=============================================================================
          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  1     0.900     9.626   5.676  12.769  -99.200  -91.000
       HIS  2     0.900    11.763   1.297   6.474  -99.200  -91.000
       TRP  3     1.040     5.045   0.671  11.894  -99.200  -91.000
      TRP6  3     1.020     3.008  -0.513  11.943  -99.200  -91.000
       TYR  5     0.840     0.951  -6.120  12.519  -99.200  -91.000
       HIS  8     0.900    13.753 -11.349   9.643  -99.200  -91.000
       HIS 13     0.900    12.491  -7.413  15.997  -99.200  -91.000
       TRP 14     1.040     5.973  -3.013  16.132  -99.200  -91.000
      TRP6 14     1.020     3.644  -3.254  16.461  -99.200  -91.000
       HIS 15     0.900    12.006  -3.166  22.174  -99.200  -91.000
       PHE 18     1.000     7.285   3.831  16.316  -99.200  -91.000
       HIS 34     0.900   -13.949 -15.999  36.011  -99.200  -91.000
       TYR 38     0.840   -23.101  -2.837  37.336  -99.200  -91.000
       TYR 49     0.840   -21.321   4.192  14.722  -99.200  -91.000
       HIS 62     0.900    -0.978   0.024   9.265  -99.200  -91.000
       PHE 64     1.000   -10.253  -4.011   5.210  -99.200  -91.000
       PHE 68     1.000   -17.326   5.510   8.349  -99.200  -91.000
       TYR 86     0.840   -14.377  10.577  23.061  -99.200  -91.000
       PHE 91     1.000   -15.540  -0.116   8.922  -99.200  -91.000
       HIS 92     0.900    -8.121  -0.246  12.633  -99.200  -91.000
       PHE 93     1.000   -13.201  -5.623   9.881  -99.200  -91.000
       HIS 94     0.900    -5.713  -4.616  14.495  -99.200  -91.000
       TRP 95     1.040    -6.830 -10.565   8.371  -99.200  -91.000
      TRP6 95     1.020    -7.030  -8.263   7.817  -99.200  -91.000
       HIS 105     0.900    -8.399  -4.989  23.389  -99.200  -91.000
       TYR 112     0.840   -13.752 -14.011  20.895  -99.200  -91.000
       HIS 117     0.900    -9.088  -2.606  17.228  -99.200  -91.000
       HIS 120     0.900   -16.086   5.824  17.505  -99.200  -91.000
       TRP 121     1.040   -11.754  12.922  15.276  -99.200  -91.000
      TRP6 121     1.020   -12.209  15.207  15.559  -99.200  -91.000
       TYR 125     0.840    -8.591  17.007  23.839  -99.200  -91.000
       PHE 128     1.000    -6.559  10.408  14.571  -99.200  -91.000
       PHE 144     1.000   -12.918  -9.725  21.691  -99.200  -91.000
       PHE 173     1.000   -16.793   0.210   1.334  -99.200  -91.000
       PHE 176     1.000   -20.041  -0.922   5.530  -99.200  -91.000
       TYR 188     0.840   -19.430  -0.279  28.041  -99.200  -91.000
       TRP 189     1.040   -15.568  -7.042  30.124  -99.200  -91.000
      TRP6 189     1.020   -15.763  -8.584  28.349  -99.200  -91.000
       TYR 191     0.840    -7.997  -1.615  28.115  -99.200  -91.000
       TRP 206     1.040    -8.198   0.378  23.793  -99.200  -91.000
      TRP6 206     1.020    -8.716  -0.486  21.679  -99.200  -91.000
       PHE 223     1.000   -11.876  -9.004   6.295  -99.200  -91.000
       PHE 228     1.000     1.123  -7.839   6.375  -99.200  -91.000
       TRP 242     1.040    -2.537 -11.696  15.573  -99.200  -91.000
      TRP6 242     1.020    -1.573 -12.603  17.540  -99.200  -91.000
       PHE 257     1.000   -20.796  -7.692  31.283  -99.200  -91.000