=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 18 rings
        ring        int.           center             anis.    iso.
       TYR  7     0.840    40.397  24.525  32.273  -99.200  -91.000
       HIS 13     0.900    41.684  22.428  24.260  -99.200  -91.000
       PHE 14     1.000    38.894  28.667  29.212  -99.200  -91.000
       HIS 33     0.900    31.728  33.136  18.686  -99.200  -91.000
       TYR 47     0.840    16.627  24.170  28.076  -99.200  -91.000
       TYR 56     0.840    18.884  27.564  23.936  -99.200  -91.000
       TYR 66     0.840    22.442  19.833  17.072  -99.200  -91.000
       PHE 77     1.000    23.637  18.541  26.647  -99.200  -91.000
       HIS 85     0.900    35.290  17.252  45.667  -99.200  -91.000
       TYR 86     0.840    37.721  17.387  37.577  -99.200  -91.000
       TYR 89     0.840    27.725  20.219  32.533  -99.200  -91.000
       HIS 94     0.900    20.319  10.596  22.282  -99.200  -91.000
       TRP 99     1.040    25.410   8.049  23.658  -99.200  -91.000
      TRP6 99     1.020    24.158   8.511  21.703  -99.200  -91.000
       PHE 100     1.000    28.559  10.948  31.136  -99.200  -91.000
       HIS 116     0.900    34.342   5.047  29.560  -99.200  -91.000
       TYR 117     0.840    31.277   8.644  36.494  -99.200  -91.000
       PHE 124     1.000    33.289  19.782  30.069  -99.200  -91.000