=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 40 rings
        ring        int.           center             anis.    iso.
       HIS 22     0.900    53.031  29.632  17.002  -99.200  -91.000
       PHE 25     1.000    56.875  41.251  15.415  -99.200  -91.000
       TRP 35     1.040    52.020  34.642   2.188  -99.200  -91.000
      TRP6 35     1.020    49.671  34.661   1.872  -99.200  -91.000
       TYR 42     0.840    54.840  31.034   9.069  -99.200  -91.000
       PHE 45     1.000    44.929  22.998  10.600  -99.200  -91.000
       HIS 56     0.900    44.083  35.588   9.182  -99.200  -91.000
       HIS 58     0.900    33.834  35.580   3.224  -99.200  -91.000
       HIS 74     0.900    33.002  56.088  18.818  -99.200  -91.000
       PHE 77     1.000    22.957  51.882  19.952  -99.200  -91.000
       TYR 82     0.840    26.411  52.792  15.984  -99.200  -91.000
       TYR 85     0.840    24.366  48.493  19.967  -99.200  -91.000
       PHE 100     1.000    13.919  32.285  26.612  -99.200  -91.000
       PHE 133     1.000    30.339  24.512  36.342  -99.200  -91.000
       TYR 137     0.840    40.622  32.949  29.343  -99.200  -91.000
       HIS 138     0.900    33.873  31.923  32.356  -99.200  -91.000
       HIS 142     0.900    41.604  43.809  39.198  -99.200  -91.000
       TYR 143     0.840    32.770  39.066  39.159  -99.200  -91.000
       TYR 154     0.840    44.997  32.313  31.605  -99.200  -91.000
       HIS 164     0.900    31.593  38.142  48.601  -99.200  -91.000
       TYR 166     0.840    31.072  31.680  46.889  -99.200  -91.000
       TYR 170     0.840    32.958  21.873  31.712  -99.200  -91.000
       HIS 175     0.900    41.907  14.287  32.290  -99.200  -91.000
       HIS 187     0.900    22.548  20.222  44.754  -99.200  -91.000
       PHE 190     1.000    23.386  26.055  45.232  -99.200  -91.000
       PHE 213     1.000    39.000  23.387  21.485  -99.200  -91.000
       TYR 214     0.840    38.830  18.192  28.928  -99.200  -91.000
       PHE 220     1.000    26.926  19.461  34.094  -99.200  -91.000
       HIS 231     0.900    18.172  25.882  44.543  -99.200  -91.000
       PHE 251     1.000    25.398  31.973  19.778  -99.200  -91.000
       PHE 265     1.000    26.773  38.321  20.841  -99.200  -91.000
       PHE 273     1.000    37.061  43.652  10.464  -99.200  -91.000
       TYR 297     0.840    37.095  52.678  21.556  -99.200  -91.000
       PHE 314     1.000    29.330  30.681  10.564  -99.200  -91.000
       HIS 341     0.900    53.051   8.706  16.122  -99.200  -91.000
       PHE 359     1.000    45.817  11.558  28.587  -99.200  -91.000
       HIS 364     0.900    43.628   8.099  29.047  -99.200  -91.000
       TYR 392     0.840    46.310  18.680  34.988  -99.200  -91.000
       TYR 393     0.840    50.215  24.363  31.608  -99.200  -91.000
       PHE 420     1.000    51.288  13.665  17.672  -99.200  -91.000