=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 38 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    12.653  -2.284   5.279  -99.200  -91.000
       TYR  4     0.840    21.055   1.991  10.763  -99.200  -91.000
       TYR 30     0.840    10.352  20.600  32.765  -99.200  -91.000
       PHE 38     1.000    18.956  28.574  32.136  -99.200  -91.000
       TYR 59     0.840    14.315  17.079  36.696  -99.200  -91.000
       TYR 67     0.840     8.451  -2.494  23.501  -99.200  -91.000
       PHE 73     1.000    25.257   3.599  24.470  -99.200  -91.000
       PHE 76     1.000    32.868  11.908  30.025  -99.200  -91.000
       TYR 79     0.840    16.661  11.637  28.164  -99.200  -91.000
       TRP 84     1.040    11.648  -2.569  21.092  -99.200  -91.000
      TRP6 84     1.020    12.447  -3.688  19.168  -99.200  -91.000
       HIS 89     0.900     8.818   4.980   6.942  -99.200  -91.000
       PHE 121     1.000    35.378  22.717   9.774  -99.200  -91.000
       HIS 138     0.900    25.294  -0.471  13.564  -99.200  -91.000
       PHE 156     1.000    24.197  17.770  19.574  -99.200  -91.000
       HIS 158     0.900    22.105  27.013  21.987  -99.200  -91.000
       PHE 159     1.000    17.809  24.018  28.103  -99.200  -91.000
       TYR 160     0.840    20.020  33.704  23.062  -99.200  -91.000
       TYR 161     0.840    22.931  31.713  30.044  -99.200  -91.000
       TYR 171     0.840    19.244  34.074  42.036  -99.200  -91.000
       TYR 178     0.840    17.681  29.204  19.101  -99.200  -91.000
       HIS 184     0.900    23.118   6.804  11.059  -99.200  -91.000
       TYR 191     0.840    21.143  16.662   5.552  -99.200  -91.000
       PHE 199     1.000    25.152  20.072   9.147  -99.200  -91.000
       PHE 200     1.000    29.653  18.977  10.028  -99.200  -91.000
       HIS 205     0.900    39.939  23.029  18.286  -99.200  -91.000
       TYR 218     0.840    29.120  28.700  12.844  -99.200  -91.000
       PHE 219     1.000    21.855  27.037  16.615  -99.200  -91.000
       TRP 228     1.040    12.722  18.091   8.637  -99.200  -91.000
      TRP6 228     1.020    14.058  16.511   9.769  -99.200  -91.000
       HIS 234     0.900    11.682  34.500  21.665  -99.200  -91.000
       TYR 235     0.840    11.123  29.982  27.948  -99.200  -91.000
       TYR 241     0.840     2.858  26.521  29.759  -99.200  -91.000
       TRP 246     1.040     7.173  21.210  13.414  -99.200  -91.000
      TRP6 246     1.020     8.929  19.920  14.321  -99.200  -91.000
       HIS 254     0.900     8.785  29.175   1.280  -99.200  -91.000
       PHE 260     1.000     4.132  22.671  19.178  -99.200  -91.000
       PHE 262     1.000     1.322  24.892  25.084  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================