=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 34 rings
        ring        int.           center             anis.    iso.
       HIS  4     0.900    45.092 -28.844  89.165  -99.200  -91.000
       HIS 16     0.900    36.605 -11.170  84.671  -99.200  -91.000
       TYR 24     0.840    50.623 -31.067  86.785  -99.200  -91.000
       HIS 42     0.900    50.241 -30.953  80.767  -99.200  -91.000
       PHE 54     1.000    32.546 -15.051  77.551  -99.200  -91.000
       PHE 57     1.000    44.448 -18.956  75.020  -99.200  -91.000
       HIS 58     0.900    40.815 -27.173  73.208  -99.200  -91.000
       PHE 72     1.000    62.576 -10.524  69.491  -99.200  -91.000
       HIS 85     0.900    32.933 -15.027  72.047  -99.200  -91.000
       PHE 88     1.000    44.472 -18.914  70.396  -99.200  -91.000
       TYR 91     0.840    50.650 -30.915  72.708  -99.200  -91.000
       HIS 95     0.900    56.609 -18.897  67.479  -99.200  -91.000
       TYR 111     0.840    38.554 -24.679  65.893  -99.200  -91.000
       PHE 112     1.000    44.445 -18.979  65.608  -99.200  -91.000
       HIS 117     0.900    54.797 -21.061  63.587  -99.200  -91.000
       HIS 120     0.900    58.977 -12.956  62.929  -99.200  -91.000
       HIS 132     0.900    46.197 -31.442  63.835  -99.200  -91.000
       HIS 139     0.900    57.022  -9.055  59.546  -99.200  -91.000
       PHE 145     1.000    33.258 -15.106  58.303  -99.200  -91.000
       PHE 147     1.000    39.220 -24.762  55.401  -99.200  -91.000
       HIS 155     0.900    58.196 -16.205  51.242  -99.200  -91.000
       PHE 157     1.000    58.052  -9.624  54.877  -99.200  -91.000
       PHE 159     1.000    49.171  -7.909  52.855  -99.200  -91.000
       TYR 163     0.840    33.558 -13.948  53.499  -99.200  -91.000
       TYR 179     0.840    35.250 -11.750  48.051  -99.200  -91.000
       PHE 202     1.000    30.159 -13.269  50.095  -99.200  -91.000
       HIS 212     0.900    31.940  -8.849  34.447  -99.200  -91.000
       TYR 214     0.840    38.856 -12.889  41.634  -99.200  -91.000
       TYR 218     0.840    43.107 -14.471  38.262  -99.200  -91.000
       HIS 219     0.900    38.996 -17.658  34.209  -99.200  -91.000
       TYR 243     0.840    38.935  -7.439  50.062  -99.200  -91.000
       PHE 247     1.000    44.465  -9.650  48.254  -99.200  -91.000
       PHE 248     1.000    44.112  -9.679  41.769  -99.200  -91.000
       HIS 258     0.900    42.940 -18.805  37.338  -99.200  -91.000