=============================================================================
          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    -0.675  27.535  64.473  -99.200  -91.000
       PHE  2     1.000    -0.367  27.829  70.140  -99.200  -91.000
       TYR  9     0.840     9.332  32.526  76.986  -99.200  -91.000
       TYR 16     0.840    20.427  17.509  80.190  -99.200  -91.000
       HIS 22     0.900    26.863  16.715  74.487  -99.200  -91.000
       PHE 23     1.000    24.106  21.563  80.689  -99.200  -91.000
       HIS 42     0.900    31.282  31.669  75.271  -99.200  -91.000
       TYR 56     0.840    13.020  37.020  68.051  -99.200  -91.000
       TYR 65     0.840    18.706  38.021  69.361  -99.200  -91.000
       TYR 75     0.840    22.859  31.847  61.031  -99.200  -91.000
       PHE 86     1.000    15.002  28.459  66.145  -99.200  -91.000
       HIS 94     0.900     9.653  15.895  81.506  -99.200  -91.000
       TYR 95     0.840    12.225  15.030  77.506  -99.200  -91.000
       TYR 98     0.840    13.153  25.492  72.193  -99.200  -91.000
       HIS 103     0.900    13.840  27.110  56.416  -99.200  -91.000
       TRP 108     1.040    14.341  21.338  57.657  -99.200  -91.000
      TRP6 108     1.020    15.452  22.939  56.331  -99.200  -91.000
       PHE 109     1.000    11.102  18.885  65.172  -99.200  -91.000
       HIS 125     0.900    12.935  11.500  62.413  -99.200  -91.000
       TYR 126     0.840     6.619  16.782  65.317  -99.200  -91.000
       PHE 133     1.000    17.517  21.030  72.695  -99.200  -91.000