=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 21 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    41.619  19.518  65.866  -99.200  -91.000
       PHE  2     1.000    38.846  19.664  69.694  -99.200  -91.000
       TYR  9     0.840    28.876  15.935  76.326  -99.200  -91.000
       TYR 16     0.840    18.545  32.013  79.576  -99.200  -91.000
       HIS 22     0.900    12.431  33.170  73.650  -99.200  -91.000
       PHE 23     1.000    14.785  27.721  80.029  -99.200  -91.000
       HIS 42     0.900     7.123  18.655  74.484  -99.200  -91.000
       TYR 56     0.840    25.001  11.494  67.814  -99.200  -91.000
       TYR 65     0.840    18.974  11.047  68.556  -99.200  -91.000
       TYR 75     0.840    15.613  17.416  60.562  -99.200  -91.000
       PHE 86     1.000    23.410  20.258  65.441  -99.200  -91.000
       HIS 94     0.900    29.532  33.673  79.685  -99.200  -91.000
       TYR 95     0.840    27.704  34.041  76.166  -99.200  -91.000
       TYR 98     0.840    25.576  23.151  71.468  -99.200  -91.000
       HIS 103     0.900    24.530  21.588  56.108  -99.200  -91.000
       TRP 108     1.040    24.728  27.242  56.980  -99.200  -91.000
      TRP6 108     1.020    23.438  25.786  55.625  -99.200  -91.000
       PHE 109     1.000    28.018  29.675  64.427  -99.200  -91.000
       HIS 125     0.900    26.124  35.551  59.045  -99.200  -91.000
       TYR 126     0.840    32.294  31.951  64.771  -99.200  -91.000
       PHE 133     1.000    21.371  28.128  72.020  -99.200  -91.000