=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 18 rings
        ring        int.           center             anis.    iso.
       TYR 26     0.840    12.348  53.400  20.927  -99.200  -91.000
       PHE 30     1.000    21.533  41.378  21.930  -99.200  -91.000
       HIS 42     0.900    36.285  40.738  17.198  -99.200  -91.000
       PHE 44     1.000    26.985  40.618  20.063  -99.200  -91.000
       HIS 45     0.900    26.755  36.836  13.268  -99.200  -91.000
       HIS 47     0.900    25.883  31.154  15.181  -99.200  -91.000
       HIS 68     0.900    24.753  34.028  11.099  -99.200  -91.000
       TYR 69     0.840    15.865  33.112  16.686  -99.200  -91.000
       HIS 73     0.900    12.253  28.081   9.219  -99.200  -91.000
       HIS 77     0.900    24.841  37.757   8.173  -99.200  -91.000
       PHE 79     1.000    22.839  46.173   5.986  -99.200  -91.000
       TRP 81     1.040    19.166  48.431   9.112  -99.200  -91.000
      TRP6 81     1.020    21.066  48.721  10.517  -99.200  -91.000
       HIS 86     0.900    20.989  34.218   8.571  -99.200  -91.000
       PHE 94     1.000    35.627  50.001  19.379  -99.200  -91.000
       HIS 118     0.900    17.077  30.316  20.089  -99.200  -91.000
       HIS 123     0.900    31.053  34.263  13.901  -99.200  -91.000
       HIS 129     0.900    25.427  43.807   9.596  -99.200  -91.000