=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 29 rings
        ring        int.           center             anis.    iso.
       HIS 30     0.900    77.815  62.470  54.418  -99.200  -91.000
       HIS 38     0.900    78.011  67.551  47.726  -99.200  -91.000
       TYR 46     0.840    71.805  57.323  40.031  -99.200  -91.000
       PHE 51     1.000    67.540  52.546  40.429  -99.200  -91.000
       PHE 56     1.000    72.690  57.008  57.572  -99.200  -91.000
       HIS 61     0.900    80.882  64.248  58.259  -99.200  -91.000
       TYR 76     0.840    91.819  64.315  58.350  -99.200  -91.000
       TYR 81     0.840    89.823  55.682  57.615  -99.200  -91.000
       PHE 87     1.000    77.648  57.686  56.451  -99.200  -91.000
       PHE 102     1.000    60.231  52.583  51.646  -99.200  -91.000
       PHE 107     1.000    70.369  47.702  42.888  -99.200  -91.000
       PHE 116     1.000    87.507  52.134  54.613  -99.200  -91.000
       HIS 119     0.900    85.270  48.428  48.791  -99.200  -91.000
       PHE 126     1.000    73.438  45.599  53.594  -99.200  -91.000
       PHE 134     1.000    78.904  57.133  42.085  -99.200  -91.000
       PHE 139     1.000    93.636  47.675  50.246  -99.200  -91.000
       TYR 157     0.840    94.948  52.870  58.584  -99.200  -91.000
       TYR 168     0.840    84.167  43.071  49.658  -99.200  -91.000
       HIS 175     0.900    85.992  51.155  44.021  -99.200  -91.000
       HIS 177     0.900    89.191  56.765  41.930  -99.200  -91.000
       HIS 182     0.900    96.449  64.609  41.725  -99.200  -91.000
       HIS 198     0.900    89.008  36.830  47.796  -99.200  -91.000
       TYR 199     0.840    83.379  40.614  43.679  -99.200  -91.000
       PHE 207     1.000    82.913  56.009  33.484  -99.200  -91.000
       HIS 214     0.900    87.915  62.591  46.290  -99.200  -91.000
       PHE 226     1.000    77.818  47.596  38.308  -99.200  -91.000
       HIS 229     0.900    73.625  43.882  33.147  -99.200  -91.000
       TRP 230     1.040    75.092  44.064  38.106  -99.200  -91.000
      TRP6 230     1.020    75.313  41.762  37.559  -99.200  -91.000