=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 45 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    10.213  -0.470   4.645  -99.200  -91.000
       TRP  2     1.040     4.784   0.671  11.702  -99.200  -91.000
      TRP6  2     1.020     2.830  -0.651  11.866  -99.200  -91.000
       TYR  4     0.840     1.018  -6.157  12.394  -99.200  -91.000
       HIS  7     0.900    14.206 -10.839   9.897  -99.200  -91.000
       HIS 12     0.900    12.832  -6.776  15.331  -99.200  -91.000
       TRP 13     1.040     6.025  -2.992  15.996  -99.200  -91.000
      TRP6 13     1.020     3.732  -3.335  16.446  -99.200  -91.000
       HIS 14     0.900    12.500  -2.627  22.169  -99.200  -91.000
       PHE 17     1.000     7.265   3.878  16.095  -99.200  -91.000
       HIS 33     0.900   -13.783 -16.221  35.900  -99.200  -91.000
       TYR 37     0.840   -22.694  -3.103  37.165  -99.200  -91.000
       TYR 48     0.840   -20.945   3.921  14.718  -99.200  -91.000
       HIS 61     0.900     1.405  -0.794   8.265  -99.200  -91.000
       PHE 63     1.000   -10.412  -4.363   5.325  -99.200  -91.000
       PHE 67     1.000   -17.184   5.382   8.274  -99.200  -91.000
       TYR 85     0.840   -14.188  10.277  23.126  -99.200  -91.000
       PHE 90     1.000   -15.295  -0.070   8.824  -99.200  -91.000
       HIS 91     0.900    -8.048  -0.366  12.534  -99.200  -91.000
       PHE 92     1.000   -13.158  -5.598   9.857  -99.200  -91.000
       HIS 93     0.900    -5.549  -4.717  14.368  -99.200  -91.000
       TRP 94     1.040    -6.720 -10.584   8.163  -99.200  -91.000
      TRP6 94     1.020    -6.908  -8.283   7.629  -99.200  -91.000
       HIS 104     0.900    -8.265  -5.118  23.188  -99.200  -91.000
       TYR 111     0.840   -13.617 -14.002  20.590  -99.200  -91.000
       HIS 116     0.900    -8.911  -2.747  17.079  -99.200  -91.000
       HIS 119     0.900   -15.761   5.651  17.531  -99.200  -91.000
       TRP 120     1.040   -11.810  12.801  15.369  -99.200  -91.000
      TRP6 120     1.020   -12.352  15.080  15.667  -99.200  -91.000
       TYR 124     0.840    -8.757  16.780  23.880  -99.200  -91.000
       PHE 127     1.000    -6.434  10.177  14.701  -99.200  -91.000
       PHE 143     1.000   -12.801  -9.768  21.480  -99.200  -91.000
       PHE 172     1.000   -16.688   0.230   1.259  -99.200  -91.000
       PHE 175     1.000   -19.724  -0.822   5.433  -99.200  -91.000
       TYR 187     0.840   -19.260  -0.610  27.930  -99.200  -91.000
       TRP 188     1.040   -15.282  -7.375  29.886  -99.200  -91.000
      TRP6 188     1.020   -15.550  -8.987  28.179  -99.200  -91.000
       TYR 190     0.840    -7.834  -1.881  27.952  -99.200  -91.000
       TRP 205     1.040    -8.028   0.275  23.551  -99.200  -91.000
      TRP6 205     1.020    -8.521  -0.630  21.424  -99.200  -91.000
       PHE 222     1.000   -11.786  -9.263   6.642  -99.200  -91.000
       PHE 227     1.000     1.036  -7.887   6.271  -99.200  -91.000
       TRP 241     1.040    -2.504 -11.741  15.341  -99.200  -91.000
      TRP6 241     1.020    -1.557 -12.689  17.296  -99.200  -91.000
       PHE 256     1.000   -20.564  -7.877  31.037  -99.200  -91.000