=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 38 rings
        ring        int.           center             anis.    iso.
       TRP  1     1.040    -3.641  34.407  12.832  -99.200  -91.000
      TRP6  1     1.020    -1.526  33.474  12.318  -99.200  -91.000
       TYR  3     0.840     2.295  31.356   9.025  -99.200  -91.000
       TRP 19     1.040    -1.760  37.015   8.277  -99.200  -91.000
      TRP6 19     1.020     0.534  36.780   8.792  -99.200  -91.000
       PHE 47     1.000    20.816  40.497  24.638  -99.200  -91.000
       TYR 52     0.840    19.031  31.891  27.818  -99.200  -91.000
       TRP 58     1.040    13.107  23.110  29.044  -99.200  -91.000
      TRP6 58     1.020    13.055  25.168  30.204  -99.200  -91.000
       HIS 65     0.900    -1.471  29.850  14.002  -99.200  -91.000
       TYR 86     0.840    13.216  43.442  27.450  -99.200  -91.000
       HIS 92     0.900     7.737  31.349  17.975  -99.200  -91.000
       HIS 94     0.900     8.332  31.577  12.708  -99.200  -91.000
       TRP 95     1.040     9.029  23.312   9.910  -99.200  -91.000
      TRP6 95     1.020     8.044  23.819  11.997  -99.200  -91.000
       HIS 105     0.900    14.231  38.411  11.147  -99.200  -91.000
       HIS 111     0.900    14.667  34.082   2.880  -99.200  -91.000
       PHE 112     1.000    21.380  31.360   7.250  -99.200  -91.000
       HIS 117     0.900    11.669  34.100  15.313  -99.200  -91.000
       HIS 120     0.900    14.399  36.347  26.069  -99.200  -91.000
       PHE 126     1.000     5.973  40.514  23.549  -99.200  -91.000
       PHE 131     1.000    20.125  32.246  19.183  -99.200  -91.000
       PHE 143     1.000    17.727  22.909  18.052  -99.200  -91.000
       HIS 157     0.900    -5.744  23.889  19.283  -99.200  -91.000
       TYR 178     0.840    32.881  37.799  21.825  -99.200  -91.000
       TYR 180     0.840    24.155  41.225  19.583  -99.200  -91.000
       PHE 181     1.000    23.913  41.389  11.291  -99.200  -91.000
       TYR 183     0.840    14.831  44.097  12.585  -99.200  -91.000
       TRP 198     1.040    12.181  41.392  15.623  -99.200  -91.000
      TRP6 198     1.020    11.909  39.045  15.540  -99.200  -91.000
       TYR 201     0.840    22.630  36.263  19.308  -99.200  -91.000
       HIS 208     0.900    21.999  13.875  10.101  -99.200  -91.000
       PHE 212     1.000    14.665  20.981   7.513  -99.200  -91.000
       PHE 215     1.000    11.818  20.773  14.218  -99.200  -91.000
       TYR 220     0.840     0.350  15.451  10.547  -99.200  -91.000
       TYR 221     0.840     0.466  24.816   9.014  -99.200  -91.000
       PHE 245     1.000    21.675  51.331  15.115  -99.200  -91.000
       HIS 248     0.900    32.316  41.642  17.152  -99.200  -91.000