=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 37 rings
        ring        int.           center             anis.    iso.
       TYR  4     0.840    -2.590  13.101  56.799  -99.200  -91.000
       PHE  5     1.000    -5.914  13.635  52.920  -99.200  -91.000
       TYR  8     0.840     0.926  19.609  57.832  -99.200  -91.000
       HIS 12     0.900    -5.412  20.112  47.138  -99.200  -91.000
       PHE 13     1.000    -1.561  16.677  52.736  -99.200  -91.000
       HIS 14     0.900    -6.008  14.819  44.301  -99.200  -91.000
       HIS 26     0.900    -1.286  25.750  48.556  -99.200  -91.000
       PHE 34     1.000    11.647  25.555  52.638  -99.200  -91.000
       HIS 39     0.900    14.088  23.902  57.782  -99.200  -91.000
       PHE 42     1.000     6.602  21.944  53.091  -99.200  -91.000
       PHE 46     1.000     7.621  16.033  53.292  -99.200  -91.000
       TYR 47     0.840     6.040  10.380  62.520  -99.200  -91.000
       TRP 67     1.040     9.260  20.033  43.129  -99.200  -91.000
      TRP6 67     1.020    10.911  20.264  44.832  -99.200  -91.000
       PHE 73     1.000    17.303  33.630  50.715  -99.200  -91.000
       TRP 85     1.040    22.155  25.904  61.812  -99.200  -91.000
      TRP6 85     1.020    21.450  26.411  59.602  -99.200  -91.000
       TYR 89     0.840    21.714  19.646  64.229  -99.200  -91.000
       TRP 90     1.040    14.963  18.177  66.538  -99.200  -91.000
      TRP6 90     1.020    12.679  18.051  65.903  -99.200  -91.000
       HIS 117     0.900    15.083  23.283  51.279  -99.200  -91.000
       TYR 120     0.840    11.879  18.995  50.875  -99.200  -91.000
       PHE 135     1.000    15.870  18.344  38.347  -99.200  -91.000
       HIS 140     0.900    22.376  25.023  50.420  -99.200  -91.000
       HIS 152     0.900    25.536  16.916  53.162  -99.200  -91.000
       TRP 155     1.040    21.446  17.589  43.866  -99.200  -91.000
      TRP6 155     1.020    20.706  17.046  41.673  -99.200  -91.000
       TYR 162     0.840    35.043  10.819  41.309  -99.200  -91.000
       TYR 166     0.840    31.580  21.054  36.730  -99.200  -91.000
       PHE 167     1.000    23.725  20.003  40.651  -99.200  -91.000
       PHE 169     1.000    33.367  22.299  46.302  -99.200  -91.000
       TYR 180     0.840    15.568  10.452  29.400  -99.200  -91.000
       HIS 186     0.900    14.152   8.008  37.373  -99.200  -91.000
       TRP 199     1.040    -2.653  11.666  39.793  -99.200  -91.000
      TRP6 199     1.020    -3.978  10.639  41.481  -99.200  -91.000
       TYR 215     0.840     6.639  -5.439  54.617  -99.200  -91.000
       TYR 234     0.840    31.158  16.388  59.867  -99.200  -91.000