=============================================================================
          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    45.870  67.152  32.135  -99.200  -91.000
       TYR 15     0.840    25.006  66.958  50.990  -99.200  -91.000
       HIS 18     0.900    14.833  69.818  44.978  -99.200  -91.000
       TYR 29     0.840    19.924  64.134  44.177  -99.200  -91.000
       TYR 45     0.840    52.282  63.905  29.152  -99.200  -91.000
       TYR 64     0.840    34.348  71.039  44.417  -99.200  -91.000
       PHE 78     1.000    27.347  66.567  37.503  -99.200  -91.000
       HIS 85     0.900    33.102  73.801  31.160  -99.200  -91.000
       PHE 86     1.000    36.459  69.866  32.192  -99.200  -91.000
       TYR 90     0.840    39.597  74.859  29.145  -99.200  -91.000
       HIS 92     0.900    44.493  72.982  25.044  -99.200  -91.000
       HIS 94     0.900    41.117  68.496  19.887  -99.200  -91.000
       HIS 97     0.900    38.206  59.696  27.776  -99.200  -91.000
       HIS 103     0.900    29.761  57.124  47.129  -99.200  -91.000
       TRP 105     1.040    24.043  59.995  51.546  -99.200  -91.000
      TRP6 105     1.020    24.502  59.152  53.690  -99.200  -91.000
       HIS 115     0.900    12.712  63.206  59.422  -99.200  -91.000
       HIS 117     0.900    14.934  67.333  58.569  -99.200  -91.000
       PHE 119     1.000    17.923  62.245  53.070  -99.200  -91.000
       PHE 158     1.000    29.759  23.784  37.264  -99.200  -91.000
       TRP 159     1.040    23.582  18.592  36.820  -99.200  -91.000
      TRP6 159     1.020    22.948  17.812  34.703  -99.200  -91.000
       PHE 161     1.000    32.161  19.593  37.013  -99.200  -91.000
       TYR 166     0.840    46.110  18.777  34.338  -99.200  -91.000
       TRP 173     1.040    22.071  16.700  39.905  -99.200  -91.000
      TRP6 173     1.020    24.042  15.386  40.063  -99.200  -91.000
       TRP 185     1.040    22.130  50.118  31.727  -99.200  -91.000
      TRP6 185     1.020    22.420  49.377  33.943  -99.200  -91.000
       TRP 187     1.040    22.522  54.064  28.194  -99.200  -91.000
      TRP6 187     1.020    20.160  53.933  28.129  -99.200  -91.000
       PHE 190     1.000    22.318  58.565  24.105  -99.200  -91.000
       HIS 199     0.900    16.414  59.051  23.668  -99.200  -91.000
       PHE 203     1.000    20.066  58.557  29.972  -99.200  -91.000
       TRP 207     1.040    20.064  51.736  38.915  -99.200  -91.000
      TRP6 207     1.020    18.445  52.055  40.601  -99.200  -91.000
       PHE 218     1.000    21.175  34.991  43.127  -99.200  -91.000
       TYR 231     0.840    22.383  34.307  26.469  -99.200  -91.000
       TYR 249     0.840    24.242  40.781  34.346  -99.200  -91.000
       HIS 255     0.900    34.018  28.811  44.649  -99.200  -91.000
       TYR 256     0.840    28.858  31.260  51.525  -99.200  -91.000
       PHE 257     1.000    35.608  25.082  49.297  -99.200  -91.000
       TRP 263     1.040    36.321  15.575  62.030  -99.200  -91.000
      TRP6 263     1.020    36.858  16.429  64.172  -99.200  -91.000
       HIS 264     0.900    32.729  15.784  67.935  -99.200  -91.000
       PHE 277     1.000    26.649  24.335  53.397  -99.200  -91.000