=============================================================================
          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    41.636  36.326  50.022  -99.200  -91.000
       PHE  2     1.000    40.893  39.433  36.926  -99.200  -91.000
       TYR  9     0.840    29.508  43.864  33.114  -99.200  -91.000
       TYR 16     0.840    18.113  28.428  33.803  -99.200  -91.000
       HIS 22     0.900    14.121  27.861  41.538  -99.200  -91.000
       PHE 23     1.000    14.470  32.816  34.631  -99.200  -91.000
       HIS 42     0.900     9.244  42.697  41.709  -99.200  -91.000
       TYR 56     0.840    28.029  48.732  42.836  -99.200  -91.000
       TYR 65     0.840    22.887  49.607  43.654  -99.200  -91.000
       TYR 75     0.840    21.564  43.747  52.365  -99.200  -91.000
       PHE 86     1.000    27.327  40.076  45.367  -99.200  -91.000
       HIS 94     0.900    28.059  26.876  29.516  -99.200  -91.000
       TYR 95     0.840    27.159  26.369  34.190  -99.200  -91.000
       TYR 98     0.840    27.429  37.006  39.076  -99.200  -91.000
       HIS 103     0.900    31.332  38.899  54.397  -99.200  -91.000
       TRP 108     1.040    30.741  33.451  53.311  -99.200  -91.000
      TRP6 108     1.020    29.900  35.055  54.854  -99.200  -91.000
       PHE 109     1.000    31.646  30.606  45.307  -99.200  -91.000
       HIS 125     0.900    30.507  23.405  48.849  -99.200  -91.000
       TYR 126     0.840    35.811  28.571  43.975  -99.200  -91.000
       PHE 133     1.000    23.143  32.356  39.898  -99.200  -91.000