=============================================================================
          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    52.990  29.538  16.984  -99.200  -91.000
       PHE 25     1.000    56.537  41.276  15.316  -99.200  -91.000
       TRP 35     1.040    51.868  34.276   2.210  -99.200  -91.000
      TRP6 35     1.020    49.514  34.252   1.975  -99.200  -91.000
       TYR 42     0.840    54.790  30.879   9.165  -99.200  -91.000
       PHE 45     1.000    45.038  22.791  10.939  -99.200  -91.000
       HIS 56     0.900    43.854  35.232   9.176  -99.200  -91.000
       HIS 58     0.900    33.650  35.274   3.044  -99.200  -91.000
       HIS 74     0.900    32.703  55.922  18.561  -99.200  -91.000
       PHE 77     1.000    22.356  51.610  19.618  -99.200  -91.000
       TYR 82     0.840    26.060  52.457  15.778  -99.200  -91.000
       TYR 85     0.840    24.050  48.248  19.673  -99.200  -91.000
       PHE 100     1.000    13.423  32.033  26.536  -99.200  -91.000
       PHE 133     1.000    30.204  24.537  36.267  -99.200  -91.000
       TYR 137     0.840    40.471  32.953  29.415  -99.200  -91.000
       HIS 138     0.900    33.672  31.719  32.414  -99.200  -91.000
       HIS 142     0.900    41.301  43.878  39.031  -99.200  -91.000
       TYR 143     0.840    32.480  38.916  38.962  -99.200  -91.000
       TYR 154     0.840    44.963  32.589  31.796  -99.200  -91.000
       HIS 164     0.900    31.254  38.102  48.547  -99.200  -91.000
       TYR 166     0.840    30.942  31.622  46.921  -99.200  -91.000
       TYR 170     0.840    32.719  21.740  31.824  -99.200  -91.000
       HIS 175     0.900    41.920  14.242  32.827  -99.200  -91.000
       HIS 187     0.900    22.542  19.913  44.911  -99.200  -91.000
       PHE 190     1.000    23.147  25.888  45.237  -99.200  -91.000
       PHE 213     1.000    38.790  23.196  21.624  -99.200  -91.000
       TYR 214     0.840    38.874  18.271  29.241  -99.200  -91.000
       PHE 220     1.000    26.870  19.388  34.273  -99.200  -91.000
       HIS 231     0.900    17.920  25.798  44.628  -99.200  -91.000
       PHE 251     1.000    24.941  31.684  19.856  -99.200  -91.000
       PHE 265     1.000    26.362  37.854  20.757  -99.200  -91.000
       PHE 273     1.000    36.632  43.301  10.507  -99.200  -91.000
       TYR 297     0.840    36.754  52.405  21.395  -99.200  -91.000
       PHE 314     1.000    29.244  30.267  10.551  -99.200  -91.000
       HIS 341     0.900    53.020   8.859  16.247  -99.200  -91.000
       PHE 359     1.000    46.117  11.421  28.760  -99.200  -91.000
       HIS 364     0.900    44.087   7.645  28.866  -99.200  -91.000
       TYR 392     0.840    46.878  18.764  35.455  -99.200  -91.000
       TYR 393     0.840    49.791  24.863  31.427  -99.200  -91.000
       PHE 420     1.000    51.354  13.707  17.881  -99.200  -91.000