=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 45 rings
        ring        int.           center             anis.    iso.
       TYR  7     0.840    45.164  67.247  32.119  -99.200  -91.000
       TYR 15     0.840    24.614  66.936  50.896  -99.200  -91.000
       HIS 18     0.900    14.367  69.872  45.068  -99.200  -91.000
       TYR 29     0.840    19.343  64.220  44.133  -99.200  -91.000
       TYR 45     0.840    51.525  63.967  29.166  -99.200  -91.000
       TYR 64     0.840    33.701  71.065  44.412  -99.200  -91.000
       PHE 78     1.000    26.866  66.700  37.465  -99.200  -91.000
       HIS 85     0.900    32.653  73.662  31.245  -99.200  -91.000
       PHE 86     1.000    35.764  69.815  32.222  -99.200  -91.000
       TYR 90     0.840    38.945  74.927  29.176  -99.200  -91.000
       HIS 92     0.900    43.724  73.198  25.038  -99.200  -91.000
       HIS 94     0.900    40.530  68.559  19.928  -99.200  -91.000
       HIS 97     0.900    37.564  59.632  27.671  -99.200  -91.000
       HIS 103     0.900    29.256  57.139  47.037  -99.200  -91.000
       TRP 105     1.040    23.601  60.108  51.481  -99.200  -91.000
      TRP6 105     1.020    24.084  59.332  53.669  -99.200  -91.000
       HIS 115     0.900    12.375  63.219  59.320  -99.200  -91.000
       HIS 117     0.900    14.429  67.474  58.294  -99.200  -91.000
       PHE 119     1.000    17.492  62.331  52.958  -99.200  -91.000
       PHE 158     1.000    29.182  23.918  37.146  -99.200  -91.000
       TRP 159     1.040    23.106  18.613  36.782  -99.200  -91.000
      TRP6 159     1.020    22.621  17.799  34.606  -99.200  -91.000
       PHE 161     1.000    31.595  19.611  36.968  -99.200  -91.000
       TYR 166     0.840    45.370  18.857  34.334  -99.200  -91.000
       TRP 173     1.040    21.674  16.690  39.843  -99.200  -91.000
      TRP6 173     1.020    23.681  15.423  39.938  -99.200  -91.000
       TRP 185     1.040    21.799  50.212  31.728  -99.200  -91.000
      TRP6 185     1.020    22.022  49.374  33.941  -99.200  -91.000
       TRP 187     1.040    22.076  54.132  28.218  -99.200  -91.000
      TRP6 187     1.020    19.719  54.019  28.074  -99.200  -91.000
       PHE 190     1.000    21.872  58.609  24.037  -99.200  -91.000
       HIS 199     0.900    16.189  59.073  23.501  -99.200  -91.000
       PHE 203     1.000    19.589  58.631  29.995  -99.200  -91.000
       TRP 207     1.040    19.607  51.835  38.839  -99.200  -91.000
      TRP6 207     1.020    18.014  52.141  40.576  -99.200  -91.000
       PHE 218     1.000    20.748  34.992  43.136  -99.200  -91.000
       TYR 231     0.840    21.680  34.366  26.451  -99.200  -91.000
       TYR 249     0.840    23.769  40.804  34.273  -99.200  -91.000
       HIS 255     0.900    33.346  28.893  44.531  -99.200  -91.000
       TYR 256     0.840    28.322  31.291  51.510  -99.200  -91.000
       PHE 257     1.000    35.020  25.195  49.363  -99.200  -91.000
       TRP 263     1.040    35.738  15.544  61.786  -99.200  -91.000
      TRP6 263     1.020    36.147  16.493  63.914  -99.200  -91.000
       HIS 264     0.900    32.181  15.846  67.768  -99.200  -91.000
       PHE 277     1.000    26.158  24.412  53.407  -99.200  -91.000