=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 25 rings
        ring        int.           center             anis.    iso.
       HIS  2     0.900     1.909 -16.467 -15.637  -99.200  -91.000
       TYR  7     0.840    -4.458  -1.220  -7.783  -99.200  -91.000
       PHE 32     1.000    16.041  -8.715 -12.922  -99.200  -91.000
       PHE 37     1.000    13.590  -0.458  -8.428  -99.200  -91.000
       HIS 42     0.900    -1.562   3.159 -10.477  -99.200  -91.000
       PHE 47     1.000     9.940   4.599  -8.427  -99.200  -91.000
       PHE 50     1.000     8.961   0.489  -1.448  -99.200  -91.000
       PHE 51     1.000    11.781   1.738  -5.173  -99.200  -91.000
       TYR 53     0.840    11.394   4.748   6.104  -99.200  -91.000
       HIS 54     0.900    15.776  -0.674  -0.749  -99.200  -91.000
       TYR 82     0.840     8.935  -8.176  -5.653  -99.200  -91.000
       HIS 87     0.900    14.493  -7.756  -0.615  -99.200  -91.000
       TYR 94     0.840    24.060  -7.920  -1.138  -99.200  -91.000
       TYR 108     0.840    14.130 -17.464  12.990  -99.200  -91.000
       PHE 122     1.000    14.571  -6.178  18.447  -99.200  -91.000
       HIS 131     0.900     1.635  -6.457  21.251  -99.200  -91.000
       PHE 138     1.000    15.676  -2.559  22.315  -99.200  -91.000
       HIS 144     0.900    23.945 -13.713  20.258  -99.200  -91.000
       PHE 146     1.000    23.046  -8.317  15.892  -99.200  -91.000
       TRP 152     1.040    16.127   3.344  14.434  -99.200  -91.000
      TRP6 152     1.020    15.317   5.061  15.829  -99.200  -91.000
       PHE 160     1.000    10.946   0.116   2.991  -99.200  -91.000
       PHE 161     1.000    12.786  -4.468   3.013  -99.200  -91.000
       PHE 177     1.000    14.564 -10.292  -8.119  -99.200  -91.000
       PHE 178     1.000    10.456 -17.303  -8.930  -99.200  -91.000