=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 31 rings
        ring        int.           center             anis.    iso.
       TYR  6     0.840    56.942  40.913  21.715  -99.200  -91.000
       HIS 17     0.900    60.719  55.467  24.989  -99.200  -91.000
       TYR 21     0.840    66.938  63.325  22.234  -99.200  -91.000
       HIS 39     0.900    42.796  53.789  24.486  -99.200  -91.000
       PHE 58     1.000    40.021  63.725  14.420  -99.200  -91.000
       HIS 64     0.900    45.063  47.789  10.670  -99.200  -91.000
       HIS 67     0.900    47.138  46.510  17.961  -99.200  -91.000
       TYR 91     0.840    49.037  65.677  12.733  -99.200  -91.000
       TYR 104     0.840    45.194  50.368  -5.471  -99.200  -91.000
       TRP 106     1.040    37.993  56.156  -1.206  -99.200  -91.000
      TRP6 106     1.020    36.726  54.507  -0.064  -99.200  -91.000
       TRP 113     1.040    44.893  66.185   5.271  -99.200  -91.000
      TRP6 113     1.020    46.132  65.744   7.260  -99.200  -91.000
       TYR 167     0.840    52.874  46.695  -6.190  -99.200  -91.000
       TYR 171     0.840    54.495  51.311  -5.820  -99.200  -91.000
       PHE 189     1.000    51.831  37.148  10.378  -99.200  -91.000
       TYR 214     0.840    44.861  49.721  27.098  -99.200  -91.000
       TYR 217     0.840    43.790  43.790  16.741  -99.200  -91.000
       HIS 226     0.900    56.539  47.229  17.070  -99.200  -91.000
       HIS 238     0.900    70.776  62.379  15.490  -99.200  -91.000
       TRP 241     1.040    70.515  62.899  11.237  -99.200  -91.000
      TRP6 241     1.020    70.741  60.737  12.162  -99.200  -91.000
       PHE 261     1.000    62.630  35.219  -1.357  -99.200  -91.000
       TYR 262     0.840    62.994  32.691   2.982  -99.200  -91.000
       TYR 263     0.840    64.440  35.906   9.324  -99.200  -91.000
       HIS 276     0.900    75.870  62.433  15.570  -99.200  -91.000
       HIS 277     0.900    80.663  58.279  13.681  -99.200  -91.000
       HIS 278     0.900    73.717  55.651  11.429  -99.200  -91.000
       HIS 279     0.900    78.583  49.614  14.940  -99.200  -91.000
       HIS 280     0.900    73.659  46.042   9.407  -99.200  -91.000
       HIS 281     0.900    75.207  47.318  17.742  -99.200  -91.000