=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 12 rings
        ring        int.           center             anis.    iso.
       TYR 12     0.840    32.083  35.095 -12.166  -99.200  -91.000
       PHE 13     1.000    21.949  37.867 -14.986  -99.200  -91.000
       HIS 21     0.900     7.328  28.118 -30.805  -99.200  -91.000
       PHE 22     1.000     8.484  35.674 -28.784  -99.200  -91.000
       HIS 35     0.900    17.104  46.578 -12.146  -99.200  -91.000
       HIS 39     0.900     9.414  44.056 -25.077  -99.200  -91.000
       HIS 42     0.900     5.485  36.044 -35.062  -99.200  -91.000
       HIS 49     0.900    -9.422  41.454 -45.755  -99.200  -91.000
       PHE 51     1.000    -2.990  42.641 -34.568  -99.200  -91.000
       PHE 56     1.000     9.781  36.773 -22.015  -99.200  -91.000
       HIS 57     0.900    10.421  44.092 -20.516  -99.200  -91.000
       TYR 60     0.840    16.178  37.674 -15.975  -99.200  -91.000