=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 21 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    43.341  38.591  42.533  -99.200  -91.000
       PHE  2     1.000    41.285  38.621  37.245  -99.200  -91.000
       TYR  9     0.840    29.678  42.711  33.870  -99.200  -91.000
       TYR 16     0.840    18.893  26.865  34.640  -99.200  -91.000
       HIS 22     0.900    14.378  26.253  42.326  -99.200  -91.000
       PHE 23     1.000    15.027  31.021  35.404  -99.200  -91.000
       HIS 42     0.900     9.663  40.806  42.835  -99.200  -91.000
       TYR 56     0.840    28.521  47.187  43.448  -99.200  -91.000
       TYR 65     0.840    22.895  48.193  44.036  -99.200  -91.000
       TYR 75     0.840    22.029  42.017  53.346  -99.200  -91.000
       PHE 86     1.000    27.792  38.880  46.092  -99.200  -91.000
       HIS 94     0.900    28.776  25.837  29.971  -99.200  -91.000
       TYR 95     0.840    27.876  24.727  34.634  -99.200  -91.000
       TYR 98     0.840    27.887  35.642  39.679  -99.200  -91.000
       HIS 103     0.900    31.996  37.719  54.921  -99.200  -91.000
       TRP 108     1.040    31.787  32.105  53.990  -99.200  -91.000
      TRP6 108     1.020    30.946  33.606  55.630  -99.200  -91.000
       PHE 109     1.000    32.375  29.460  45.787  -99.200  -91.000
       HIS 125     0.900    31.735  22.270  49.439  -99.200  -91.000
       TYR 126     0.840    36.575  27.457  44.338  -99.200  -91.000
       PHE 133     1.000    23.833  30.820  40.722  -99.200  -91.000