=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 39 rings
        ring        int.           center             anis.    iso.
       TRP 12     1.040    13.362   3.543  10.399  -99.200  -91.000
      TRP6 12     1.020    12.031   1.930   9.358  -99.200  -91.000
       TRP 14     1.040     7.304   4.567  13.010  -99.200  -91.000
      TRP6 14     1.020     6.661   4.750  10.738  -99.200  -91.000
       TYR 20     0.840    12.384  10.837  35.840  -99.200  -91.000
       HIS 24     0.900    16.592   6.930  24.699  -99.200  -91.000
       TRP 35     1.040    -3.673  10.068  22.833  -99.200  -91.000
      TRP6 35     1.020    -3.738   9.468  25.097  -99.200  -91.000
       HIS 41     0.900    10.742  -2.257  30.456  -99.200  -91.000
       PHE 43     1.000     6.374   5.868  31.586  -99.200  -91.000
       TRP 53     1.040     8.868  10.459  32.847  -99.200  -91.000
      TRP6 53     1.020    10.135   8.829  31.733  -99.200  -91.000
       PHE 56     1.000    15.475  14.581  20.177  -99.200  -91.000
       HIS 66     0.900    18.433  21.991  13.276  -99.200  -91.000
       TYR 77     0.840     0.520   1.492  35.876  -99.200  -91.000
       HIS 78     0.900    -3.126  -4.090  30.672  -99.200  -91.000
       TYR 81     0.840     5.046  -4.472  33.782  -99.200  -91.000
       PHE 84     1.000     5.387  -0.433  36.733  -99.200  -91.000
       HIS 93     0.900    -3.323  13.295  26.204  -99.200  -91.000
       TYR 103     0.840    12.642  15.768   8.305  -99.200  -91.000
       TRP 127     1.040    18.274   7.810  19.280  -99.200  -91.000
      TRP6 127     1.020    15.990   8.329  19.197  -99.200  -91.000
       TYR 132     0.840    23.798  -6.168  29.308  -99.200  -91.000
       TYR 133     0.840    28.604  -6.479  30.299  -99.200  -91.000
       PHE 158     1.000    15.408 -20.360  20.764  -99.200  -91.000
       TYR 159     0.840    14.109 -15.492  26.266  -99.200  -91.000
       PHE 168     1.000     6.091  -9.956  18.478  -99.200  -91.000
       TYR 172     0.840    18.381 -12.554  12.174  -99.200  -91.000
       PHE 187     1.000     9.044  -6.930  15.345  -99.200  -91.000
       TRP 199     1.040     6.864   1.072   7.013  -99.200  -91.000
      TRP6 199     1.020     8.275  -0.759   7.325  -99.200  -91.000
       TRP 207     1.040    10.348  -9.890  28.570  -99.200  -91.000
      TRP6 207     1.020    11.251 -12.061  28.903  -99.200  -91.000
       TYR 220     0.840    10.626  -7.241  19.956  -99.200  -91.000
       PHE 226     1.000    -1.649  -5.845  25.467  -99.200  -91.000
       TRP 229     1.040    -5.268  -1.144  28.394  -99.200  -91.000
      TRP6 229     1.020    -3.465   0.272  27.932  -99.200  -91.000
       PHE 231     1.000    -8.707   1.121  18.553  -99.200  -91.000
       HIS 237     0.900    -7.982   6.833  31.745  -99.200  -91.000