=============================================================================
          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    -6.696   7.098  40.430  -99.200  -91.000
       PHE  2     1.000    -2.634   7.381  37.269  -99.200  -91.000
       TYR  9     0.840     8.842   3.845  33.634  -99.200  -91.000
       TYR 16     0.840    19.471  19.878  33.271  -99.200  -91.000
       HIS 22     0.900    23.592  21.045  40.641  -99.200  -91.000
       PHE 23     1.000    23.181  15.833  33.750  -99.200  -91.000
       HIS 42     0.900    29.214   6.698  41.085  -99.200  -91.000
       TYR 56     0.840    10.447  -0.623  42.917  -99.200  -91.000
       TYR 65     0.840    16.354  -1.039  43.333  -99.200  -91.000
       TYR 75     0.840    17.637   5.375  52.452  -99.200  -91.000
       PHE 86     1.000    11.277   8.031  45.559  -99.200  -91.000
       HIS 94     0.900     8.902  21.699  30.242  -99.200  -91.000
       TYR 95     0.840     9.652  21.959  34.120  -99.200  -91.000
       TYR 98     0.840    10.652  11.022  39.176  -99.200  -91.000
       HIS 103     0.900     7.468   9.277  54.622  -99.200  -91.000
       TRP 108     1.040     7.589  14.838  53.559  -99.200  -91.000
      TRP6 108     1.020     8.532  13.354  55.149  -99.200  -91.000
       PHE 109     1.000     6.368  17.410  45.347  -99.200  -91.000
       HIS 125     0.900     6.661  23.148  51.066  -99.200  -91.000
       TYR 126     0.840     2.149  19.404  43.984  -99.200  -91.000
       PHE 133     1.000    14.582  15.975  39.810  -99.200  -91.000