=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 30 rings
        ring        int.           center             anis.    iso.
       HIS  9     0.900    12.572  33.520  54.307  -99.200  -91.000
       TYR 13     0.840    11.632  31.515  39.978  -99.200  -91.000
       HIS 21     0.900    -4.718  26.780  29.969  -99.200  -91.000
       HIS 22     0.900     2.813  27.699  28.668  -99.200  -91.000
       PHE 23     1.000     0.364  24.697  34.425  -99.200  -91.000
       TYR 34     0.840    16.820  20.972  60.814  -99.200  -91.000
       PHE 52     1.000    -4.698  22.522  34.986  -99.200  -91.000
       PHE 54     1.000    -2.912  25.516  42.460  -99.200  -91.000
       PHE 61     1.000     2.577  24.873  43.004  -99.200  -91.000
       PHE 65     1.000    10.934  23.853  53.968  -99.200  -91.000
       HIS 68     0.900    13.802  12.865  56.476  -99.200  -91.000
       PHE 75     1.000    19.012  10.952  48.175  -99.200  -91.000
       PHE 76     1.000    14.388  13.722  50.011  -99.200  -91.000
       PHE 80     1.000    19.447  21.431  50.240  -99.200  -91.000
       PHE 84     1.000    16.067  17.640  47.274  -99.200  -91.000
       TRP 86     1.040    10.677  16.759  43.425  -99.200  -91.000
      TRP6 86     1.020     8.746  16.771  42.032  -99.200  -91.000
       TYR 92     0.840    -4.527  12.269  39.043  -99.200  -91.000
       TYR 113     0.840    11.498  24.077  46.621  -99.200  -91.000
       PHE 122     1.000    -4.749  14.746  34.331  -99.200  -91.000
       TRP 136     1.040    -4.285  16.310  46.496  -99.200  -91.000
      TRP6 136     1.020    -4.524  14.428  45.078  -99.200  -91.000
       TYR 144     0.840    11.621   1.615  46.637  -99.200  -91.000
       HIS 165     0.900   -12.417   9.816  49.145  -99.200  -91.000
       TYR 174     0.840    11.818  11.685  46.182  -99.200  -91.000
       TYR 189     0.840    12.848   7.609  54.674  -99.200  -91.000
       TYR 190     0.840     7.258   2.403  55.680  -99.200  -91.000
       TYR 206     0.840    -3.861  36.502  43.095  -99.200  -91.000
       HIS 210     0.900     0.755  23.904  57.009  -99.200  -91.000
       TYR 217     0.840    14.100   3.759  60.156  -99.200  -91.000