=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 2 rings
        ring        int.           center             anis.    iso.
       TYR 17     0.840    20.939   5.833  18.518  -99.200  -91.000
       HIS 18     0.900    16.646   6.039  21.242  -99.200  -91.000