=============================================================================
          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    -1.371  28.043  64.497  -99.200  -91.000
       PHE  2     1.000    -0.531  27.828  70.606  -99.200  -91.000
       TYR  9     0.840     9.438  32.359  77.349  -99.200  -91.000
       TYR 16     0.840    20.634  17.146  80.190  -99.200  -91.000
       HIS 22     0.900    26.721  16.397  74.214  -99.200  -91.000
       PHE 23     1.000    23.987  21.377  80.711  -99.200  -91.000
       HIS 42     0.900    31.336  31.237  75.151  -99.200  -91.000
       TYR 56     0.840    12.952  37.002  68.371  -99.200  -91.000
       TYR 65     0.840    18.618  38.002  69.570  -99.200  -91.000
       TYR 75     0.840    22.665  31.912  61.119  -99.200  -91.000
       PHE 86     1.000    14.823  28.516  66.376  -99.200  -91.000
       HIS 94     0.900     9.627  15.712  81.571  -99.200  -91.000
       TYR 95     0.840    11.911  14.785  77.516  -99.200  -91.000
       TYR 98     0.840    13.027  25.512  72.366  -99.200  -91.000
       HIS 103     0.900    13.589  27.146  56.574  -99.200  -91.000
       TRP 108     1.040    14.051  21.302  57.804  -99.200  -91.000
      TRP6 108     1.020    15.101  22.902  56.447  -99.200  -91.000
       PHE 109     1.000    10.904  18.814  65.311  -99.200  -91.000
       HIS 125     0.900    12.843  11.515  62.292  -99.200  -91.000
       TYR 126     0.840     6.600  16.584  65.774  -99.200  -91.000
       PHE 133     1.000    17.423  20.859  72.813  -99.200  -91.000