=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 31 rings
        ring        int.           center             anis.    iso.
       TYR  6     0.840    56.851  40.819  21.733  -99.200  -91.000
       HIS 17     0.900    60.659  55.401  25.019  -99.200  -91.000
       TYR 21     0.840    66.948  63.165  22.263  -99.200  -91.000
       HIS 39     0.900    42.737  53.699  24.527  -99.200  -91.000
       PHE 58     1.000    40.006  63.649  14.493  -99.200  -91.000
       HIS 64     0.900    45.046  47.787  10.695  -99.200  -91.000
       HIS 67     0.900    47.074  46.448  18.041  -99.200  -91.000
       TYR 91     0.840    48.980  65.589  12.767  -99.200  -91.000
       TYR 104     0.840    45.136  50.230  -5.425  -99.200  -91.000
       TRP 106     1.040    37.938  56.125  -1.202  -99.200  -91.000
      TRP6 106     1.020    36.646  54.505  -0.044  -99.200  -91.000
       TRP 113     1.040    44.836  66.122   5.359  -99.200  -91.000
      TRP6 113     1.020    46.106  65.641   7.328  -99.200  -91.000
       TYR 167     0.840    52.729  46.581  -6.122  -99.200  -91.000
       TYR 171     0.840    54.352  51.245  -5.791  -99.200  -91.000
       PHE 189     1.000    51.611  37.020  10.452  -99.200  -91.000
       TYR 214     0.840    44.808  49.633  27.138  -99.200  -91.000
       TYR 217     0.840    43.752  43.705  16.797  -99.200  -91.000
       HIS 226     0.900    56.490  47.165  17.129  -99.200  -91.000
       HIS 238     0.900    70.783  62.222  15.481  -99.200  -91.000
       TRP 241     1.040    70.546  62.742  11.223  -99.200  -91.000
      TRP6 241     1.020    70.763  60.590  12.156  -99.200  -91.000
       PHE 261     1.000    62.433  35.129  -1.325  -99.200  -91.000
       TYR 262     0.840    62.726  32.529   3.085  -99.200  -91.000
       TYR 263     0.840    64.280  35.829   9.353  -99.200  -91.000
       HIS 276     0.900    75.788  62.306  15.539  -99.200  -91.000
       HIS 277     0.900    80.671  57.948  13.889  -99.200  -91.000
       HIS 278     0.900    73.666  55.485  11.514  -99.200  -91.000
       HIS 279     0.900    78.558  49.405  14.941  -99.200  -91.000
       HIS 280     0.900    73.551  45.839   9.339  -99.200  -91.000
       HIS 281     0.900    74.948  47.128  17.391  -99.200  -91.000