=============================================================================
          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.
       HIS  3     0.900   -21.716 -21.354  27.427  -99.200  -91.000
       TYR  7     0.840   -10.055 -12.405  32.463  -99.200  -91.000
       PHE  8     1.000    -8.978 -12.086  23.993  -99.200  -91.000
       TYR  9     0.840    -3.144  -9.886  30.967  -99.200  -91.000
       PHE 22     1.000    -1.958  -4.970  31.508  -99.200  -91.000
       TYR 27     0.840   -14.218  -9.918  24.278  -99.200  -91.000
       PHE 33     1.000   -15.844 -11.144  32.104  -99.200  -91.000
       PHE 36     1.000    -5.969  -1.614  34.741  -99.200  -91.000
       TRP 51     1.040   -23.294 -11.111  32.002  -99.200  -91.000
      TRP6 51     1.020   -21.101 -11.830  32.526  -99.200  -91.000
       TYR 59     0.840   -15.185  -9.838  40.027  -99.200  -91.000
       TRP 60     1.040   -16.673  -4.935  40.712  -99.200  -91.000
      TRP6 60     1.020   -16.272  -5.277  38.408  -99.200  -91.000
       TYR 74     0.840     1.986  -8.904  30.996  -99.200  -91.000
       TYR 84     0.840    14.911 -12.411  27.526  -99.200  -91.000
       TYR 85     0.840    12.786 -11.265  20.567  -99.200  -91.000
       HIS 93     0.900    10.026  -3.178  19.870  -99.200  -91.000
       TYR 99     0.840    -5.253 -15.266  31.931  -99.200  -91.000
       TYR 113     0.840    -7.580 -22.415  24.728  -99.200  -91.000
       TYR 116     0.840     2.264 -15.299  28.444  -99.200  -91.000
       TYR 118     0.840     8.897  -8.093  21.588  -99.200  -91.000
       TYR 123     0.840     8.706 -14.234  24.414  -99.200  -91.000
       TRP 133     1.040     6.022 -23.176  30.164  -99.200  -91.000
      TRP6 133     1.020     4.266 -21.589  30.331  -99.200  -91.000
       TRP 147     1.040     7.852 -17.493  32.842  -99.200  -91.000
      TRP6 147     1.020     6.099 -16.882  31.389  -99.200  -91.000
       TYR 159     0.840    -7.226 -18.427  36.000  -99.200  -91.000
       TYR 171     0.840   -17.432 -14.295  35.721  -99.200  -91.000
       HIS 188     0.900   -31.504  -9.354   3.206  -99.200  -91.000
       HIS 191     0.900   -30.589  -9.986  -9.579  -99.200  -91.000
       HIS 192     0.900   -27.273  -5.111  -4.990  -99.200  -91.000
       HIS 197     0.900   -21.564 -10.017 -19.308  -99.200  -91.000
       TRP 204     1.040   -27.053  -8.627   2.738  -99.200  -91.000
      TRP6 204     1.020   -25.663  -7.099   3.886  -99.200  -91.000
       PHE 208     1.000   -24.194 -13.633  12.591  -99.200  -91.000
       TYR 209     0.840   -23.741 -13.871  21.889  -99.200  -91.000
       TRP 217     1.040   -23.592 -16.933  -2.269  -99.200  -91.000
      TRP6 217     1.020   -25.854 -17.000  -2.964  -99.200  -91.000
       PHE 241     1.000   -20.518 -10.660  17.143  -99.200  -91.000
       TRP 244     1.040   -21.634  -8.253   2.968  -99.200  -91.000
      TRP6 244     1.020   -20.205  -8.497   1.099  -99.200  -91.000
       TYR 257     0.840   -24.366 -19.222  -8.814  -99.200  -91.000
       HIS 260     0.900   -26.669 -24.632   0.730  -99.200  -91.000
       HIS 263     0.900   -25.949 -18.340  14.980  -99.200  -91.000
       TRP 274     1.040   -33.068 -12.976  -7.518  -99.200  -91.000
      TRP6 274     1.020   -33.643 -11.083  -6.201  -99.200  -91.000