=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 5 rings
        ring        int.           center             anis.    iso.
       HIS 21     0.900    57.361   7.728  45.107  -99.200  -91.000
       HIS 26     0.900    62.005  10.090  44.903  -99.200  -91.000
       PHE 31     1.000    53.733  12.975  30.415  -99.200  -91.000
       TYR 58     0.840    52.394  22.431  32.633  -99.200  -91.000
       PHE 59     1.000    59.375  22.675  36.677  -99.200  -91.000