=============================================================================
          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.
       PHE  1     1.000   -25.108  69.757  81.152  -99.200  -91.000
       PHE 14     1.000    -1.771  49.082  82.956  -99.200  -91.000
       TYR 30     0.840    -9.275  42.048  68.897  -99.200  -91.000