12.176  15.080  78.150  -99.200  -91.000
       TYR 98     0.840    13.230  25.749  72.950  -99.200  -91.000
       HIS 103     0.900    14.248  27.338  57.150  -99.200  -91.000
       TRP 108     1.040    14.688  21.379  58.393  -99.200  -91.000
      TRP6 108     1.020    15.814  22.956  57.025  -99.200  -91.000
       PHE 109     1.000    11.208  19.152  65.915  -99.200  -91.000
       HIS 125     0.900    13.226  11.752  62.965  -99.200  -91.000
       TYR 126     0.840     6.897  16.744  66.142  -99.200  -91.000
       PHE 133     1.000    17.668  21.152  73.474  -99.200  -91.000