=============================================================================
          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 42     0.900    20.610  28.760  19.137  -99.200  -91.000
       HIS 52     0.900    23.534   5.633   5.256  -99.200  -91.000
       TYR 53     0.840    15.981   5.806   9.437  -99.200  -91.000