=============================================================================
          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.
       PHE 12     1.000    -2.562   9.298  17.646  -99.200  -91.000
       TYR 28     0.840     3.557   6.208  33.262  -99.200  -91.000