=============================================================================
          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 13     1.000    -2.726  43.543  17.802  -99.200  -91.000
       TYR 29     0.840     3.447  40.561  33.559  -99.200  -91.000