=============================================================================
          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    13.229  -6.294   3.106  -99.200  -91.000
       HIS 14     0.900     9.026 -13.993  -3.561  -99.200  -91.000
       PHE 23     1.000     8.060  -8.713  -7.180  -99.200  -91.000
       TYR 27     0.840     9.986  -1.616   7.276  -99.200  -91.000
       PHE 31     1.000    10.530   7.817   7.599  -99.200  -91.000
       HIS 32     0.900     7.527  12.870  13.307  -99.200  -91.000
       HIS 52     0.900     5.578   6.007  -2.102  -99.200  -91.000
       PHE 57     1.000     0.504   7.530  12.540  -99.200  -91.000
       TRP 61     1.040     2.782   9.511  18.614  -99.200  -91.000
      TRP6 61     1.020     0.560   9.376  17.805  -99.200  -91.000
       PHE 63     1.000     5.336  10.209   9.911  -99.200  -91.000
       TYR 64     0.840     4.749   1.358   9.023  -99.200  -91.000
       TYR 67     0.840    10.127   4.815  -1.181  -99.200  -91.000
       TYR 68     0.840     6.293  -2.035  -3.905  -99.200  -91.000
       PHE 71     1.000    16.464  -7.766  -7.034  -99.200  -91.000
       TYR 79     0.840    20.106  -5.158  -8.724  -99.200  -91.000
       HIS 85     0.900    14.313  12.183   8.031  -99.200  -91.000
       TRP 96     1.040    19.748  -7.615  -1.781  -99.200  -91.000
      TRP6 96     1.020    20.191  -9.048  -3.601  -99.200  -91.000