=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 29 rings
        ring        int.           center             anis.    iso.
       HIS  5     0.900     7.362  38.112  53.859  -99.200  -91.000
       HIS 10     0.900    22.681  39.360  49.365  -99.200  -91.000
       TYR 14     0.840    18.648  46.579  57.992  -99.200  -91.000
       TYR 17     0.840    23.615  32.965  62.103  -99.200  -91.000
       TRP 21     1.040    30.904  28.421  74.287  -99.200  -91.000
      TRP6 21     1.020    32.575  28.976  75.863  -99.200  -91.000
       PHE 32     1.000    19.864  46.993  64.961  -99.200  -91.000
       PHE 38     1.000    31.326  50.093  68.427  -99.200  -91.000
       HIS 44     0.900    18.776  36.036  75.947  -99.200  -91.000
       TRP 46     1.040    28.509  39.369  77.576  -99.200  -91.000
      TRP6 46     1.020    29.432  37.452  78.597  -99.200  -91.000
       HIS 57     0.900    18.224  35.503  51.316  -99.200  -91.000
       PHE 68     1.000    33.355  34.131  60.981  -99.200  -91.000
       HIS 77     0.900    22.257  50.443  79.481  -99.200  -91.000
       TYR 80     0.840    20.290  41.955  79.872  -99.200  -91.000
       PHE 85     1.000    13.250  38.571  80.260  -99.200  -91.000
       TRP 127     1.040    19.490  34.134  58.768  -99.200  -91.000
      TRP6 127     1.020    20.419  36.265  59.169  -99.200  -91.000
       HIS 136     0.900    18.607  26.197  62.361  -99.200  -91.000
       HIS 138     0.900    19.374  25.684  57.427  -99.200  -91.000
       HIS 159     0.900     3.478  40.774  87.465  -99.200  -91.000
       TYR 160     0.840     8.550  39.252  83.085  -99.200  -91.000
       TYR 161     0.840     5.698  47.541  77.299  -99.200  -91.000
       PHE 178     1.000     8.870  31.413  69.682  -99.200  -91.000
       TYR 198     0.840    10.198  41.336  77.483  -99.200  -91.000
       PHE 215     1.000    17.902  51.683  76.391  -99.200  -91.000
       HIS 217     0.900    23.721  60.582  76.614  -99.200  -91.000
       TRP 218     1.040    25.168  52.629  77.112  -99.200  -91.000
      TRP6 218     1.020    24.913  50.855  75.581  -99.200  -91.000