=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 5 rings
        ring        int.           center             anis.    iso.
       PHE 23     1.000     4.850  41.468  -0.141  -99.200  -91.000
       PHE 30     1.000    -3.503  45.325   3.654  -99.200  -91.000
       HIS 31     0.900    -7.733  52.718   3.321  -99.200  -91.000
       PHE 35     1.000     7.556  53.000   3.146  -99.200  -91.000
       TYR 78     0.840     1.785  36.855  -0.667  -99.200  -91.000