=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 10 rings
        ring        int.           center             anis.    iso.
       HIS 21     0.900    -3.678 -16.277  -1.973  -99.200  -91.000
       TYR 27     0.840   -17.160 -24.411 -21.001  -99.200  -91.000
       TYR 28     0.840   -19.741 -31.522 -17.543  -99.200  -91.000
       TYR 57     0.840   -19.116 -11.140 -18.334  -99.200  -91.000
       TYR 72     0.840    -3.332 -21.187  -8.152  -99.200  -91.000
       HIS 76     0.900    -0.424 -27.381 -13.532  -99.200  -91.000
       TYR 80     0.840   -10.857 -32.184 -20.380  -99.200  -91.000
       PHE 85     1.000    -9.075 -31.879  -7.177  -99.200  -91.000
       PHE 86     1.000   -13.398 -37.702 -12.090  -99.200  -91.000
       TYR 101     0.840   -38.128 -23.953 -13.907  -99.200  -91.000