=============================================================================
          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  3     1.040   -16.077  -7.381 -10.411  -99.200  -91.000
      TRP6  3     1.020   -14.722  -6.290 -12.021  -99.200  -91.000
       TYR  5     0.840    -9.834  -7.386 -15.265  -99.200  -91.000
       TRP 14     1.040   -14.929 -11.774 -14.284  -99.200  -91.000
      TRP6 14     1.020   -14.532 -10.183 -15.996  -99.200  -91.000
       TYR 18     0.840   -20.984 -10.295 -11.365  -99.200  -91.000
       HIS 38     0.900   -19.631   0.268 -46.594  -99.200  -91.000
       TYR 49     0.840   -16.375  13.803 -26.360  -99.200  -91.000
       HIS 62     0.900   -11.875  -2.524 -12.361  -99.200  -91.000
       PHE 64     1.000    -6.181   5.655 -15.504  -99.200  -91.000
       HIS 65     0.900   -13.364   3.401 -14.285  -99.200  -91.000
       PHE 68     1.000   -14.610  13.664 -19.191  -99.200  -91.000
       PHE 82     1.000   -24.692   5.444 -31.056  -99.200  -91.000
       TYR 86     0.840   -26.430   6.727 -27.164  -99.200  -91.000
       PHE 89     1.000   -20.656   6.883 -18.546  -99.200  -91.000
       PHE 91     1.000   -10.142   9.951 -20.450  -99.200  -91.000
       HIS 92     0.900   -12.999   2.458 -18.906  -99.200  -91.000
       PHE 93     1.000    -6.326   5.479 -21.329  -99.200  -91.000
       HIS 94     0.900   -10.633  -2.437 -20.181  -99.200  -91.000
       TRP 95     1.040    -2.881  -1.951 -17.710  -99.200  -91.000
      TRP6 95     1.020    -4.258  -0.231 -16.829  -99.200  -91.000
       HIS 101     0.900    -0.799  -9.752 -22.673  -99.200  -91.000
       HIS 105     0.900   -14.003  -4.314 -28.570  -99.200  -91.000
       TYR 112     0.840    -3.707  -3.610 -32.868  -99.200  -91.000
       HIS 117     0.900   -12.972  -0.010 -23.709  -99.200  -91.000
       HIS 120     0.900   -19.589   8.751 -25.508  -99.200  -91.000
       TRP 121     1.040   -25.419   9.186 -19.080  -99.200  -91.000
      TRP6 121     1.020   -27.554  10.174 -18.802  -99.200  -91.000
       TYR 126     0.840   -32.979   4.578 -21.485  -99.200  -91.000
       PHE 174     1.000    -7.517  14.280 -16.002  -99.200  -91.000
       PHE 177     1.000    -7.795  15.076 -21.527  -99.200  -91.000
       PHE 189     1.000   -18.906   4.037 -37.165  -99.200  -91.000
       TRP 190     1.040   -14.664  -2.639 -38.499  -99.200  -91.000
      TRP6 190     1.020   -12.387  -2.445 -37.890  -99.200  -91.000
       TYR 192     0.840   -19.324  -5.497 -30.833  -99.200  -91.000
       HIS 198     0.900   -15.649  -3.385 -15.638  -99.200  -91.000
       TYR 202     0.840   -26.150  -4.247 -15.541  -99.200  -91.000
       TRP 207     1.040   -18.802  -2.363 -27.069  -99.200  -91.000
      TRP6 207     1.020   -16.953  -1.346 -26.004  -99.200  -91.000
       PHE 224     1.000    -2.266   3.536 -19.242  -99.200  -91.000
       HIS 241     0.900    -3.672  -9.519 -15.740  -99.200  -91.000
       PHE 258     1.000   -13.604   0.718 -42.312  -99.200  -91.000