=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 20 rings
        ring        int.           center             anis.    iso.
       PHE  6     1.000    22.281  -3.915  30.127  -99.200  -91.000
       HIS  8     0.900    22.208  -0.819  24.272  -99.200  -91.000
       PHE 10     1.000    22.470   3.396  18.107  -99.200  -91.000
       HIS 15     0.900    23.326   3.998   9.974  -99.200  -91.000
       HIS 20     0.900    18.587   6.686   6.349  -99.200  -91.000
       TYR 22     0.840     8.684   0.085   6.934  -99.200  -91.000
       PHE 28     1.000     7.034   6.307   7.459  -99.200  -91.000
       PHE 31     1.000     8.565  13.060   9.797  -99.200  -91.000
       PHE 35     1.000    16.677   6.371  17.745  -99.200  -91.000
       PHE 39     1.000    15.923   2.483  12.241  -99.200  -91.000
       TRP 46     1.040    21.270  -4.342  21.105  -99.200  -91.000
      TRP6 46     1.020    22.390  -2.665  19.825  -99.200  -91.000
       TYR 55     0.840    15.280 -16.526  32.940  -99.200  -91.000
       HIS 71     0.900     9.911   8.724  19.576  -99.200  -91.000
       TRP 97     1.040    13.921  -5.968  31.380  -99.200  -91.000
      TRP6 97     1.020    13.519  -7.879  30.035  -99.200  -91.000
       HIS 102     0.900    19.289  10.427  29.150  -99.200  -91.000
       HIS 113     0.900    10.288  -5.686  24.652  -99.200  -91.000
       HIS 119     0.900    14.414 -26.053  21.163  -99.200  -91.000
       PHE 123     1.000    10.222 -18.250  16.226  -99.200  -91.000