=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 29 rings
        ring        int.           center             anis.    iso.
       HIS  3     0.900    44.525   5.335  -4.776  -99.200  -91.000
       TYR  4     0.840    44.993   3.999  -8.408  -99.200  -91.000
       HIS 13     0.900    29.862   6.782  -8.728  -99.200  -91.000
       PHE 16     1.000    22.289   6.284  -9.143  -99.200  -91.000
       PHE 18     1.000    25.440  -1.907 -16.151  -99.200  -91.000
       PHE 19     1.000    18.060   2.734  -9.277  -99.200  -91.000
       TRP 28     1.040    14.471  -2.602 -14.366  -99.200  -91.000
      TRP6 28     1.020    15.573  -1.108 -12.907  -99.200  -91.000
       PHE 31     1.000    20.549  -2.626  -9.885  -99.200  -91.000
       PHE 38     1.000    19.591  -6.896  -4.521  -99.200  -91.000
       PHE 40     1.000    13.822  -6.129  -3.402  -99.200  -91.000
       TRP 41     1.040    14.298  -3.403   4.957  -99.200  -91.000
      TRP6 41     1.020    12.324  -2.343   5.730  -99.200  -91.000
       PHE 42     1.000     9.482   0.545  -2.749  -99.200  -91.000
       PHE 46     1.000     7.691  -6.065  -5.177  -99.200  -91.000
       HIS 47     0.900     6.902  -2.450   5.050  -99.200  -91.000
       PHE 59     1.000    11.557  -2.588  -6.059  -99.200  -91.000
       PHE 60     1.000    15.373  -3.203  -8.998  -99.200  -91.000
       TYR 62     0.840     4.583  -2.613  -8.489  -99.200  -91.000
       PHE 67     1.000     6.796   5.848 -13.137  -99.200  -91.000
       HIS 68     0.900     2.168   2.810 -19.935  -99.200  -91.000
       PHE 88     1.000    25.118   5.782  -6.087  -99.200  -91.000
       PHE 90     1.000    17.710   8.534  -7.253  -99.200  -91.000
       PHE 96     1.000     1.438   5.614 -11.151  -99.200  -91.000
       TYR 101     0.840     7.498   9.267  -8.751  -99.200  -91.000
       PHE 109     1.000    23.002   0.738  -5.594  -99.200  -91.000
       TYR 119     0.840    17.261  -0.654  -4.298  -99.200  -91.000
       TYR 122     0.840    16.806   4.745   3.621  -99.200  -91.000
       PHE 123     1.000     9.022   5.963  -1.252  -99.200  -91.000