=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 45 rings
        ring        int.           center             anis.    iso.
       HIS  3     0.900     3.671  20.839  27.658  -99.200  -91.000
       TYR  7     0.840    15.397  12.213  22.231  -99.200  -91.000
       PHE  8     1.000    16.446  11.862  30.704  -99.200  -91.000
       TYR  9     0.840    22.289   9.639  23.792  -99.200  -91.000
       PHE 22     1.000    23.635   4.829  23.245  -99.200  -91.000
       TYR 27     0.840    11.349   9.544  30.416  -99.200  -91.000
       PHE 33     1.000     9.608  10.921  22.612  -99.200  -91.000
       PHE 36     1.000    19.609   1.474  19.842  -99.200  -91.000
       TRP 51     1.040     2.082  10.790  22.685  -99.200  -91.000
      TRP6 51     1.020     4.304  11.489  22.316  -99.200  -91.000
       TYR 59     0.840    10.314   9.776  14.475  -99.200  -91.000
       TRP 60     1.040     8.919   4.843  13.918  -99.200  -91.000
      TRP6 60     1.020     9.329   5.162  16.229  -99.200  -91.000
       TYR 74     0.840    27.467   8.928  23.834  -99.200  -91.000
       TYR 84     0.840    40.622  12.208  27.230  -99.200  -91.000
       TYR 85     0.840    38.363  11.217  34.265  -99.200  -91.000
       HIS 93     0.900    35.444   2.980  34.989  -99.200  -91.000
       TYR 99     0.840    20.179  15.084  22.901  -99.200  -91.000
       TYR 113     0.840    17.924  22.052  30.324  -99.200  -91.000
       TYR 118     0.840    34.348   7.905  33.155  -99.200  -91.000
       TYR 123     0.840    34.286  14.030  30.284  -99.200  -91.000
       TRP 133     1.040    31.431  23.133  24.524  -99.200  -91.000
      TRP6 133     1.020    29.697  21.543  24.241  -99.200  -91.000
       TRP 147     1.040    33.258  17.546  21.838  -99.200  -91.000
      TRP6 147     1.020    31.623  16.988  23.445  -99.200  -91.000
       TYR 159     0.840    18.206  18.321  18.803  -99.200  -91.000
       TYR 171     0.840     8.095  14.139  18.983  -99.200  -91.000
       HIS 188     0.900    -6.276   9.172  51.326  -99.200  -91.000
       HIS 191     0.900    -5.809  10.017  64.163  -99.200  -91.000
       HIS 192     0.900    -2.266   5.474  59.581  -99.200  -91.000
       HIS 197     0.900    -0.879  10.510  76.260  -99.200  -91.000
       TRP 204     1.040    -1.970   8.577  52.092  -99.200  -91.000
      TRP6 204     1.020    -0.620   7.002  50.964  -99.200  -91.000
       PHE 208     1.000     1.124  13.477  42.166  -99.200  -91.000
       TYR 209     0.840     1.731  13.475  32.898  -99.200  -91.000
       TRP 217     1.040     1.450  17.068  56.939  -99.200  -91.000
      TRP6 217     1.020    -0.812  17.109  57.625  -99.200  -91.000
       PHE 241     1.000     4.970  10.385  37.677  -99.200  -91.000
       TRP 244     1.040     3.485   8.276  51.857  -99.200  -91.000
      TRP6 244     1.020     4.919   8.558  53.720  -99.200  -91.000
       TYR 257     0.840     0.454  19.483  63.584  -99.200  -91.000
       HIS 260     0.900    -1.548  24.737  53.839  -99.200  -91.000
       HIS 263     0.900    -0.547  18.142  39.624  -99.200  -91.000
       TRP 274     1.040    -8.273  13.050  61.987  -99.200  -91.000
      TRP6 274     1.020    -8.739  11.085  60.754  -99.200  -91.000