=============================================================================
          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.
       TRP  2     1.040   -35.478  -7.745 -12.471  -99.200  -91.000
      TRP6  2     1.020   -36.760  -6.707 -10.774  -99.200  -91.000
       TYR  4     0.840   -41.403  -7.679  -7.389  -99.200  -91.000
       TRP 13     1.040   -36.374 -12.086  -8.717  -99.200  -91.000
      TRP6 13     1.020   -36.694 -10.562  -6.931  -99.200  -91.000
       TYR 17     0.840   -30.532 -10.432 -11.770  -99.200  -91.000
       HIS 37     0.900   -29.480   0.075  23.657  -99.200  -91.000
       TYR 48     0.840   -34.098  13.329   3.597  -99.200  -91.000
       HIS 61     0.900   -39.319  -2.780 -10.358  -99.200  -91.000
       PHE 63     1.000   -44.791   5.439  -7.035  -99.200  -91.000
       HIS 64     0.900   -37.554   3.148  -8.616  -99.200  -91.000
       PHE 67     1.000   -36.051  13.335  -3.460  -99.200  -91.000
       PHE 81     1.000   -25.959   5.033   8.006  -99.200  -91.000
       TYR 85     0.840   -24.107   6.050   3.878  -99.200  -91.000
       PHE 88     1.000   -30.191   6.293  -4.513  -99.200  -91.000
       PHE 90     1.000   -40.641   9.658  -2.174  -99.200  -91.000
       HIS 91     0.900   -38.007   2.097  -3.829  -99.200  -91.000
       PHE 92     1.000   -44.569   5.254  -1.204  -99.200  -91.000
       HIS 93     0.900   -40.419  -2.696  -2.434  -99.200  -91.000
       TRP 94     1.040   -48.260  -2.089  -4.855  -99.200  -91.000
      TRP6 94     1.020   -46.858  -0.362  -5.670  -99.200  -91.000
       HIS 100     0.900   -50.646 -10.143   0.289  -99.200  -91.000
       HIS 104     0.900   -36.882  -4.768   5.652  -99.200  -91.000
       TYR 111     0.840   -46.671  -3.404  10.236  -99.200  -91.000
       HIS 116     0.900   -37.949  -0.388   0.979  -99.200  -91.000
       HIS 119     0.900   -31.024   8.201   2.553  -99.200  -91.000
       TRP 120     1.040   -25.382   8.515  -4.108  -99.200  -91.000
      TRP6 120     1.020   -23.173   9.328  -4.375  -99.200  -91.000
       TYR 125     0.840   -17.727   3.744  -2.128  -99.200  -91.000
       PHE 173     1.000   -43.187  14.123  -6.460  -99.200  -91.000
       PHE 176     1.000   -42.780  14.827  -0.915  -99.200  -91.000
       PHE 188     1.000   -31.554   3.580  14.220  -99.200  -91.000
       TRP 189     1.040   -35.941  -3.036  15.740  -99.200  -91.000
      TRP6 189     1.020   -38.202  -2.730  15.141  -99.200  -91.000
       TYR 191     0.840   -31.523  -6.009   7.727  -99.200  -91.000
       HIS 197     0.900   -35.690  -3.695  -7.189  -99.200  -91.000
       TYR 201     0.840   -24.977  -4.494  -7.568  -99.200  -91.000
       TRP 206     1.040   -32.019  -2.924   4.132  -99.200  -91.000
      TRP6 206     1.020   -33.868  -1.837   3.147  -99.200  -91.000
       PHE 223     1.000   -48.706   3.394  -3.251  -99.200  -91.000
       HIS 240     0.900   -47.718  -9.664  -6.882  -99.200  -91.000
       PHE 257     1.000   -36.742   0.198  19.515  -99.200  -91.000