=============================================================================
          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 11     0.840     1.338  44.761  28.011  -99.200  -91.000
       HIS 14     0.900    -5.301  42.730  37.000  -99.200  -91.000
       PHE 23     1.000    -0.186  48.665  38.822  -99.200  -91.000
       TYR 27     0.840     8.096  43.291  27.175  -99.200  -91.000
       PHE 31     1.000    15.544  48.504  24.781  -99.200  -91.000
       HIS 32     0.900    22.815  45.895  22.454  -99.200  -91.000
       HIS 52     0.900    12.952  52.290  34.886  -99.200  -91.000
       PHE 57     1.000    21.786  40.524  29.137  -99.200  -91.000
       TRP 61     1.040    24.572  38.450  23.299  -99.200  -91.000
      TRP6 61     1.020    25.335  38.069  25.500  -99.200  -91.000
       PHE 63     1.000    20.655  45.947  26.817  -99.200  -91.000
       TYR 64     0.840    13.700  41.186  29.205  -99.200  -91.000
       TYR 67     0.840    10.245  52.762  30.712  -99.200  -91.000
       TYR 68     0.840     5.817  49.111  36.861  -99.200  -91.000
       PHE 71     1.000    -4.879  52.368  32.754  -99.200  -91.000
       TYR 79     0.840    -4.887  56.445  30.012  -99.200  -91.000
       HIS 85     0.900    17.188  52.161  20.447  -99.200  -91.000
       TRP 96     1.040    -4.585  50.290  26.395  -99.200  -91.000
      TRP6 96     1.020    -6.351  51.034  27.778  -99.200  -91.000