=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 36 rings
        ring        int.           center             anis.    iso.
       TRP  1     1.040     4.342   0.080  -5.108  -99.200  -91.000
      TRP6  1     1.020     6.166   1.469  -4.570  -99.200  -91.000
       HIS 42     0.900     6.616  13.341  15.570  -99.200  -91.000
       PHE 48     1.000    -0.728   2.229   7.096  -99.200  -91.000
       TYR 49     0.840     4.600   5.872   2.345  -99.200  -91.000
       HIS 51     0.900    -5.200  -1.562   4.767  -99.200  -91.000
       TYR 57     0.840     0.823  -8.289  -0.294  -99.200  -91.000
       PHE 59     1.000     1.840  -1.163  -0.392  -99.200  -91.000
       TYR 62     0.840    14.696   1.637   2.073  -99.200  -91.000
       PHE 69     1.000    21.453  -4.828  17.352  -99.200  -91.000
       PHE 86     1.000    21.120   8.318  15.979  -99.200  -91.000
       PHE 87     1.000    16.829  10.021  25.809  -99.200  -91.000
       HIS 88     0.900    18.247  16.191  22.567  -99.200  -91.000
       TYR 96     0.840     2.382  11.865  16.655  -99.200  -91.000
       HIS 98     0.900     4.252   7.731  25.956  -99.200  -91.000
       HIS 104     0.900     7.446   0.470  19.765  -99.200  -91.000
       PHE 125     1.000     3.994   2.683  15.699  -99.200  -91.000
       PHE 131     1.000    -1.001   6.264  26.952  -99.200  -91.000
       TYR 133     0.840   -11.294   5.988  22.144  -99.200  -91.000
       TYR 149     0.840    16.180  -3.378  24.624  -99.200  -91.000
       PHE 160     1.000     1.864  -3.345  32.935  -99.200  -91.000
       HIS 161     0.900    -0.750   4.744  35.893  -99.200  -91.000
       TRP 168     1.040    13.075   0.054  32.428  -99.200  -91.000
      TRP6 168     1.020    13.639   0.187  34.718  -99.200  -91.000
       TRP 184     1.040    18.173  -4.626  33.391  -99.200  -91.000
      TRP6 184     1.020    18.850  -2.669  34.510  -99.200  -91.000
       TYR 194     0.840    16.389  -4.109  38.412  -99.200  -91.000
       TRP 197     1.040    19.964   0.881  38.106  -99.200  -91.000
      TRP6 197     1.020    21.226   2.740  37.370  -99.200  -91.000
       TYR 203     0.840    31.598  -0.748  42.182  -99.200  -91.000
       TRP 207     1.040    25.375   0.666  35.518  -99.200  -91.000
      TRP6 207     1.020    23.514   1.178  34.174  -99.200  -91.000
       HIS 219     0.900    22.440   6.821  39.343  -99.200  -91.000
       TRP 240     1.040    24.071  13.851  28.380  -99.200  -91.000
      TRP6 240     1.020    22.599  12.638  26.999  -99.200  -91.000
       TYR 241     0.840    16.198  15.918  26.174  -99.200  -91.000