=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 11 rings
        ring        int.           center             anis.    iso.
       HIS  3     0.900    89.965  70.207  13.662  -99.200  -91.000
       PHE  9     1.000    85.632  63.642  23.795  -99.200  -91.000
       TYR 26     0.840    74.046  40.690  13.799  -99.200  -91.000
       HIS 57     0.900    84.390  46.662  32.759  -99.200  -91.000
       PHE 58     1.000    80.484  39.107  30.084  -99.200  -91.000
       TYR 78     0.840   101.549  27.205  24.653  -99.200  -91.000
       PHE 82     1.000    93.240  33.723  25.701  -99.200  -91.000
       HIS 116     0.900    83.112  26.315  17.205  -99.200  -91.000
       HIS 156     0.900    85.368  44.842  20.404  -99.200  -91.000
       HIS 161     0.900    80.405  49.314  30.311  -99.200  -91.000
       PHE 172     1.000    69.568  37.711  38.388  -99.200  -91.000