=============================================================================
          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.
       HIS 44     0.900   -13.634  13.704  -6.522  -99.200  -91.000
       TYR 54     0.840   -13.272  -3.693   1.025  -99.200  -91.000