=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 33 rings
        ring        int.           center             anis.    iso.
       HIS  5     0.900   113.284  27.492   9.189  -99.200  -91.000
       PHE 13     1.000   106.299  22.771  -1.243  -99.200  -91.000
       HIS 18     0.900    91.221  18.761   5.597  -99.200  -91.000
       PHE 28     1.000    99.247  11.955  19.667  -99.200  -91.000
       HIS 29     0.900    96.558   9.643  11.455  -99.200  -91.000
       TRP 32     1.040   105.955   6.357  15.940  -99.200  -91.000
      TRP6 32     1.020   106.558   8.549  15.295  -99.200  -91.000
       HIS 34     0.900   102.543   8.534  23.186  -99.200  -91.000
       TYR 37     0.840   103.648  18.105  19.561  -99.200  -91.000
       PHE 41     1.000   104.818  20.522  26.320  -99.200  -91.000
       PHE 50     1.000   114.926  20.228  25.440  -99.200  -91.000
       TYR 57     0.840   119.230  27.286  15.805  -99.200  -91.000
       HIS 66     0.900   117.443  13.607   8.710  -99.200  -91.000
       TYR 67     0.840   112.225  21.191   7.780  -99.200  -91.000
       TYR 72     0.840   104.717  18.543  13.377  -99.200  -91.000
       TYR 73     0.840   102.895  14.340  15.831  -99.200  -91.000
       TYR 76     0.840   108.572  19.324  15.822  -99.200  -91.000
       PHE 103     1.000   117.284   8.741  17.139  -99.200  -91.000
       PHE 123     1.000   107.862  50.091  16.695  -99.200  -91.000
       TYR 135     0.840   119.675  39.163   4.696  -99.200  -91.000
       HIS 139     0.900   114.297  29.977  16.526  -99.200  -91.000
       TYR 145     0.840   105.779  36.046   5.023  -99.200  -91.000
       HIS 155     0.900    97.064  42.518  20.487  -99.200  -91.000
       TRP 161     1.040   105.548  35.386  25.595  -99.200  -91.000
      TRP6 161     1.020   104.012  36.910  24.651  -99.200  -91.000
       PHE 163     1.000   115.375  39.290  19.652  -99.200  -91.000
       HIS 169     0.900   121.175  30.229  18.451  -99.200  -91.000
       TYR 180     0.840   105.018  46.080  19.047  -99.200  -91.000
       HIS 181     0.900    98.530  40.066  16.941  -99.200  -91.000
       PHE 184     1.000   104.389  43.042   7.116  -99.200  -91.000
       PHE 190     1.000   104.142  36.575  -0.632  -99.200  -91.000
       PHE 204     1.000   109.432  37.595  20.364  -99.200  -91.000
       TYR 207     0.840   112.435  39.104  15.328  -99.200  -91.000