=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 22 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    43.154  39.096  42.559  -99.200  -91.000
       PHE  2     1.000    40.973  39.150  37.218  -99.200  -91.000
       TYR  9     0.840    29.523  43.521  33.512  -99.200  -91.000
       TYR 16     0.840    18.049  28.032  34.719  -99.200  -91.000
       HIS 22     0.900    13.857  27.509  42.126  -99.200  -91.000
       PHE 23     1.000    14.329  32.281  35.111  -99.200  -91.000
       HIS 42     0.900     9.102  42.442  42.118  -99.200  -91.000
       TYR 56     0.840    28.081  48.346  43.216  -99.200  -91.000
       TYR 65     0.840    23.025  49.387  44.166  -99.200  -91.000
       TYR 75     0.840    21.670  43.314  52.907  -99.200  -91.000
       PHE 86     1.000    27.424  39.801  45.805  -99.200  -91.000
       HIS 94     0.900    28.061  26.736  29.860  -99.200  -91.000
       TYR 95     0.840    27.075  25.809  34.642  -99.200  -91.000
       TYR 98     0.840    27.473  36.654  39.469  -99.200  -91.000
       HIS 103     0.900    31.551  38.696  54.829  -99.200  -91.000
       TRP 108     1.040    30.972  33.088  53.776  -99.200  -91.000
      TRP6 108     1.020    30.123  34.683  55.302  -99.200  -91.000
       PHE 109     1.000    31.908  30.206  45.900  -99.200  -91.000
       HIS 125     0.900    31.014  23.155  49.404  -99.200  -91.000
       TYR 126     0.840    36.078  28.327  44.341  -99.200  -91.000
       TRP 133     1.040    24.271  32.054  40.421  -99.200  -91.000
      TRP6 133     1.020    21.961  32.339  40.861  -99.200  -91.000