=============================================================================
          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    -0.815  27.578  64.381  -99.200  -91.000
       PHE  2     1.000    -0.450  27.765  70.160  -99.200  -91.000
       TYR  9     0.840     9.343  32.307  76.946  -99.200  -91.000
       TYR 16     0.840    20.066  17.177  79.877  -99.200  -91.000
       HIS 22     0.900    26.725  16.606  74.172  -99.200  -91.000
       PHE 23     1.000    24.102  21.442  80.458  -99.200  -91.000
       HIS 42     0.900    31.235  31.480  74.960  -99.200  -91.000
       TYR 56     0.840    13.013  36.905  67.989  -99.200  -91.000
       TYR 65     0.840    18.707  37.876  69.167  -99.200  -91.000
       TYR 75     0.840    22.672  31.726  60.807  -99.200  -91.000
       PHE 86     1.000    14.891  28.371  66.055  -99.200  -91.000
       HIS 94     0.900     9.531  15.710  81.256  -99.200  -91.000
       TYR 95     0.840    12.257  14.916  77.270  -99.200  -91.000
       TYR 98     0.840    13.101  25.420  72.077  -99.200  -91.000
       HIS 103     0.900    13.652  27.001  56.285  -99.200  -91.000
       TRP 108     1.040    14.145  21.212  57.517  -99.200  -91.000
      TRP6 108     1.020    15.268  22.804  56.172  -99.200  -91.000
       PHE 109     1.000    11.060  18.760  65.006  -99.200  -91.000
       HIS 125     0.900    12.794  11.349  62.252  -99.200  -91.000
       TYR 126     0.840     6.623  16.664  65.343  -99.200  -91.000
       PHE 133     1.000    17.459  20.851  72.474  -99.200  -91.000