=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 12 rings
        ring        int.           center             anis.    iso.
       TYR 12     0.840     7.748  24.158 -18.010  -99.200  -91.000
       HIS 14     0.900     1.700  29.120  -9.937  -99.200  -91.000
       PHE 18     1.000    16.422  22.210 -16.650  -99.200  -91.000
       PHE 22     1.000     4.775  16.230 -10.015  -99.200  -91.000
       HIS 23     0.900     9.732  21.687 -14.335  -99.200  -91.000
       HIS 43     0.900    -5.452  29.855 -16.336  -99.200  -91.000
       PHE 46     1.000    -1.357  25.159 -12.007  -99.200  -91.000
       PHE 70     1.000    -5.238  15.894 -19.147  -99.200  -91.000
       HIS 79     0.900     8.551   6.949 -31.479  -99.200  -91.000
       TRP 107     1.040     1.536   4.136 -15.548  -99.200  -91.000
      TRP6 107     1.020     3.739   3.260 -15.622  -99.200  -91.000
       PHE 111     1.000    10.628  10.145 -21.770  -99.200  -91.000