=============================================================================
          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   -16.557  42.359  74.426  -99.200  -91.000
       PHE  2     1.000    -9.491  34.240  73.177  -99.200  -91.000
       TYR  9     0.840    -7.726  27.194  83.881  -99.200  -91.000
       TYR 16     0.840    11.184  24.056  84.003  -99.200  -91.000
       HIS 22     0.900    15.793  29.491  87.805  -99.200  -91.000
       PHE 23     1.000     9.604  23.412  88.940  -99.200  -91.000
       HIS 42     0.900     6.725  28.954 100.672  -99.200  -91.000
       TYR 56     0.840    -8.792  36.108  89.393  -99.200  -91.000
       TYR 65     0.840    -6.145  35.054  94.896  -99.200  -91.000
       TYR 75     0.840     1.468  43.210  94.221  -99.200  -91.000
       PHE 86     1.000    -0.629  37.982  85.996  -99.200  -91.000
       HIS 94     0.900     5.869  22.821  74.015  -99.200  -91.000
       TYR 95     0.840     8.310  26.626  75.396  -99.200  -91.000
       TYR 98     0.840     0.276  31.875  82.599  -99.200  -91.000
       HIS 103     0.900    -0.114  47.831  84.220  -99.200  -91.000
       TRP 108     1.040     4.851  46.385  80.956  -99.200  -91.000
      TRP6 108     1.020     4.304  47.857  82.728  -99.200  -91.000
       PHE 109     1.000     4.535  39.242  76.984  -99.200  -91.000
       HIS 125     0.900    11.323  41.792  74.122  -99.200  -91.000
       TYR 126     0.840     3.520  38.808  72.117  -99.200  -91.000
       PHE 133     1.000     6.769  31.279  83.390  -99.200  -91.000