=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 32 rings
        ring        int.           center             anis.    iso.
       HIS  3     0.900    29.276   7.705  29.997  -99.200  -91.000
       HIS  4     0.900    30.257  13.696  32.516  -99.200  -91.000
       HIS  5     0.900    24.455  15.888  24.274  -99.200  -91.000
       HIS  6     0.900    19.699  15.297  30.356  -99.200  -91.000
       HIS  7     0.900    25.576  19.191  34.519  -99.200  -91.000
       PHE 31     1.000     7.666  32.612  45.393  -99.200  -91.000
       PHE 34     1.000     4.095  35.819  51.374  -99.200  -91.000
       TRP 42     1.040     5.387  36.073  56.614  -99.200  -91.000
      TRP6 42     1.020     7.625  35.361  56.842  -99.200  -91.000
       PHE 43     1.000    -1.382  29.207  60.766  -99.200  -91.000
       PHE 48     1.000     0.600  26.684  48.075  -99.200  -91.000
       PHE 55     1.000    -5.564  20.009  46.471  -99.200  -91.000
       PHE 71     1.000    -5.900  27.709  55.051  -99.200  -91.000
       HIS 88     0.900    -5.654  17.751  50.604  -99.200  -91.000
       PHE 90     1.000    -3.898  11.782  51.645  -99.200  -91.000
       TYR 91     0.840   -12.111  14.391  54.368  -99.200  -91.000
       TYR 97     0.840    -0.695  16.429  59.534  -99.200  -91.000
       PHE 104     1.000     4.969  26.043  67.145  -99.200  -91.000
       PHE 114     1.000    14.382  29.554  64.901  -99.200  -91.000
       PHE 123     1.000     9.688  26.466  65.059  -99.200  -91.000
       TYR 133     0.840    15.029  18.687  57.223  -99.200  -91.000
       HIS 138     0.900     5.919  24.509  48.177  -99.200  -91.000
       PHE 139     1.000     6.408  29.177  56.016  -99.200  -91.000
       TYR 145     0.840    13.728  33.390  54.939  -99.200  -91.000
       HIS 154     0.900     6.483  15.129  39.934  -99.200  -91.000
       TYR 160     0.840    16.976   5.864  39.342  -99.200  -91.000
       TYR 164     0.840    22.619  15.555  37.541  -99.200  -91.000
       TYR 177     0.840    15.090  18.431  51.590  -99.200  -91.000
       TYR 201     0.840    15.146  30.422  35.260  -99.200  -91.000
       TRP 203     1.040     8.157  22.585  39.994  -99.200  -91.000
      TRP6 203     1.020     6.678  20.810  39.484  -99.200  -91.000
       TYR 204     0.840     8.952  27.941  30.900  -99.200  -91.000