=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 9 rings
        ring        int.           center             anis.    iso.
       TYR  6     0.840    27.541  17.005  -3.159  -99.200  -91.000
       PHE 15     1.000    25.199  12.213   1.183  -99.200  -91.000
       HIS 17     0.900    20.153  13.230   3.220  -99.200  -91.000
       HIS 20     0.900    25.521   8.194   3.012  -99.200  -91.000
       HIS 31     0.900    22.325  17.800   7.723  -99.200  -91.000
       PHE 41     1.000    29.758  18.729   1.892  -99.200  -91.000
       HIS 47     0.900    38.558  15.458  -1.727  -99.200  -91.000
       HIS 55     0.900    32.200   7.122   2.806  -99.200  -91.000
       HIS 69     0.900    35.393  13.018  -7.110  -99.200  -91.000