=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 35 rings
        ring        int.           center             anis.    iso.
       TRP  5     1.040   -36.327 -34.045  -1.337  -99.200  -91.000
      TRP6  5     1.020   -35.324 -36.106  -1.828  -99.200  -91.000
       HIS 10     0.900   -31.174 -20.091  -1.223  -99.200  -91.000
       TRP 14     1.040   -27.296 -27.504 -10.347  -99.200  -91.000
      TRP6 14     1.020   -26.327 -27.223  -8.243  -99.200  -91.000
       HIS 32     0.900   -19.616 -19.568 -19.801  -99.200  -91.000
       TRP 35     1.040   -22.012 -21.047 -23.678  -99.200  -91.000
      TRP6 35     1.020   -22.424 -21.949 -25.811  -99.200  -91.000
       HIS 41     0.900   -35.094 -36.325 -25.030  -99.200  -91.000
       HIS 54     0.900   -39.312 -23.786  -4.334  -99.200  -91.000
       PHE 57     1.000   -48.063 -23.942 -12.394  -99.200  -91.000
       HIS 58     0.900   -48.287 -18.878  -7.800  -99.200  -91.000
       PHE 66     1.000   -30.804 -14.383 -19.215  -99.200  -91.000
       HIS 70     0.900   -26.819 -21.951 -33.465  -99.200  -91.000
       PHE 72     1.000   -23.832 -23.876 -30.732  -99.200  -91.000
       HIS 74     0.900   -22.108 -35.568 -29.405  -99.200  -91.000
       TYR 77     0.840   -30.236 -37.853 -29.865  -99.200  -91.000
       PHE 85     1.000   -44.948 -44.985 -25.270  -99.200  -91.000
       HIS 94     0.900   -22.468 -40.532 -28.791  -99.200  -91.000
       TYR 128     0.840   -28.940 -36.693  -3.245  -99.200  -91.000
       TRP 132     1.040   -40.365 -27.082 -11.721  -99.200  -91.000
      TRP6 132     1.020   -38.335 -26.097 -12.383  -99.200  -91.000
       PHE 140     1.000   -46.313 -33.575 -17.806  -99.200  -91.000
       HIS 152     0.900   -28.980 -46.117  -3.616  -99.200  -91.000
       HIS 163     0.900   -34.420 -50.181 -19.378  -99.200  -91.000
       PHE 170     1.000   -20.263 -43.565 -26.520  -99.200  -91.000
       TRP 177     1.040   -33.209 -54.530  -8.442  -99.200  -91.000
      TRP6 177     1.020   -32.634 -54.362 -10.705  -99.200  -91.000
       TRP 204     1.040   -33.085 -43.845 -22.946  -99.200  -91.000
      TRP6 204     1.020   -33.428 -46.127 -22.508  -99.200  -91.000
       TYR 218     0.840   -30.471 -40.523 -14.962  -99.200  -91.000
       HIS 223     0.900   -18.022 -41.704 -21.748  -99.200  -91.000
       TYR 224     0.840   -21.228 -37.076 -24.365  -99.200  -91.000
       TRP 227     1.040   -19.739 -31.621 -28.647  -99.200  -91.000
      TRP6 227     1.020   -21.700 -31.123 -27.417  -99.200  -91.000