=============================================================================
          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    46.848  39.795  44.527  -99.200  -91.000
       PHE  2     1.000    41.438  39.208  36.878  -99.200  -91.000
       TYR  9     0.840    29.952  43.582  33.076  -99.200  -91.000
       TYR 16     0.840    18.794  28.148  33.861  -99.200  -91.000
       HIS 22     0.900    14.350  27.462  41.512  -99.200  -91.000
       PHE 23     1.000    14.925  32.290  34.551  -99.200  -91.000
       HIS 42     0.900     9.583  42.502  41.482  -99.200  -91.000
       TYR 56     0.840    28.489  48.499  42.744  -99.200  -91.000
       TYR 65     0.840    23.451  49.409  43.686  -99.200  -91.000
       TYR 75     0.840    21.898  43.517  52.325  -99.200  -91.000
       PHE 86     1.000    27.868  39.880  45.299  -99.200  -91.000
       HIS 94     0.900    28.692  26.670  29.610  -99.200  -91.000
       TYR 95     0.840    27.666  25.963  34.220  -99.200  -91.000
       TYR 98     0.840    27.974  36.744  39.058  -99.200  -91.000
       HIS 103     0.900    31.810  38.539  54.408  -99.200  -91.000
       TRP 108     1.040    31.313  33.163  53.390  -99.200  -91.000
      TRP6 108     1.020    30.378  34.692  54.932  -99.200  -91.000
       PHE 109     1.000    32.121  30.361  45.319  -99.200  -91.000
       HIS 125     0.900    31.378  23.147  48.899  -99.200  -91.000
       TYR 126     0.840    36.303  28.266  43.869  -99.200  -91.000
       PHE 133     1.000    23.703  32.008  40.006  -99.200  -91.000