=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 17 rings
        ring        int.           center             anis.    iso.
       TYR  6     0.840    19.306   3.337   9.278  -99.200  -91.000
       PHE  8     1.000    16.005  -4.058  -0.180  -99.200  -91.000
       HIS 17     0.900    15.524 -10.854  13.467  -99.200  -91.000
       TYR 32     0.840     1.841  -3.129   9.842  -99.200  -91.000
       HIS 36     0.900     2.816  -6.567   8.566  -99.200  -91.000
       TYR 45     0.840     1.637  12.253  10.190  -99.200  -91.000
       HIS 48     0.900    -4.872   6.771  15.812  -99.200  -91.000
       PHE 52     1.000     5.649   7.400  17.407  -99.200  -91.000
       PHE 59     1.000     1.830   5.058  20.972  -99.200  -91.000
       PHE 76     1.000     9.449   7.714  13.713  -99.200  -91.000
       TYR 77     0.840     9.004   1.391   7.798  -99.200  -91.000
       HIS 94     0.900     5.610  16.258  20.581  -99.200  -91.000
       TYR 96     0.840     9.647   8.296  21.182  -99.200  -91.000
       TYR 102     0.840    13.173   1.562   3.908  -99.200  -91.000
       TRP 108     1.040    10.515  -4.618   2.780  -99.200  -91.000
      TRP6 108     1.020    12.617  -4.905   3.849  -99.200  -91.000
       HIS 111     0.900    15.341  -1.463  -3.782  -99.200  -91.000