=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 34 rings
        ring        int.           center             anis.    iso.
       TRP  7     1.040    33.096  -5.477  -7.632  -99.200  -91.000
      TRP6  7     1.020    31.947  -3.848  -6.364  -99.200  -91.000
       TYR 12     0.840    32.643  -5.468  -2.353  -99.200  -91.000
       TRP 26     1.040    33.534 -27.867  -7.475  -99.200  -91.000
      TRP6 26     1.020    32.607 -27.938  -5.322  -99.200  -91.000
       PHE 28     1.000    40.243 -23.198  -4.283  -99.200  -91.000
       PHE 39     1.000    34.446  -5.407   2.186  -99.200  -91.000
       TYR 72     0.840    24.219 -28.875  -8.080  -99.200  -91.000
       PHE 74     1.000    27.224 -19.316  -4.888  -99.200  -91.000
       TYR 76     0.840    27.664 -27.299   2.960  -99.200  -91.000
       TYR 89     0.840    36.471 -28.279   6.831  -99.200  -91.000
       TYR 91     0.840    42.216 -26.896  -1.559  -99.200  -91.000
       TYR 100     0.840    29.332 -26.166   9.483  -99.200  -91.000
       TYR 104     0.840    36.241 -22.858  15.481  -99.200  -91.000
       PHE 112     1.000    21.146 -21.237  -6.583  -99.200  -91.000
       HIS 140     0.900    39.915 -24.316 -26.488  -99.200  -91.000
       PHE 143     1.000    41.962 -19.946 -18.716  -99.200  -91.000
       PHE 145     1.000    50.730 -24.234 -22.880  -99.200  -91.000
       TYR 146     0.840    46.275 -14.476 -19.657  -99.200  -91.000
       TYR 151     0.840    42.119 -17.275 -23.381  -99.200  -91.000
       PHE 152     1.000    38.476 -13.844 -29.916  -99.200  -91.000
       HIS 163     0.900    39.034 -23.345 -14.208  -99.200  -91.000
       TYR 170     0.840    32.520  -3.389 -16.007  -99.200  -91.000
       PHE 172     1.000    38.362   2.231 -20.025  -99.200  -91.000
       TYR 178     0.840    40.424  -5.284 -19.019  -99.200  -91.000
       TRP 179     1.040    33.560 -10.203 -19.367  -99.200  -91.000
      TRP6 179     1.020    31.884  -8.950 -18.278  -99.200  -91.000
       TRP 185     1.040    44.018 -23.401 -12.529  -99.200  -91.000
      TRP6 185     1.020    43.992 -23.291 -14.900  -99.200  -91.000
       TRP 189     1.040    47.336 -19.705 -15.500  -99.200  -91.000
      TRP6 189     1.020    45.505 -18.240 -15.583  -99.200  -91.000
       TYR 194     0.840    42.946 -11.326 -10.041  -99.200  -91.000
       HIS 204     0.900    36.426 -15.634 -26.913  -99.200  -91.000
       TYR 213     0.840    24.062 -12.120  -7.538  -99.200  -91.000