=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 3 rings
        ring        int.           center             anis.    iso.
       HIS 16     0.900    23.727  -5.518  18.252  -99.200  -91.000
       PHE 19     1.000    25.300  -8.559  21.430  -99.200  -91.000
       TYR 24     0.840    28.807   0.798  19.260  -99.200  -91.000