=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 46 rings
        ring        int.           center             anis.    iso.
       HIS  2     0.900    11.587   4.872   7.451  -99.200  -91.000
       HIS  3     0.900    12.295   0.889   6.176  -99.200  -91.000
       TRP  4     1.040     5.173   0.809  11.824  -99.200  -91.000
      TRP6  4     1.020     3.148  -0.407  11.902  -99.200  -91.000
       TYR  6     0.840     1.162  -6.061  12.404  -99.200  -91.000
       HIS  9     0.900    14.332 -11.111  10.266  -99.200  -91.000
       HIS 14     0.900    12.926  -6.908  15.771  -99.200  -91.000
       TRP 15     1.040     6.194  -2.925  16.092  -99.200  -91.000
      TRP6 15     1.020     3.898  -3.217  16.524  -99.200  -91.000
       HIS 16     0.900    12.582  -2.471  22.471  -99.200  -91.000
       PHE 19     1.000     7.428   3.945  16.238  -99.200  -91.000
       HIS 35     0.900   -14.191 -16.080  36.186  -99.200  -91.000
       TYR 39     0.840   -22.664  -3.424  37.538  -99.200  -91.000
       TYR 50     0.840   -21.139   4.117  14.787  -99.200  -91.000
       HIS 63     0.900     1.578  -0.460   8.464  -99.200  -91.000
       PHE 65     1.000   -10.312  -4.168   5.286  -99.200  -91.000
       PHE 69     1.000   -17.378   5.555   8.469  -99.200  -91.000
       TYR 87     0.840   -14.204  10.467  23.289  -99.200  -91.000
       PHE 92     1.000   -15.512  -0.127   9.019  -99.200  -91.000
       HIS 93     0.900    -8.089  -0.226  12.560  -99.200  -91.000
       PHE 94     1.000   -13.178  -5.579   9.938  -99.200  -91.000
       HIS 95     0.900    -5.486  -4.578  14.371  -99.200  -91.000
       TRP 96     1.040    -6.713 -10.472   8.327  -99.200  -91.000
      TRP6 96     1.020    -6.908  -8.167   7.815  -99.200  -91.000
       HIS 106     0.900    -8.230  -5.038  23.337  -99.200  -91.000
       TYR 113     0.840   -13.647 -14.018  20.715  -99.200  -91.000
       HIS 118     0.900    -8.911  -2.617  17.139  -99.200  -91.000
       HIS 121     0.900   -15.890   5.783  17.657  -99.200  -91.000
       TRP 122     1.040   -11.826  12.998  15.427  -99.200  -91.000
      TRP6 122     1.020   -12.415  15.254  15.721  -99.200  -91.000
       TYR 126     0.840    -8.755  17.033  23.907  -99.200  -91.000
       PHE 129     1.000    -6.493  10.473  14.657  -99.200  -91.000
       PHE 145     1.000   -12.823  -9.716  21.669  -99.200  -91.000
       PHE 174     1.000   -16.967   0.154   1.460  -99.200  -91.000
       PHE 177     1.000   -20.150  -0.763   5.560  -99.200  -91.000
       TYR 189     0.840   -19.287  -0.392  28.293  -99.200  -91.000
       TRP 190     1.040   -15.248  -7.271  30.060  -99.200  -91.000
      TRP6 190     1.020   -15.544  -8.793  28.286  -99.200  -91.000
       TYR 192     0.840    -7.738  -1.708  28.105  -99.200  -91.000
       TRP 206     1.040    -7.983   0.374  23.646  -99.200  -91.000
      TRP6 206     1.020    -8.559  -0.524  21.542  -99.200  -91.000
       PHE 223     1.000   -11.787  -9.239   6.951  -99.200  -91.000
       PHE 228     1.000     1.177  -7.728   6.364  -99.200  -91.000
       TRP 242     1.040    -2.439 -11.680  15.488  -99.200  -91.000
      TRP6 242     1.020    -1.489 -12.668  17.400  -99.200  -91.000
       PHE 257     1.000   -20.450  -7.904  31.189  -99.200  -91.000