=============================================================================
          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    -0.569  27.432  64.351  -99.200  -91.000
       PHE  2     1.000    -0.265  27.857  69.939  -99.200  -91.000
       TYR  9     0.840     9.372  32.542  76.872  -99.200  -91.000
       TYR 16     0.840    20.381  17.531  80.114  -99.200  -91.000
       HIS 22     0.900    26.786  16.572  74.432  -99.200  -91.000
       PHE 23     1.000    24.231  21.529  80.573  -99.200  -91.000
       HIS 42     0.900    31.386  31.640  75.196  -99.200  -91.000
       TYR 56     0.840    13.186  36.962  67.876  -99.200  -91.000
       TYR 65     0.840    18.865  37.901  69.217  -99.200  -91.000
       TYR 75     0.840    23.004  31.694  60.935  -99.200  -91.000
       PHE 86     1.000    15.116  28.400  66.064  -99.200  -91.000
       HIS 94     0.900     9.683  15.867  81.319  -99.200  -91.000
       TYR 95     0.840    12.307  15.073  77.478  -99.200  -91.000
       TYR 98     0.840    13.232  25.467  72.084  -99.200  -91.000
       HIS 103     0.900    13.989  26.961  56.282  -99.200  -91.000
       TRP 108     1.040    14.471  21.225  57.592  -99.200  -91.000
      TRP6 108     1.020    15.621  22.781  56.235  -99.200  -91.000
       PHE 109     1.000    11.140  18.824  65.107  -99.200  -91.000
       HIS 125     0.900    12.996  11.389  62.267  -99.200  -91.000
       TYR 126     0.840     6.629  16.757  65.116  -99.200  -91.000
       PHE 133     1.000    17.533  20.960  72.632  -99.200  -91.000