=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 16 rings
        ring        int.           center             anis.    iso.
       HIS  5     0.900     7.159  52.343  30.585  -99.200  -91.000
       TYR 12     0.840    20.578  54.232  28.514  -99.200  -91.000
       TYR 13     0.840    20.104  48.576  30.120  -99.200  -91.000
       TYR 26     0.840    34.496  42.037  15.939  -99.200  -91.000
       PHE 28     1.000    28.618  46.302   7.431  -99.200  -91.000
       TYR 29     0.840    28.918  42.130  12.086  -99.200  -91.000
       PHE 64     1.000    35.742  44.155 -18.588  -99.200  -91.000
       PHE 67     1.000    38.481  45.440 -12.031  -99.200  -91.000
       PHE 74     1.000    29.148  50.051  -1.541  -99.200  -91.000
       HIS 85     0.900    34.453  58.748   0.602  -99.200  -91.000
       PHE 89     1.000    37.951  54.641   3.800  -99.200  -91.000
       TYR 92     0.840    40.898  47.488   3.875  -99.200  -91.000
       TYR 97     0.840    31.033  41.359   1.317  -99.200  -91.000
       PHE 104     1.000    33.305  49.203  -4.185  -99.200  -91.000
       HIS 110     0.900    43.771  55.810  -9.128  -99.200  -91.000
       PHE 111     1.000    38.046  58.630 -10.586  -99.200  -91.000