=============================================================================
          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 13     1.000     8.642   8.735   3.890  -99.200  -91.000
       TYR 31     0.840    -0.410   8.540   5.227  -99.200  -91.000
       TYR 46     0.840    10.872  13.607  14.532  -99.200  -91.000