=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 19 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900     3.924  -4.253 -44.287  -99.200  -91.000
       HIS  2     0.900    -1.633  -8.455 -38.989  -99.200  -91.000
       HIS  3     0.900    -5.892  -0.497 -43.439  -99.200  -91.000
       TYR 10     0.840    -9.226 -10.441 -33.748  -99.200  -91.000
       PHE 12     1.000    -7.815  -3.972 -30.584  -99.200  -91.000
       TYR 15     0.840    -9.327   7.236 -25.978  -99.200  -91.000
       TYR 35     0.840   -11.327   5.117 -16.442  -99.200  -91.000
       TYR 39     0.840    -1.567   1.057 -25.375  -99.200  -91.000
       TYR 49     0.840     3.282  -1.120 -27.843  -99.200  -91.000
       TYR 62     0.840     5.625   6.631 -20.942  -99.200  -91.000
       TYR 63     0.840     3.001   5.263 -25.443  -99.200  -91.000
       HIS 78     0.900     6.795  13.357 -28.849  -99.200  -91.000
       PHE 89     1.000    -1.901   6.012 -28.636  -99.200  -91.000
       TYR 90     0.840    -8.016   2.419 -34.723  -99.200  -91.000
       PHE 95     1.000   -14.678  -9.146 -18.692  -99.200  -91.000
       PHE 116     1.000    -6.554  -9.099 -29.129  -99.200  -91.000
       PHE 120     1.000    -3.910  -8.438 -34.147  -99.200  -91.000
       TRP 124     1.040     6.607   0.819 -33.340  -99.200  -91.000
      TRP6 124     1.020     5.772   2.892 -32.580  -99.200  -91.000