=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 31 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    47.195  28.632 -14.446  -99.200  -91.000
       HIS  2     0.900    53.730  22.980 -16.323  -99.200  -91.000
       TYR 30     0.840    23.879  11.964 -42.535  -99.200  -91.000
       TRP 36     1.040    16.244  17.852 -52.190  -99.200  -91.000
      TRP6 36     1.020    14.807  16.048 -52.739  -99.200  -91.000
       TYR 38     0.840    11.372  17.686 -41.925  -99.200  -91.000
       HIS 40     0.900    12.462  18.786 -52.835  -99.200  -91.000
       PHE 48     1.000    16.948   7.429 -40.578  -99.200  -91.000
       PHE 50     1.000    16.286  18.202 -36.414  -99.200  -91.000
       HIS 52     0.900    22.723   9.295 -38.867  -99.200  -91.000
       TYR 57     0.840    26.956  19.473 -31.923  -99.200  -91.000
       HIS 59     0.900    28.043   9.357 -32.926  -99.200  -91.000
       PHE 66     1.000    39.972   9.974 -25.289  -99.200  -91.000
       HIS 84     0.900    23.489  23.545 -52.628  -99.200  -91.000
       PHE 86     1.000    21.367  16.285 -51.202  -99.200  -91.000
       PHE 93     1.000    17.654   7.747 -46.634  -99.200  -91.000
       TYR 97     0.840    25.704   1.378 -47.625  -99.200  -91.000
       HIS 99     0.900    29.274  11.595 -44.801  -99.200  -91.000
       HIS 102     0.900    35.222   9.724 -45.863  -99.200  -91.000
       HIS 113     0.900    48.879   6.733 -35.541  -99.200  -91.000
       HIS 120     0.900    46.345  -1.174 -26.949  -99.200  -91.000
       PHE 123     1.000    41.511  -1.388 -29.594  -99.200  -91.000
       PHE 125     1.000    36.537   8.325 -26.336  -99.200  -91.000
       TRP 128     1.040    32.345   5.827 -27.238  -99.200  -91.000
      TRP6 128     1.020    31.285   7.349 -28.718  -99.200  -91.000
       TYR 129     0.840    33.276   7.772 -33.504  -99.200  -91.000
       HIS 134     0.900    28.469  -3.290 -37.921  -99.200  -91.000
       PHE 140     1.000    21.873   6.786 -42.811  -99.200  -91.000
       HIS 155     0.900     0.329   3.786 -54.270  -99.200  -91.000
       TYR 158     0.840     1.818   7.327 -48.051  -99.200  -91.000
       TYR 163     0.840    11.073   0.262 -43.766  -99.200  -91.000