=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 28 rings
        ring        int.           center             anis.    iso.
       PHE  9     1.000    17.853  39.630  21.007  -99.200  -91.000
       HIS 44     0.900     1.777  26.994  21.573  -99.200  -91.000
       HIS 45     0.900     8.759  26.432  17.518  -99.200  -91.000
       TYR 52     0.840     9.681  27.942  29.146  -99.200  -91.000
       PHE 53     1.000    16.767  35.015  24.128  -99.200  -91.000
       PHE 56     1.000    13.808  26.601  25.130  -99.200  -91.000
       TYR 83     0.840     5.561   2.987  23.223  -99.200  -91.000
       PHE 91     1.000    22.860  11.108  27.751  -99.200  -91.000
       HIS 107     0.900     4.835  -1.189  19.813  -99.200  -91.000
       PHE 110     1.000     5.438   3.939  12.392  -99.200  -91.000
       HIS 122     0.900     0.011  12.621  18.596  -99.200  -91.000
       PHE 133     1.000    11.265  15.039  31.407  -99.200  -91.000
       PHE 145     1.000     6.164  17.063  22.341  -99.200  -91.000
       TYR 157     0.840    17.102  20.569  38.181  -99.200  -91.000
       HIS 159     0.900    10.441  25.425  32.267  -99.200  -91.000
       TYR 172     0.840    14.991   2.702  17.297  -99.200  -91.000
       TYR 173     0.840    18.274  -0.993  16.526  -99.200  -91.000
       TYR 178     0.840    21.695  11.504  10.018  -99.200  -91.000
       PHE 179     1.000    18.266  11.774  13.605  -99.200  -91.000
       PHE 185     1.000    31.136   6.687  13.395  -99.200  -91.000
       HIS 192     0.900    34.699   0.764   5.642  -99.200  -91.000
       PHE 198     1.000    26.941  -3.367   1.593  -99.200  -91.000
       TYR 203     0.840    15.181   8.388   5.926  -99.200  -91.000
       PHE 227     1.000    29.582   0.366  13.653  -99.200  -91.000
       TYR 229     0.840    23.894  -5.856   6.427  -99.200  -91.000
       TRP 232     1.040    35.232   0.256   9.041  -99.200  -91.000
      TRP6 232     1.020    34.435   2.389   9.592  -99.200  -91.000
       TYR 234     0.840    29.002  -1.543  18.157  -99.200  -91.000