=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 9 rings
        ring        int.           center             anis.    iso.
       TYR 20     0.840   159.879  84.186  -0.589  -99.200  -91.000
       PHE 23     1.000   152.314  85.160  -8.013  -99.200  -91.000
       PHE 28     1.000   147.596  73.785   0.706  -99.200  -91.000
       HIS 36     0.900   143.570  71.999   3.346  -99.200  -91.000
       TYR 53     0.840   124.254  85.806  14.858  -99.200  -91.000
       HIS 57     0.900   130.556  88.944   2.673  -99.200  -91.000
       HIS 67     0.900   119.941  87.455  18.058  -99.200  -91.000
       TYR 70     0.840   123.336  87.068  23.850  -99.200  -91.000
       TYR 85     0.840   114.335  87.935  32.765  -99.200  -91.000