=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 23 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    43.384  39.007  42.181  -99.200  -91.000
       PHE  2     1.000    41.106  39.107  36.942  -99.200  -91.000
       TYR  9     0.840    29.665  43.524  33.278  -99.200  -91.000
       TYR 16     0.840    17.946  28.154  34.736  -99.200  -91.000
       HIS 22     0.900    14.195  27.236  42.191  -99.200  -91.000
       PHE 23     1.000    14.273  32.163  35.141  -99.200  -91.000
       HIS 42     0.900     9.039  42.391  42.009  -99.200  -91.000
       PHE 45     1.000    18.225  40.453  39.794  -99.200  -91.000
       TYR 56     0.840    28.638  48.539  42.568  -99.200  -91.000
       TYR 65     0.840    23.140  49.455  44.110  -99.200  -91.000
       TYR 75     0.840    21.641  43.421  52.782  -99.200  -91.000
       PHE 86     1.000    27.498  39.984  45.580  -99.200  -91.000
       HIS 94     0.900    27.975  26.765  29.745  -99.200  -91.000
       TYR 95     0.840    27.039  25.908  34.512  -99.200  -91.000
       TYR 98     0.840    27.494  36.730  39.284  -99.200  -91.000
       HIS 103     0.900    31.712  38.780  54.650  -99.200  -91.000
       TRP 108     1.040    31.149  33.184  53.599  -99.200  -91.000
      TRP6 108     1.020    30.325  34.749  55.160  -99.200  -91.000
       PHE 109     1.000    31.965  30.349  45.710  -99.200  -91.000
       HIS 125     0.900    31.211  23.372  49.455  -99.200  -91.000
       TYR 126     0.840    36.126  28.331  44.240  -99.200  -91.000
       TRP 133     1.040    24.383  32.139  40.332  -99.200  -91.000
      TRP6 133     1.020    22.076  32.389  40.806  -99.200  -91.000