=============================================================================
          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  5     0.900    31.073 -51.308  31.292  -99.200  -91.000
       PHE 29     1.000    24.209 -43.409  28.164  -99.200  -91.000
       PHE 41     1.000    26.719 -40.915  38.210  -99.200  -91.000
       PHE 42     1.000    21.319 -39.485  32.873  -99.200  -91.000
       PHE 47     1.000    21.824 -27.889  34.531  -99.200  -91.000
       HIS 59     0.900    14.903 -34.311  25.152  -99.200  -91.000
       HIS 61     0.900    18.276 -33.745  20.451  -99.200  -91.000
       PHE 63     1.000    21.845 -37.232  11.764  -99.200  -91.000
       HIS 76     0.900    13.849 -35.293  21.213  -99.200  -91.000
       TYR 77     0.840    18.507 -43.652  17.268  -99.200  -91.000
       HIS 84     0.900     9.546 -36.107  23.715  -99.200  -91.000
       HIS 87     0.900    11.037 -39.445  20.053  -99.200  -91.000
       PHE 91     1.000    18.662 -40.968  28.190  -99.200  -91.000
       PHE 94     1.000    17.803 -36.871  34.057  -99.200  -91.000
       TRP 102     1.040    25.897 -37.645  41.982  -99.200  -91.000
      TRP6 102     1.020    24.951 -39.412  43.182  -99.200  -91.000
       TYR 104     0.840    21.750 -46.555  38.635  -99.200  -91.000
       HIS 116     0.900    16.289 -50.124  16.086  -99.200  -91.000
       HIS 126     0.900    16.716 -29.904  24.975  -99.200  -91.000
       TRP 163     1.040    28.478 -48.486  36.161  -99.200  -91.000
      TRP6 163     1.020    26.660 -47.309  35.237  -99.200  -91.000