=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 12 rings
        ring        int.           center             anis.    iso.
       TYR 13     0.840    13.441 -61.217  20.318  -99.200  -91.000
       HIS 15     0.900    20.475 -53.472  24.211  -99.200  -91.000
       PHE 19     1.000     4.487 -59.855  27.700  -99.200  -91.000
       PHE 23     1.000     9.109 -50.505  17.558  -99.200  -91.000
       HIS 24     0.900     9.721 -57.939  21.801  -99.200  -91.000
       HIS 44     0.900    26.622 -57.565  16.505  -99.200  -91.000
       PHE 47     1.000    20.178 -53.302  18.291  -99.200  -91.000
       PHE 71     1.000    16.211 -55.057   6.399  -99.200  -91.000
       HIS 80     0.900    -0.788 -67.492   4.826  -99.200  -91.000
       TRP 108     1.040     2.696 -50.362   5.481  -99.200  -91.000
      TRP6 108     1.020     0.629 -50.596   6.604  -99.200  -91.000
       PHE 112     1.000     0.407 -60.563  12.445  -99.200  -91.000