=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 40 rings
        ring        int.           center             anis.    iso.
       PHE  4     1.000    13.924  17.573  21.378  -99.200  -91.000
       HIS 20     0.900    31.353   6.332  -7.311  -99.200  -91.000
       PHE 28     1.000    31.482  -5.789  -3.828  -99.200  -91.000
       HIS 45     0.900    29.727  15.982   8.642  -99.200  -91.000
       TRP 49     1.040    22.585  15.063  15.118  -99.200  -91.000
      TRP6 49     1.020    21.931  12.896  15.801  -99.200  -91.000
       PHE 56     1.000    25.554  11.370  23.143  -99.200  -91.000
       HIS 60     0.900    31.896   6.585  31.760  -99.200  -91.000
       TYR 70     0.840    27.097  -0.806  21.230  -99.200  -91.000
       TRP 72     1.040    27.425   5.916  11.777  -99.200  -91.000
      TRP6 72     1.020    28.041   4.640   9.882  -99.200  -91.000
       PHE 78     1.000    14.050   7.819  10.530  -99.200  -91.000
       TRP 82     1.040    14.220  13.846   5.617  -99.200  -91.000
      TRP6 82     1.020    11.868  13.963   5.844  -99.200  -91.000
       PHE 85     1.000     9.243  12.219   1.445  -99.200  -91.000
       TYR 94     0.840    20.681  12.954  -2.890  -99.200  -91.000
       PHE 95     1.000    23.353   4.362  -0.604  -99.200  -91.000
       PHE 101     1.000    24.564   2.428  -4.594  -99.200  -91.000
       TYR 104     0.840    24.834  -1.470 -14.142  -99.200  -91.000
       HIS 107     0.900    22.850  -7.315 -10.436  -99.200  -91.000
       TYR 112     0.840    17.641  -5.187  -6.562  -99.200  -91.000
       HIS 120     0.900     8.238  -0.999   2.170  -99.200  -91.000
       PHE 125     1.000    11.578   8.783   6.261  -99.200  -91.000
       TRP 127     1.040     3.617   4.824   0.320  -99.200  -91.000
      TRP6 127     1.020     4.911   2.849   0.479  -99.200  -91.000
       PHE 135     1.000    15.039  12.919   9.023  -99.200  -91.000
       PHE 144     1.000    19.510   9.361  23.225  -99.200  -91.000
       PHE 157     1.000    21.707  11.443  31.399  -99.200  -91.000
       PHE 158     1.000    20.121   4.466  26.278  -99.200  -91.000
       TYR 165     0.840    16.620  13.156  22.993  -99.200  -91.000
       PHE 182     1.000     4.190   7.197  20.861  -99.200  -91.000
       TYR 183     0.840     0.032   0.752  15.683  -99.200  -91.000
       HIS 200     0.900    24.365  -3.194  12.707  -99.200  -91.000
       PHE 202     1.000    26.870  -6.050   1.671  -99.200  -91.000
       PHE 204     1.000    31.460 -10.576  11.211  -99.200  -91.000
       HIS 211     0.900    42.616  -8.008   3.749  -99.200  -91.000
       PHE 217     1.000    35.160  -2.798   4.898  -99.200  -91.000
       TYR 241     0.840    12.900  -4.487  17.424  -99.200  -91.000
       PHE 242     1.000     9.009   3.447  20.759  -99.200  -91.000
       HIS 243     0.900     4.230  -0.854  18.365  -99.200  -91.000