=============================================================================
          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    -5.180   8.630  20.714  -99.200  -91.000
       PHE 19     1.000    -4.388  14.698  13.082  -99.200  -91.000
       TYR 24     0.840    -8.441  11.636  25.564  -99.200  -91.000