=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 21 rings
        ring        int.           center             anis.    iso.
       TYR  4     0.840    24.562  28.511  73.908  -99.200  -91.000
       TYR 17     0.840    10.587  35.685  80.248  -99.200  -91.000
       HIS 18     0.900     4.433  35.446  73.345  -99.200  -91.000
       PHE 27     1.000    12.278  44.751  69.033  -99.200  -91.000
       TYR 46     0.840    29.703  32.263  83.422  -99.200  -91.000
       HIS 47     0.900    27.876  36.667  90.090  -99.200  -91.000
       PHE 59     1.000    19.845  28.865  75.640  -99.200  -91.000
       PHE 61     1.000    20.466  32.650  71.199  -99.200  -91.000
       PHE 71     1.000    16.423  36.415  78.378  -99.200  -91.000
       PHE 99     1.000    19.159  45.331  83.093  -99.200  -91.000
       TRP 111     1.040    20.995  46.563  69.294  -99.200  -91.000
      TRP6 111     1.020    20.573  48.103  67.527  -99.200  -91.000
       TRP 115     1.040    22.040  49.641  62.599  -99.200  -91.000
      TRP6 115     1.020    23.143  51.353  61.394  -99.200  -91.000
       TYR 119     0.840    25.297  52.226  56.816  -99.200  -91.000
       TRP 138     1.040     9.992  53.028  54.883  -99.200  -91.000
      TRP6 138     1.020    11.848  54.475  55.030  -99.200  -91.000
       PHE 141     1.000    19.402  48.695  58.960  -99.200  -91.000
       PHE 142     1.000    19.152  53.500  57.968  -99.200  -91.000
       TYR 163     0.840     6.951  44.277  77.116  -99.200  -91.000
       TYR 174     0.840    16.907  17.748  74.343  -99.200  -91.000