=============================================================================
          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    52.786  29.348  17.130  -99.200  -91.000
       PHE 25     1.000    56.681  41.079  15.370  -99.200  -91.000
       TRP 35     1.040    51.788  34.282   2.223  -99.200  -91.000
      TRP6 35     1.020    49.438  34.279   1.912  -99.200  -91.000
       TYR 42     0.840    54.557  30.740   9.213  -99.200  -91.000
       PHE 45     1.000    44.744  22.749  10.646  -99.200  -91.000
       HIS 56     0.900    43.843  35.137   9.236  -99.200  -91.000
       HIS 58     0.900    33.640  35.384   3.242  -99.200  -91.000
       HIS 74     0.900    32.785  56.163  18.806  -99.200  -91.000
       PHE 77     1.000    22.571  51.684  19.780  -99.200  -91.000
       TYR 82     0.840    26.172  52.590  15.936  -99.200  -91.000
       TYR 85     0.840    24.188  48.369  19.898  -99.200  -91.000
       PHE 100     1.000    13.575  32.029  26.659  -99.200  -91.000
       PHE 133     1.000    30.156  24.363  36.356  -99.200  -91.000
       TYR 137     0.840    40.344  32.827  29.322  -99.200  -91.000
       HIS 138     0.900    33.664  31.757  32.412  -99.200  -91.000
       HIS 142     0.900    41.411  43.756  39.065  -99.200  -91.000
       TYR 143     0.840    32.589  38.966  39.112  -99.200  -91.000
       TYR 154     0.840    44.710  32.129  31.814  -99.200  -91.000
       HIS 164     0.900    31.271  37.970  48.660  -99.200  -91.000
       TYR 166     0.840    30.951  31.483  46.912  -99.200  -91.000
       TYR 170     0.840    32.570  21.666  31.705  -99.200  -91.000
       HIS 175     0.900    41.714  14.095  32.541  -99.200  -91.000
       HIS 187     0.900    22.484  19.999  44.852  -99.200  -91.000
       PHE 190     1.000    23.152  25.827  45.315  -99.200  -91.000
       PHE 213     1.000    38.785  23.217  21.500  -99.200  -91.000
       TYR 214     0.840    38.618  18.084  29.052  -99.200  -91.000
       PHE 220     1.000    26.726  19.347  34.099  -99.200  -91.000
       HIS 231     0.900    17.899  25.780  44.672  -99.200  -91.000
       PHE 251     1.000    25.062  31.751  19.827  -99.200  -91.000
       PHE 265     1.000    26.504  38.106  20.896  -99.200  -91.000
       PHE 273     1.000    36.788  43.426  10.527  -99.200  -91.000
       TYR 297     0.840    36.956  52.422  21.484  -99.200  -91.000
       PHE 314     1.000    29.091  30.459  10.615  -99.200  -91.000
       HIS 341     0.900    52.703   8.434  16.478  -99.200  -91.000
       PHE 359     1.000    45.662  11.321  28.731  -99.200  -91.000
       HIS 364     0.900    43.473   7.530  29.067  -99.200  -91.000
       TYR 392     0.840    46.299  18.906  35.119  -99.200  -91.000
       TYR 393     0.840    49.866  24.269  31.548  -99.200  -91.000
       PHE 420     1.000    51.013  13.342  17.853  -99.200  -91.000