=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 45 rings
        ring        int.           center             anis.    iso.
       TYR  9     0.840    15.051  22.635   6.951  -99.200  -91.000
       TYR 13     0.840     8.071  34.182   5.386  -99.200  -91.000
       TYR 21     0.840     9.463  24.681   9.249  -99.200  -91.000
       TYR 22     0.840     7.400  18.588  13.552  -99.200  -91.000
       HIS 24     0.900     7.558  21.027   2.257  -99.200  -91.000
       TYR 43     0.840     9.688  27.549  15.726  -99.200  -91.000
       HIS 61     0.900    15.630  45.257   0.772  -99.200  -91.000
       HIS 66     0.900    27.324  45.663  -0.214  -99.200  -91.000
       PHE 76     1.000    23.774  40.717  -9.343  -99.200  -91.000
       TYR 79     0.840    12.961  36.702  -8.848  -99.200  -91.000
       HIS 84     0.900    11.433  20.906   4.359  -99.200  -91.000
       PHE 88     1.000     6.538  25.063  -0.861  -99.200  -91.000
       HIS 97     0.900     9.879  30.373 -17.745  -99.200  -91.000
       HIS 112     0.900    30.388  25.057   6.929  -99.200  -91.000
       PHE 113     1.000    28.251  20.201  -2.322  -99.200  -91.000
       PHE 116     1.000    20.297  13.777   2.962  -99.200  -91.000
       TYR 121     0.840    18.397  23.592   0.164  -99.200  -91.000
       TRP 143     1.040    28.344  30.744   0.963  -99.200  -91.000
      TRP6 143     1.020    28.097  31.780   3.074  -99.200  -91.000
       TYR 144     0.840    34.866  25.826   3.415  -99.200  -91.000
       PHE 149     1.000    31.091  32.527   6.880  -99.200  -91.000
       TYR 152     0.840    30.142  37.951  11.440  -99.200  -91.000
       TRP 153     1.040    31.263  32.978  11.834  -99.200  -91.000
      TRP6 153     1.020    30.068  33.168  13.868  -99.200  -91.000
       TYR 161     0.840    38.675  32.487  22.968  -99.200  -91.000
       HIS 179     0.900    20.586  20.661  11.386  -99.200  -91.000
       PHE 188     1.000    23.902   9.984  -1.776  -99.200  -91.000
       TYR 192     0.840    27.370  19.689   6.497  -99.200  -91.000
       HIS 197     0.900    36.692  18.050  11.409  -99.200  -91.000
       TYR 212     0.840    40.630  24.288  16.171  -99.200  -91.000
       TRP 216     1.040    29.236  16.939  13.097  -99.200  -91.000
      TRP6 216     1.020    29.171  18.040  11.008  -99.200  -91.000
       TRP 226     1.040    20.163  12.320  11.725  -99.200  -91.000
      TRP6 226     1.020    19.454  14.364  10.763  -99.200  -91.000
       PHE 239     1.000    33.870  20.737  33.701  -99.200  -91.000
       TYR 244     0.840    39.106  22.800  27.722  -99.200  -91.000
       PHE 247     1.000    33.342  23.879  27.449  -99.200  -91.000
       TYR 249     0.840    29.029  26.033  23.157  -99.200  -91.000
       PHE 254     1.000    22.963  25.892  12.556  -99.200  -91.000
       HIS 258     0.900    16.622  31.535  10.924  -99.200  -91.000
       TYR 263     0.840    15.119  24.691  22.933  -99.200  -91.000
       TYR 267     0.840    16.912  25.132  27.596  -99.200  -91.000
       TYR 280     0.840    26.019  29.653  25.575  -99.200  -91.000
       TYR 281     0.840    32.123  33.931  27.672  -99.200  -91.000
       PHE 292     1.000    26.181  36.427   6.141  -99.200  -91.000