=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 13 rings
        ring        int.           center             anis.    iso.
       HIS  2     0.900    11.081  44.795  24.823  -99.200  -91.000
       TYR 19     0.840     0.740  32.110   5.683  -99.200  -91.000
       TYR 24     0.840    10.207  26.789  -3.084  -99.200  -91.000
       HIS 26     0.900     5.221  32.881 -10.591  -99.200  -91.000
       TYR 35     0.840    15.731  24.036 -17.776  -99.200  -91.000
       PHE 42     1.000    14.323  21.638  -5.653  -99.200  -91.000
       PHE 43     1.000    11.247  25.394  -8.916  -99.200  -91.000
       HIS 53     0.900     9.385  24.199   7.857  -99.200  -91.000
       TYR 56     0.840     6.553  24.960  15.634  -99.200  -91.000
       TYR 86     0.840    15.884  36.592  -8.570  -99.200  -91.000
       TYR 92     0.840    22.232  34.398   3.413  -99.200  -91.000
       TYR 98     0.840    12.534  29.610  10.420  -99.200  -91.000
       HIS 125     0.900    14.123  22.061   1.447  -99.200  -91.000