=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 24 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    24.142  41.190  22.473  -99.200  -91.000
       HIS 12     0.900     8.245  24.137   8.173  -99.200  -91.000
       HIS 18     0.900    19.615  28.670   1.259  -99.200  -91.000
       HIS 27     0.900    27.782  39.834  10.318  -99.200  -91.000
       PHE 31     1.000    23.521  37.587  14.204  -99.200  -91.000
       TYR 33     0.840    20.591  25.792  14.676  -99.200  -91.000
       HIS 37     0.900    20.653  18.001  24.239  -99.200  -91.000
       TYR 49     0.840    21.974  16.084  14.930  -99.200  -91.000
       TYR 50     0.840    25.280  19.631  23.144  -99.200  -91.000
       PHE 51     1.000    25.033  12.145  18.786  -99.200  -91.000
       HIS 54     0.900    12.182   7.486  24.217  -99.200  -91.000
       TYR 66     0.840    14.870  18.533  25.079  -99.200  -91.000
       TYR 69     0.840     8.443  18.027  22.726  -99.200  -91.000
       HIS 72     0.900    13.462  11.592   9.972  -99.200  -91.000
       TYR 77     0.840    16.660  13.820  15.066  -99.200  -91.000
       HIS 88     0.900    20.340  33.636  25.174  -99.200  -91.000
       PHE 111     1.000    15.148  30.898  27.458  -99.200  -91.000
       PHE 114     1.000    14.149  42.180  16.167  -99.200  -91.000
       PHE 117     1.000     5.370  35.871   8.550  -99.200  -91.000
       TYR 147     0.840     0.463  31.135  14.950  -99.200  -91.000
       HIS 149     0.900    -0.480  39.856  20.900  -99.200  -91.000
       TYR 150     0.840     2.002  35.696  20.562  -99.200  -91.000
       PHE 151     1.000     4.141  37.584  12.709  -99.200  -91.000
       HIS 166     0.900    14.319  45.447   7.304  -99.200  -91.000