=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 42 rings
        ring        int.           center             anis.    iso.
       PHE 13     1.000    40.160   9.296  51.093  -99.200  -91.000
       TYR 18     0.840    37.072  18.213  51.611  -99.200  -91.000
       TYR 21     0.840    37.800  12.386  55.306  -99.200  -91.000
       HIS 31     0.900    32.281   5.836  60.804  -99.200  -91.000
       TRP 42     1.040    39.397   3.043  66.307  -99.200  -91.000
      TRP6 42     1.020    37.205   2.208  66.154  -99.200  -91.000
       TYR 47     0.840    33.066  22.577  65.086  -99.200  -91.000
       PHE 59     1.000    39.614  10.003  72.560  -99.200  -91.000
       TRP 63     1.040    53.870   7.942  69.518  -99.200  -91.000
      TRP6 63     1.020    53.097   6.554  67.767  -99.200  -91.000
       HIS 79     0.900    61.973  11.015  74.718  -99.200  -91.000
       HIS 89     0.900    51.445  20.236  75.870  -99.200  -91.000
       PHE 100     1.000    57.690  29.516  68.087  -99.200  -91.000
       TRP 139     1.040    57.068  23.042  48.471  -99.200  -91.000
      TRP6 139     1.020    57.068  21.550  50.298  -99.200  -91.000
       PHE 160     1.000    65.785  19.678  58.556  -99.200  -91.000
       TRP 163     1.040    67.643  13.708  55.095  -99.200  -91.000
      TRP6 163     1.020    69.293  15.070  56.104  -99.200  -91.000
       PHE 167     1.000    60.573  12.982  58.265  -99.200  -91.000
       PHE 169     1.000    53.581  15.513  51.349  -99.200  -91.000
       TYR 186     0.840    71.571  19.392  59.691  -99.200  -91.000
       HIS 227     0.900    61.099  15.647  64.135  -99.200  -91.000
       HIS 234     0.900    61.801  22.579  56.701  -99.200  -91.000
       TYR 246     0.840    42.399  24.534  43.913  -99.200  -91.000
       HIS 251     0.900    36.197  28.630  45.159  -99.200  -91.000
       TYR 275     0.840    36.896  25.729  49.926  -99.200  -91.000
       TYR 284     0.840    49.115   8.076  63.907  -99.200  -91.000
       PHE 286     1.000    48.911   6.953  70.268  -99.200  -91.000
       HIS 312     0.900    38.079  23.121  59.678  -99.200  -91.000
       PHE 318     1.000    32.910  26.035  60.432  -99.200  -91.000
       HIS 322     0.900    30.509  20.526  50.584  -99.200  -91.000
       PHE 324     1.000    37.860  30.847  49.461  -99.200  -91.000
       HIS 333     0.900    40.107  28.194  61.877  -99.200  -91.000
       PHE 336     1.000    46.457  28.126  62.771  -99.200  -91.000
       HIS 338     0.900    39.030  23.029  71.745  -99.200  -91.000
       HIS 341     0.900    48.841  18.109  72.893  -99.200  -91.000
       PHE 342     1.000    44.909  27.356  68.691  -99.200  -91.000
       TRP 378     1.040    44.094  18.001  45.413  -99.200  -91.000
      TRP6 378     1.020    44.319  19.749  46.972  -99.200  -91.000
       TYR 379     0.840    52.875  15.619  47.358  -99.200  -91.000
       TRP 394     1.040    53.168  37.237  36.074  -99.200  -91.000
      TRP6 394     1.020    54.206  35.278  36.899  -99.200  -91.000