=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 46 rings
        ring        int.           center             anis.    iso.
       PHE  1     1.000    61.133  19.938 -31.368  -99.200  -91.000
       TYR  3     0.840    53.571  14.934 -23.744  -99.200  -91.000
       HIS 10     0.900    53.468  21.254 -16.311  -99.200  -91.000
       PHE 17     1.000    50.872  27.865  -5.724  -99.200  -91.000
       HIS 20     0.900    48.849  33.333  -3.757  -99.200  -91.000
       TYR 28     0.840    50.198  35.994   7.615  -99.200  -91.000
       HIS 30     0.900    56.000  42.255   8.113  -99.200  -91.000
       HIS 33     0.900    63.157  42.932  13.824  -99.200  -91.000
       TYR 60     0.840    50.538  43.594  21.786  -99.200  -91.000
       TYR 74     0.840    52.741  29.570  19.325  -99.200  -91.000
       PHE 79     1.000    63.572  27.717  32.217  -99.200  -91.000
       TRP 88     1.040    43.407  34.720  26.003  -99.200  -91.000
      TRP6 88     1.020    41.826  34.942  27.764  -99.200  -91.000
       PHE 94     1.000    48.841  26.767  19.878  -99.200  -91.000
       PHE 99     1.000    53.925  24.068  21.581  -99.200  -91.000
       TRP 101     1.040    58.085  19.475  21.208  -99.200  -91.000
      TRP6 101     1.020    56.972  19.053  19.149  -99.200  -91.000
       TYR 104     0.840    57.670  26.653  16.501  -99.200  -91.000
       PHE 105     1.000    62.264  27.527  22.888  -99.200  -91.000
       TYR 106     0.840    65.736  22.737  17.564  -99.200  -91.000
       TYR 116     0.840    59.741  22.798  11.721  -99.200  -91.000
       PHE 117     1.000    57.979  22.510   5.578  -99.200  -91.000
       TYR 128     0.840    56.805  28.809   6.171  -99.200  -91.000
       TYR 129     0.840    54.016  26.322  13.367  -99.200  -91.000
       TYR 130     0.840    57.587  33.476   8.275  -99.200  -91.000
       TYR 132     0.840    63.659  38.836  15.361  -99.200  -91.000
       TYR 136     0.840    64.511  45.447  28.833  -99.200  -91.000
       TRP 156     1.040    47.021  24.804  -8.737  -99.200  -91.000
      TRP6 156     1.020    49.174  25.124  -9.659  -99.200  -91.000
       TYR 162     0.840    45.248  16.967 -10.637  -99.200  -91.000
       PHE 163     1.000    49.821  23.512  -4.609  -99.200  -91.000
       HIS 169     0.900    63.073  12.389   4.742  -99.200  -91.000
       PHE 173     1.000    53.337  21.754   5.487  -99.200  -91.000
       TRP 179     1.040    47.074  13.046  -4.457  -99.200  -91.000
      TRP6 179     1.020    47.794  14.105  -6.444  -99.200  -91.000
       PHE 181     1.000    49.753  16.236   6.763  -99.200  -91.000
       HIS 182     0.900    48.432  10.112   1.190  -99.200  -91.000
       TYR 201     0.840    55.429  16.430   7.533  -99.200  -91.000
       TRP 211     1.040    52.668   9.278  -9.764  -99.200  -91.000
      TRP6 211     1.020    51.387  10.832  -8.542  -99.200  -91.000
       TRP 222     1.040    56.853  12.594 -10.956  -99.200  -91.000
      TRP6 222     1.020    55.812  13.580  -9.073  -99.200  -91.000
       HIS 228     0.900    46.589   2.382 -10.155  -99.200  -91.000
       TRP 229     1.040    39.309   0.455 -12.198  -99.200  -91.000
      TRP6 229     1.020    38.452  -1.333 -13.489  -99.200  -91.000
       TYR 234     0.840    49.046  12.734 -12.893  -99.200  -91.000