=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 40 rings
        ring        int.           center             anis.    iso.
       TYR  9     0.840     6.606  -1.395   0.806  -99.200  -91.000
       HIS 11     0.900     1.849  -2.169   5.385  -99.200  -91.000
       PHE 17     1.000    -4.031   3.551   0.034  -99.200  -91.000
       TYR 42     0.840     8.173  -3.650   8.476  -99.200  -91.000
       PHE 46     1.000    18.177  -1.122   7.241  -99.200  -91.000
       PHE 65     1.000    29.554   2.118  19.649  -99.200  -91.000
       TYR 67     0.840    25.540   4.258  15.379  -99.200  -91.000
       HIS 72     0.900    33.040  12.182  10.663  -99.200  -91.000
       TYR 75     0.840    31.012   7.894   4.047  -99.200  -91.000
       PHE 99     1.000    13.057   8.500   2.749  -99.200  -91.000
       PHE 101     1.000     6.649   7.520   6.274  -99.200  -91.000
       TYR 104     0.840     3.735   1.569  12.297  -99.200  -91.000
       TRP 105     1.040     3.080   5.224  18.682  -99.200  -91.000
      TRP6 105     1.020     1.077   5.919  19.756  -99.200  -91.000
       PHE 106     1.000     0.796  13.326  15.900  -99.200  -91.000
       TRP 115     1.040    17.263   3.093   4.714  -99.200  -91.000
      TRP6 115     1.020    17.466   5.330   3.920  -99.200  -91.000
       PHE 124     1.000    25.527   8.468   2.020  -99.200  -91.000
       PHE 126     1.000    25.274  14.386   9.807  -99.200  -91.000
       PHE 131     1.000    24.819  22.957   9.298  -99.200  -91.000
       TYR 132     0.840    19.041  22.520   8.882  -99.200  -91.000
       TYR 155     0.840    -3.139  13.694  11.246  -99.200  -91.000
       TYR 166     0.840     1.143  22.496  13.940  -99.200  -91.000
       PHE 167     1.000     2.279  14.154  10.295  -99.200  -91.000
       TRP 169     1.040    10.611  21.104  12.989  -99.200  -91.000
      TRP6 169     1.020    11.241  22.928  11.621  -99.200  -91.000
       HIS 173     0.900    14.291  22.659   9.288  -99.200  -91.000
       HIS 177     0.900    16.269  22.662   4.275  -99.200  -91.000
       PHE 178     1.000    21.551  18.365  10.088  -99.200  -91.000
       PHE 181     1.000    17.712  13.364   0.542  -99.200  -91.000
       PHE 190     1.000    -4.696  13.653   5.519  -99.200  -91.000
       TRP 207     1.040     2.130   7.371  -5.165  -99.200  -91.000
      TRP6 207     1.020     3.588   9.189  -4.775  -99.200  -91.000
       TRP 215     1.040    11.071  12.749 -13.034  -99.200  -91.000
      TRP6 215     1.020    12.729  12.260 -11.402  -99.200  -91.000
       HIS 225     0.900     5.430  31.377   7.003  -99.200  -91.000
       TRP 226     1.040     5.858  24.414   3.331  -99.200  -91.000
      TRP6 226     1.020     5.330  22.264   4.179  -99.200  -91.000
       HIS 227     0.900     8.045  21.919   7.929  -99.200  -91.000
       PHE 228     1.000     6.671  24.114  13.301  -99.200  -91.000