=============================================================================
          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    18.072  47.386   5.911  -99.200  -91.000
       PHE 19     1.000    16.164  50.577   2.466  -99.200  -91.000
       TYR 24     0.840    20.367  41.212   1.429  -99.200  -91.000