=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 49 rings
        ring        int.           center             anis.    iso.
       TYR  3     0.840    -1.151   5.415  11.315  -99.200  -91.000
       HIS 15     0.900    -2.587  22.839  22.759  -99.200  -91.000
       TYR 20     0.840     1.679  23.192  22.512  -99.200  -91.000
       PHE 23     1.000    10.593  24.398  21.685  -99.200  -91.000
       PHE 33     1.000    26.765  34.894  26.524  -99.200  -91.000
       TRP 38     1.040    10.884  36.696  23.235  -99.200  -91.000
      TRP6 38     1.020     9.135  37.775  24.411  -99.200  -91.000
       TRP 51     1.040    17.857  37.519  35.474  -99.200  -91.000
      TRP6 51     1.020    19.122  37.482  37.459  -99.200  -91.000
       TYR 56     0.840    24.255  26.154  36.148  -99.200  -91.000
       HIS 62     0.900    37.217  33.090  29.375  -99.200  -91.000
       HIS 70     0.900    35.971  32.390  16.115  -99.200  -91.000
       TYR 92     0.840    41.707  19.958  17.322  -99.200  -91.000
       HIS 93     0.900    36.938  14.007  18.508  -99.200  -91.000
       HIS 104     0.900    35.236  14.397  37.161  -99.200  -91.000
       PHE 112     1.000    29.222   8.148  25.874  -99.200  -91.000
       TYR 116     0.840    18.561  11.707  27.064  -99.200  -91.000
       PHE 130     1.000    30.467  -4.601  35.601  -99.200  -91.000
       TYR 136     0.840    20.536  -1.629  44.748  -99.200  -91.000
       HIS 142     0.900    18.696  14.411  32.699  -99.200  -91.000
       PHE 159     1.000    18.726   5.896  46.152  -99.200  -91.000
       HIS 161     0.900    16.299  13.795  46.088  -99.200  -91.000
       HIS 166     0.900    12.962   3.007  49.762  -99.200  -91.000
       PHE 184     1.000    25.547   9.099  44.336  -99.200  -91.000
       TYR 188     0.840    19.732  14.510  43.200  -99.200  -91.000
       PHE 194     1.000    25.077  21.077  47.595  -99.200  -91.000
       PHE 207     1.000    24.636  -3.768  52.239  -99.200  -91.000
       TYR 212     0.840    26.630   6.563  35.938  -99.200  -91.000
       HIS 217     0.900    22.140  20.901  36.578  -99.200  -91.000
       TYR 222     0.840    28.917  23.655  43.792  -99.200  -91.000
       HIS 237     0.900    39.148   8.680  48.190  -99.200  -91.000
       PHE 242     1.000    33.554  11.682  39.714  -99.200  -91.000
       TYR 249     0.840    33.799  22.128  32.720  -99.200  -91.000
       PHE 252     1.000    25.763  19.584  21.888  -99.200  -91.000
       TYR 255     0.840    32.797  14.755  31.786  -99.200  -91.000
       TYR 269     0.840    31.281  -5.616  24.879  -99.200  -91.000
       PHE 273     1.000    32.739   5.805  21.888  -99.200  -91.000
       PHE 275     1.000    26.747   0.660  15.512  -99.200  -91.000
       PHE 293     1.000    39.607  31.146  32.508  -99.200  -91.000
       HIS 309     0.900    27.257  37.754  41.076  -99.200  -91.000
       HIS 327     0.900    16.921  21.752  49.467  -99.200  -91.000
       HIS 330     0.900    24.742  25.785  40.804  -99.200  -91.000
       HIS 341     0.900    -2.435  32.674  41.371  -99.200  -91.000
       TYR 353     0.840     9.686  44.885  36.256  -99.200  -91.000
       TYR 356     0.840    13.530  32.609  28.989  -99.200  -91.000
       PHE 362     1.000     1.549  16.466  38.103  -99.200  -91.000
       PHE 374     1.000    14.290  33.991  39.428  -99.200  -91.000
       HIS 380     0.900    22.282  36.432  35.645  -99.200  -91.000
       HIS 390     0.900    14.821  47.607  44.507  -99.200  -91.000