=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 21 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    17.318 -16.972 -17.981  -99.200  -91.000
       HIS 44     0.900    20.644 -19.833   7.628  -99.200  -91.000
       PHE 49     1.000    24.427 -20.443  15.949  -99.200  -91.000
       HIS 51     0.900    19.664 -30.457  13.500  -99.200  -91.000
       PHE 53     1.000    19.833 -23.890  21.474  -99.200  -91.000
       TYR 57     0.840    13.036 -25.969  25.794  -99.200  -91.000
       PHE 74     1.000    12.365 -19.857  27.994  -99.200  -91.000
       PHE 76     1.000     7.540 -21.144  18.049  -99.200  -91.000
       TRP 82     1.040    20.009 -19.974  21.445  -99.200  -91.000
      TRP6 82     1.020    22.237 -19.170  21.515  -99.200  -91.000
       HIS 89     0.900    26.514 -15.071  14.275  -99.200  -91.000
       PHE 108     1.000     7.639 -16.038   5.110  -99.200  -91.000
       HIS 112     0.900    -3.025 -29.552  10.319  -99.200  -91.000
       HIS 118     0.900    -1.988 -20.974   6.767  -99.200  -91.000
       TYR 127     0.840    12.070  -8.394   0.679  -99.200  -91.000
       TYR 136     0.840    15.946 -17.900   9.740  -99.200  -91.000
       PHE 149     1.000     4.628 -24.534  20.218  -99.200  -91.000
       HIS 160     0.900     5.458 -23.975   0.437  -99.200  -91.000
       PHE 161     1.000     9.255 -20.363   0.401  -99.200  -91.000
       TYR 179     0.840    29.001 -41.036  -0.608  -99.200  -91.000
       HIS 186     0.900    26.705 -48.923   6.641  -99.200  -91.000