=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 43 rings
        ring        int.           center             anis.    iso.
       TYR  8     0.840    -3.995  21.845  36.417  -99.200  -91.000
       PHE 14     1.000     6.362  10.287  35.095  -99.200  -91.000
       PHE 17     1.000     9.352   9.877  30.138  -99.200  -91.000
       HIS 20     0.900     8.861   9.010  25.046  -99.200  -91.000
       TYR 27     0.840    19.213   6.378  34.338  -99.200  -91.000
       TYR 32     0.840     7.229  16.040  35.770  -99.200  -91.000
       TYR 44     0.840    16.203  25.147  30.323  -99.200  -91.000
       PHE 59     1.000    15.328  13.652  18.976  -99.200  -91.000
       HIS 60     0.900    21.168   6.606  23.799  -99.200  -91.000
       TYR 71     0.840    24.704  19.890  32.194  -99.200  -91.000
       PHE 74     1.000    15.730  21.323  36.602  -99.200  -91.000
       PHE 78     1.000    20.104  17.686  32.704  -99.200  -91.000
       TYR 85     0.840    26.347   9.786  25.295  -99.200  -91.000
       HIS 86     0.900    29.555  11.643  28.447  -99.200  -91.000
       PHE 89     1.000    32.835  12.433  34.850  -99.200  -91.000
       HIS 95     0.900    36.982  16.369  31.314  -99.200  -91.000
       TYR 113     0.840    47.097   2.198   3.895  -99.200  -91.000
       HIS 132     0.900    16.151  30.218  29.971  -99.200  -91.000
       TYR 159     0.840    30.454  36.861  12.181  -99.200  -91.000
       TYR 160     0.840    32.074  34.969   4.848  -99.200  -91.000
       HIS 175     0.900    30.861  19.919   1.732  -99.200  -91.000
       PHE 176     1.000    34.640  26.564   4.965  -99.200  -91.000
       PHE 178     1.000    25.075  27.778  11.828  -99.200  -91.000
       HIS 185     0.900    19.218  17.948  19.314  -99.200  -91.000
       PHE 186     1.000    19.753  22.904  16.270  -99.200  -91.000
       PHE 194     1.000    18.936  30.289  10.998  -99.200  -91.000
       TRP 201     1.040    36.430  34.362  11.705  -99.200  -91.000
      TRP6 201     1.020    38.205  32.829  11.915  -99.200  -91.000
       HIS 202     0.900    36.205  30.964   5.351  -99.200  -91.000
       PHE 208     1.000    40.641  28.104  14.456  -99.200  -91.000
       TRP 211     1.040    29.480  25.938  11.751  -99.200  -91.000
      TRP6 211     1.020    28.415  23.818  11.998  -99.200  -91.000
       HIS 217     0.900    26.573  30.648  24.603  -99.200  -91.000
       PHE 230     1.000    44.917  19.293  20.648  -99.200  -91.000
       PHE 233     1.000    40.342  22.207  18.797  -99.200  -91.000
       HIS 243     0.900    39.328  40.397  21.128  -99.200  -91.000
       PHE 252     1.000    36.311  29.721  25.321  -99.200  -91.000
       HIS 256     0.900    30.750  16.095  38.120  -99.200  -91.000
       PHE 259     1.000    36.680  23.632  28.111  -99.200  -91.000
       HIS 276     0.900    36.160  11.465   6.294  -99.200  -91.000
       HIS 281     0.900    42.111  -6.077   2.111  -99.200  -91.000
       PHE 287     1.000    36.916  -1.269  11.176  -99.200  -91.000
       TYR 308     0.840    34.398   1.693   7.287  -99.200  -91.000