=============================================================================
          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.
       TYR 13     0.840    40.059   7.686  48.589  -99.200  -91.000
       HIS 49     0.900     0.155  18.070  17.236  -99.200  -91.000