=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 42 rings
        ring        int.           center             anis.    iso.
       PHE 12     1.000    34.820   6.197  22.734  -99.200  -91.000
       TYR 17     0.840    37.865  14.953  23.478  -99.200  -91.000
       TYR 20     0.840    37.066   9.753  18.998  -99.200  -91.000
       HIS 30     0.900    42.717   4.347  12.572  -99.200  -91.000
       TRP 41     1.040    35.570   1.877   6.882  -99.200  -91.000
      TRP6 41     1.020    37.815   1.104   6.740  -99.200  -91.000
       TYR 46     0.840    41.626  21.283  10.823  -99.200  -91.000
       PHE 58     1.000    35.143   9.789   1.713  -99.200  -91.000
       TRP 62     1.040    20.747   7.152   4.337  -99.200  -91.000
      TRP6 62     1.020    21.591   5.516   5.817  -99.200  -91.000
       HIS 78     0.900    13.063  10.725  -0.373  -99.200  -91.000
       HIS 88     0.900    23.219  20.236  -0.121  -99.200  -91.000
       PHE 99     1.000    17.022  28.420   8.688  -99.200  -91.000
       TRP 138     1.040    16.509  19.420  25.394  -99.200  -91.000
      TRP6 138     1.020    17.978  17.831  26.340  -99.200  -91.000
       PHE 159     1.000     8.883  18.101  17.529  -99.200  -91.000
       TRP 162     1.040     8.391  11.634  19.312  -99.200  -91.000
      TRP6 162     1.020     7.072  13.359  18.350  -99.200  -91.000
       PHE 166     1.000    14.258  10.768  16.823  -99.200  -91.000
       PHE 168     1.000    18.545   9.844  26.825  -99.200  -91.000
       TYR 185     0.840     3.320  17.223  15.617  -99.200  -91.000
       HIS 226     0.900    13.990  14.251  10.152  -99.200  -91.000
       HIS 233     0.900    15.371  19.423  20.431  -99.200  -91.000
       TYR 245     0.840    31.861  20.078  32.546  -99.200  -91.000
       HIS 250     0.900    38.564  24.386  31.324  -99.200  -91.000
       TYR 274     0.840    37.893  22.109  26.294  -99.200  -91.000
       TYR 283     0.840    25.633   6.533   9.973  -99.200  -91.000
       PHE 285     1.000    25.853   6.364   3.593  -99.200  -91.000
       HIS 311     0.900    36.575  20.846  16.357  -99.200  -91.000
       PHE 317     1.000    41.755  23.973  15.853  -99.200  -91.000
       HIS 321     0.900    44.349  17.283  24.712  -99.200  -91.000
       PHE 323     1.000    36.776  27.045  27.378  -99.200  -91.000
       HIS 332     0.900    34.417  26.260  14.907  -99.200  -91.000
       PHE 335     1.000    28.186  26.343  13.875  -99.200  -91.000
       HIS 337     0.900    35.667  22.534   4.327  -99.200  -91.000
       HIS 340     0.900    25.889  17.670   2.369  -99.200  -91.000
       PHE 341     1.000    29.673  26.420   7.790  -99.200  -91.000
       TRP 377     1.040    30.745  13.945  29.703  -99.200  -91.000
      TRP6 377     1.020    30.435  15.925  28.447  -99.200  -91.000
       TYR 378     0.840    22.136  11.697  27.474  -99.200  -91.000
       TRP 393     1.040    21.413  31.995  41.208  -99.200  -91.000
      TRP6 393     1.020    20.447  30.145  40.111  -99.200  -91.000