=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 14 rings
        ring        int.           center             anis.    iso.
       TYR 29     0.840    56.372  -5.073  13.264  -99.200  -91.000
       TYR 31     0.840    58.950   4.403  11.022  -99.200  -91.000
       PHE 38     1.000    60.829  -7.525  -1.581  -99.200  -91.000
       TYR 52     0.840    59.276 -17.823   2.022  -99.200  -91.000
       TYR 53     0.840    61.053 -13.731  -0.011  -99.200  -91.000
       HIS 54     0.900    54.665 -10.801   5.475  -99.200  -91.000
       PHE 56     1.000    58.789  -6.467   9.038  -99.200  -91.000
       TYR 72     0.840    59.960 -22.820   6.457  -99.200  -91.000
       TYR 76     0.840    66.763 -13.031   2.280  -99.200  -91.000
       TRP 77     1.040    71.720  -4.163   4.899  -99.200  -91.000
      TRP6 77     1.020    70.436  -2.422   5.758  -99.200  -91.000
       HIS 81     0.900    63.315   1.430  -2.278  -99.200  -91.000
       TYR 82     0.840    65.168  -0.321  -8.200  -99.200  -91.000
       PHE 85     1.000    66.404  -7.581  -1.331  -99.200  -91.000