=============================================================================
          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    43.606  39.115  42.431  -99.200  -91.000
       PHE  2     1.000    41.326  39.290  37.081  -99.200  -91.000
       TYR  9     0.840    30.006  43.753  33.206  -99.200  -91.000
       TYR 16     0.840    18.560  28.198  34.199  -99.200  -91.000
       HIS 22     0.900    14.243  27.656  41.781  -99.200  -91.000
       PHE 23     1.000    14.727  32.365  34.789  -99.200  -91.000
       HIS 42     0.900     9.573  42.485  41.790  -99.200  -91.000
       TYR 56     0.840    28.349  48.630  42.992  -99.200  -91.000
       TYR 65     0.840    23.280  49.438  43.827  -99.200  -91.000
       TYR 75     0.840    21.893  43.548  52.529  -99.200  -91.000
       PHE 86     1.000    27.775  39.947  45.482  -99.200  -91.000
       HIS 94     0.900    28.611  26.893  29.616  -99.200  -91.000
       TYR 95     0.840    27.671  26.054  34.350  -99.200  -91.000
       TYR 98     0.840    27.857  36.793  39.249  -99.200  -91.000
       HIS 103     0.900    31.751  38.632  54.601  -99.200  -91.000
       TRP 108     1.040    31.195  33.199  53.608  -99.200  -91.000
      TRP6 108     1.020    30.333  34.776  55.163  -99.200  -91.000
       PHE 109     1.000    32.071  30.511  45.472  -99.200  -91.000
       HIS 125     0.900    31.206  23.384  49.305  -99.200  -91.000
       TYR 126     0.840    36.340  28.471  44.174  -99.200  -91.000
       PHE 133     1.000    23.658  32.107  40.222  -99.200  -91.000