=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 47 rings
        ring        int.           center             anis.    iso.
       HIS  6     0.900    12.374   5.982  34.302  -99.200  -91.000
       HIS 18     0.900    27.438   2.571  39.482  -99.200  -91.000
       HIS 20     0.900    31.903   3.558  35.989  -99.200  -91.000
       PHE 33     1.000    22.477   6.076  40.720  -99.200  -91.000
       PHE 56     1.000    23.809  10.753  52.361  -99.200  -91.000
       HIS 68     0.900    27.964   7.293  30.869  -99.200  -91.000
       TYR 72     0.840    16.762  14.361  32.636  -99.200  -91.000
       HIS 87     0.900    19.931  11.980  58.928  -99.200  -91.000
       PHE 91     1.000    22.567  13.703  44.750  -99.200  -91.000
       HIS 92     0.900    28.788  20.465  46.728  -99.200  -91.000
       PHE 116     1.000    20.883  15.355  40.518  -99.200  -91.000
       PHE 124     1.000    29.490  18.080  39.300  -99.200  -91.000
       TYR 126     0.840    26.319  11.304  47.774  -99.200  -91.000
       HIS 127     0.900    26.783  18.970  51.680  -99.200  -91.000
       TRP 136     1.040    26.661  16.669  64.855  -99.200  -91.000
      TRP6 136     1.020    24.483  16.019  65.546  -99.200  -91.000
       HIS 137     0.900    22.530  15.837  60.335  -99.200  -91.000
       HIS 163     0.900    42.301   3.619  29.036  -99.200  -91.000
       TYR 164     0.840    37.643   5.443  34.904  -99.200  -91.000
       TYR 168     0.840    40.946   0.682  43.777  -99.200  -91.000
       PHE 173     1.000    34.052  11.011  55.254  -99.200  -91.000
       TYR 176     0.840    36.470  19.087  63.068  -99.200  -91.000
       TYR 185     0.840    40.416  11.608  71.078  -99.200  -91.000
       TYR 188     0.840    29.906  12.490  73.482  -99.200  -91.000
       TYR 195     0.840    24.519  20.197  67.990  -99.200  -91.000
       HIS 209     0.900    40.687  10.604  65.962  -99.200  -91.000
       PHE 212     1.000    43.155   9.103  52.604  -99.200  -91.000
       HIS 237     0.900    41.457  12.340  48.565  -99.200  -91.000
       HIS 247     0.900    53.221  12.564  46.894  -99.200  -91.000
       HIS 252     0.900    55.470  11.346  39.231  -99.200  -91.000
       TRP 255     1.040    46.753  12.406  31.198  -99.200  -91.000
      TRP6 255     1.020    47.410  14.426  30.149  -99.200  -91.000
       TRP 257     1.040    39.852  16.555  34.293  -99.200  -91.000
      TRP6 257     1.020    40.508  14.329  33.768  -99.200  -91.000
       PHE 262     1.000    35.584  13.777  35.100  -99.200  -91.000
       TRP 273     1.040    45.512  14.952  43.119  -99.200  -91.000
      TRP6 273     1.020    47.281  13.413  42.775  -99.200  -91.000
       PHE 274     1.000    44.044  23.083  48.154  -99.200  -91.000
       TYR 285     0.840    51.225   6.523  38.579  -99.200  -91.000
       PHE 287     1.000    49.573   2.175  40.472  -99.200  -91.000
       TYR 293     0.840    53.338   2.571  43.601  -99.200  -91.000
       TYR 295     0.840    45.171   8.834  47.047  -99.200  -91.000
       HIS 298     0.900    53.839  15.202  50.901  -99.200  -91.000
       PHE 304     1.000    53.338   8.979  56.987  -99.200  -91.000
       HIS 311     0.900    49.843   1.154  53.595  -99.200  -91.000
       TRP 318     1.040    62.907  -2.224  39.903  -99.200  -91.000
      TRP6 318     1.020    61.786  -0.761  41.393  -99.200  -91.000