=============================================================================
          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    23.825  -3.020  13.841  -99.200  -91.000
       TRP 14     1.040    19.555  -8.932  30.235  -99.200  -91.000
      TRP6 14     1.020    20.136 -11.168  29.725  -99.200  -91.000
       PHE 15     1.000    18.617  -2.392  26.381  -99.200  -91.000
       TYR 19     0.840    12.403   4.837  23.644  -99.200  -91.000
       HIS 22     0.900    11.807  15.756  25.133  -99.200  -91.000
       TYR 28     0.840    17.771   4.686  24.356  -99.200  -91.000
       TRP 39     1.040    10.893  -3.259  42.015  -99.200  -91.000
      TRP6 39     1.020    10.952  -0.971  42.596  -99.200  -91.000
       HIS 45     0.900    24.821   8.764  33.602  -99.200  -91.000
       PHE 47     1.000    16.532   7.442  34.641  -99.200  -91.000
       TYR 50     0.840    15.306  17.299  31.762  -99.200  -91.000
       TYR 56     0.840    12.620  10.003  32.709  -99.200  -91.000
       TYR 59     0.840     8.161   1.422  24.109  -99.200  -91.000
       PHE 75     1.000     5.824  -2.880  31.379  -99.200  -91.000
       HIS 83     0.900    23.047   5.771  46.428  -99.200  -91.000
       TYR 86     0.840    24.729  11.196  39.958  -99.200  -91.000
       HIS 93     0.900    29.214  10.988  35.673  -99.200  -91.000
       HIS 94     0.900    32.408   9.501  42.955  -99.200  -91.000
       TYR 125     0.840    31.042  -6.716  50.070  -99.200  -91.000
       PHE 130     1.000    39.156  -7.449  39.414  -99.200  -91.000
       PHE 139     1.000    17.886   0.108  21.109  -99.200  -91.000
       TYR 147     0.840    23.810  13.638  13.135  -99.200  -91.000
       TYR 149     0.840    21.651   7.807  21.164  -99.200  -91.000
       HIS 163     0.900    40.311   0.025  43.046  -99.200  -91.000
       HIS 170     0.900    50.556   7.222  31.383  -99.200  -91.000
       TYR 171     0.840    44.788   1.347  32.127  -99.200  -91.000
       TYR 172     0.840    38.935   5.844  33.326  -99.200  -91.000
       TRP 188     1.040    43.213  -0.463  24.618  -99.200  -91.000
      TRP6 188     1.020    42.202  -0.179  26.736  -99.200  -91.000
       TRP 217     1.040    32.468   6.784  35.660  -99.200  -91.000
      TRP6 217     1.020    34.802   7.143  35.527  -99.200  -91.000
       TYR 230     0.840    30.648  -1.163  32.171  -99.200  -91.000
       HIS 235     0.900    31.361  -3.834  46.293  -99.200  -91.000
       PHE 236     1.000    26.106   1.209  44.678  -99.200  -91.000
       TRP 239     1.040    20.156   2.772  47.401  -99.200  -91.000
      TRP6 239     1.020    19.341   2.602  45.189  -99.200  -91.000
       HIS 243     0.900    16.369   2.877  48.472  -99.200  -91.000