=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 44 rings
        ring        int.           center             anis.    iso.
       HIS  3     0.900    41.850  35.689  11.843  -99.200  -91.000
       PHE  4     1.000    41.874  40.426  17.952  -99.200  -91.000
       HIS 10     0.900    33.769  43.892   6.134  -99.200  -91.000
       TRP 20     1.040    51.319  60.981  16.091  -99.200  -91.000
      TRP6 20     1.020    51.597  60.767  18.442  -99.200  -91.000
       HIS 28     0.900    62.813  51.360   3.289  -99.200  -91.000
       TYR 39     0.840    54.286  45.037  10.875  -99.200  -91.000
       HIS 41     0.900    45.684  46.916  11.670  -99.200  -91.000
       TYR 48     0.840    48.458  59.736  13.058  -99.200  -91.000
       PHE 72     1.000    41.236  46.409   8.980  -99.200  -91.000
       TRP 78     1.040    42.254  67.498  13.281  -99.200  -91.000
      TRP6 78     1.020    43.168  66.365  15.154  -99.200  -91.000
       TYR 102     0.840    38.532  48.658  -0.157  -99.200  -91.000
       TYR 106     0.840    37.374  58.434   7.690  -99.200  -91.000
       HIS 107     0.900    39.100  53.719  14.480  -99.200  -91.000
       HIS 109     0.900    43.310  61.368  15.133  -99.200  -91.000
       TRP 110     1.040    41.988  63.222  19.616  -99.200  -91.000
      TRP6 110     1.020    42.437  62.718  21.884  -99.200  -91.000
       PHE 112     1.000    36.596  65.993  23.324  -99.200  -91.000
       HIS 119     0.900    45.437  79.623  16.786  -99.200  -91.000
       PHE 130     1.000    31.531  64.100  17.613  -99.200  -91.000
       TRP 136     1.040    27.924  56.252  13.877  -99.200  -91.000
      TRP6 136     1.020    30.207  55.656  14.175  -99.200  -91.000
       TYR 156     0.840    33.206  57.923  21.148  -99.200  -91.000
       HIS 180     0.900    50.619  52.855  28.104  -99.200  -91.000
       TRP 183     1.040    45.408  55.057  30.181  -99.200  -91.000
      TRP6 183     1.020    44.850  56.259  32.149  -99.200  -91.000
       PHE 189     1.000    39.780  44.855  26.516  -99.200  -91.000
       HIS 195     0.900    26.883  47.876  24.680  -99.200  -91.000
       HIS 198     0.900    39.580  44.104  17.858  -99.200  -91.000
       TYR 202     0.840    45.815  56.044  21.414  -99.200  -91.000
       HIS 214     0.900    66.200  51.755  27.509  -99.200  -91.000
       TRP 236     1.040    50.205  43.384  29.456  -99.200  -91.000
      TRP6 236     1.020    48.890  45.355  29.217  -99.200  -91.000
       PHE 261     1.000    51.226  36.940  15.644  -99.200  -91.000
       TRP 263     1.040    56.882  34.903  21.549  -99.200  -91.000
      TRP6 263     1.020    56.695  36.654  23.137  -99.200  -91.000
       PHE 270     1.000    48.127  39.423  30.863  -99.200  -91.000
       PHE 289     1.000    40.426  67.655  21.715  -99.200  -91.000
       HIS 294     0.900    38.768  82.710  27.675  -99.200  -91.000
       TYR 297     0.840    35.266  69.736  26.363  -99.200  -91.000
       TRP 304     1.040    40.554  61.783  28.869  -99.200  -91.000
      TRP6 304     1.020    40.487  60.313  26.996  -99.200  -91.000
       HIS 306     0.900    35.001  65.409  35.695  -99.200  -91.000