=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 19 rings
        ring        int.           center             anis.    iso.
       TYR  4     0.840    -6.188  44.386  -4.371  -99.200  -91.000
       TYR 11     0.840    -7.759  39.220 -10.291  -99.200  -91.000
       TYR 24     0.840    -2.621  30.949   6.748  -99.200  -91.000
       HIS 27     0.900     2.499  28.708   4.928  -99.200  -91.000
       TYR 38     0.840     2.414  28.655  -8.180  -99.200  -91.000
       HIS 40     0.900     6.217  28.825  -5.849  -99.200  -91.000
       PHE 42     1.000     7.066  37.843  -4.048  -99.200  -91.000
       TRP 45     1.040    14.459  36.918  -6.208  -99.200  -91.000
      TRP6 45     1.020    16.480  36.780  -4.970  -99.200  -91.000
       PHE 48     1.000     6.867  44.012  -6.157  -99.200  -91.000
       PHE 50     1.000     4.883  42.648  -0.813  -99.200  -91.000
       TYR 56     0.840     6.759  39.374   2.503  -99.200  -91.000
       TYR 57     0.840     5.107  31.366   2.954  -99.200  -91.000
       TRP 59     1.040    -3.498  30.595  -4.014  -99.200  -91.000
      TRP6 59     1.020    -3.219  28.253  -4.302  -99.200  -91.000
       TYR 68     0.840    -2.897  26.946  -9.716  -99.200  -91.000
       PHE 80     1.000    -0.405  32.957   1.578  -99.200  -91.000
       HIS 92     0.900     5.601  36.425 -13.209  -99.200  -91.000
       PHE 100     1.000     5.915  37.813  -9.565  -99.200  -91.000