=============================================================================
          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  1     1.000    25.082  -1.616  16.063  -99.200  -91.000
       HIS  3     0.900    22.678   3.764  16.326  -99.200  -91.000