=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 26 rings
        ring        int.           center             anis.    iso.
       HIS  2     0.900    64.463  -5.102  48.094  -99.200  -91.000
       HIS  3     0.900    68.483  -5.166  40.983  -99.200  -91.000
       HIS  4     0.900    60.807  -2.478  42.153  -99.200  -91.000
       HIS  5     0.900    62.514  -3.256  34.834  -99.200  -91.000
       HIS  6     0.900    58.249   2.433  39.662  -99.200  -91.000
       HIS  7     0.900    54.718   3.441  32.102  -99.200  -91.000
       TYR 17     0.840    69.648  -0.564  41.208  -99.200  -91.000
       PHE 18     1.000    63.189  -0.597  46.982  -99.200  -91.000
       TYR 53     0.840    25.581  11.290  49.538  -99.200  -91.000
       PHE 70     1.000    39.058   9.553  53.001  -99.200  -91.000
       TYR 81     0.840    20.286  -0.743  52.469  -99.200  -91.000
       PHE 86     1.000    36.981   0.851  43.462  -99.200  -91.000
       TYR 92     0.840    44.637  12.482  26.767  -99.200  -91.000
       HIS 94     0.900    52.469  19.456  25.900  -99.200  -91.000
       TYR 132     0.840    38.251  15.685  31.687  -99.200  -91.000
       PHE 137     1.000    32.274  11.130  37.314  -99.200  -91.000
       TYR 139     0.840    28.344  15.116  27.875  -99.200  -91.000
       TYR 165     0.840    30.398  15.383  52.825  -99.200  -91.000
       PHE 168     1.000    42.815  14.516  59.487  -99.200  -91.000
       HIS 172     0.900    53.561  26.012  51.549  -99.200  -91.000
       PHE 174     1.000    55.925  14.471  48.306  -99.200  -91.000
       TYR 178     0.840    44.317   5.995  55.269  -99.200  -91.000
       TYR 182     0.840    60.044  10.345  46.237  -99.200  -91.000
       TYR 186     0.840    58.237   5.926  51.273  -99.200  -91.000
       TYR 191     0.840    52.992   6.473  59.707  -99.200  -91.000
       TYR 200     0.840    61.110  15.684  49.471  -99.200  -91.000