=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 38 rings
        ring        int.           center             anis.    iso.
       PHE  6     1.000    25.502  -4.928  30.197  -99.200  -91.000
       TRP 14     1.040    20.765  -7.188  12.427  -99.200  -91.000
      TRP6 14     1.020    21.450  -9.396  11.992  -99.200  -91.000
       PHE 15     1.000    21.655  -1.020  17.511  -99.200  -91.000
       TYR 19     0.840    25.825   7.808  18.626  -99.200  -91.000
       HIS 22     0.900    22.524  17.913  21.121  -99.200  -91.000
       TYR 28     0.840    21.574   5.565  20.724  -99.200  -91.000
       TRP 39     1.040    18.335   3.121   0.752  -99.200  -91.000
      TRP6 39     1.020    17.179   5.124   1.056  -99.200  -91.000
       HIS 45     0.900     9.285   7.122  18.662  -99.200  -91.000
       PHE 47     1.000    15.377   9.801  12.750  -99.200  -91.000
       TYR 50     0.840    17.265  19.507  15.161  -99.200  -91.000
       TYR 56     0.840    18.805  13.633  13.529  -99.200  -91.000
       TYR 59     0.840    29.798   7.109  14.823  -99.200  -91.000
       PHE 75     1.000    28.270   4.674   6.846  -99.200  -91.000
       HIS 83     0.900     4.133   5.835   6.185  -99.200  -91.000
       TYR 86     0.840     4.767   9.908  13.819  -99.200  -91.000
       HIS 93     0.900     4.738   7.451  18.886  -99.200  -91.000
       HIS 94     0.900    -2.094   5.024  15.132  -99.200  -91.000
       TYR 125     0.840     0.355  -6.775   3.066  -99.200  -91.000
       PHE 130     1.000    -0.762 -17.401  18.601  -99.200  -91.000
       PHE 139     1.000    24.699   1.149  22.100  -99.200  -91.000
       TYR 147     0.840    20.334  10.519  35.746  -99.200  -91.000
       TYR 149     0.840    19.402   6.522  26.147  -99.200  -91.000
       HIS 163     0.900    -2.100  -8.216  15.588  -99.200  -91.000
       HIS 170     0.900    -6.457  -7.417  30.628  -99.200  -91.000
       TYR 171     0.840    -2.466  -7.790  27.607  -99.200  -91.000
       TYR 172     0.840    -0.214  -1.315  25.087  -99.200  -91.000
       TRP 188     1.040     3.703  -9.722  31.924  -99.200  -91.000
      TRP6 188     1.020     3.029  -8.694  29.933  -99.200  -91.000
       TRP 217     1.040     2.846   2.316  20.148  -99.200  -91.000
      TRP6 217     1.020     1.090   1.737  21.596  -99.200  -91.000
       TYR 230     0.840     8.633  -4.424  19.517  -99.200  -91.000
       HIS 235     0.900     0.762  -6.195   7.712  -99.200  -91.000
       PHE 236     1.000     4.132   0.371   7.913  -99.200  -91.000
       TRP 239     1.040     6.542   4.739   3.128  -99.200  -91.000
      TRP6 239     1.020     8.396   4.734   4.554  -99.200  -91.000
       HIS 243     0.900     9.721   6.388  -0.004  -99.200  -91.000