=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 28 rings
        ring        int.           center             anis.    iso.
       TYR 21     0.840     9.136  -9.015  13.143  -99.200  -91.000
       HIS 27     0.900     1.771  -5.612   5.111  -99.200  -91.000
       TYR 28     0.840     7.215  -5.438  14.069  -99.200  -91.000
       TYR 40     0.840     7.015  12.233  17.127  -99.200  -91.000
       HIS 42     0.900    -2.054  13.637  23.210  -99.200  -91.000
       HIS 48     0.900     0.965  18.992  11.174  -99.200  -91.000
       PHE 79     1.000    20.963   3.141  10.004  -99.200  -91.000
       TRP 82     1.040    24.833   0.906   4.777  -99.200  -91.000
      TRP6 82     1.020    22.503   1.102   4.500  -99.200  -91.000
       HIS 84     0.900    26.208  11.958   4.568  -99.200  -91.000
       HIS 86     0.900    20.394   3.552   0.514  -99.200  -91.000
       HIS 93     0.900    20.144  14.300  -9.279  -99.200  -91.000
       HIS 96     0.900    16.890  14.559   1.689  -99.200  -91.000
       TYR 97     0.840    17.480   8.292   3.420  -99.200  -91.000
       PHE 103     1.000    12.679  -0.049  12.951  -99.200  -91.000
       HIS 111     0.900    30.019   4.660  25.881  -99.200  -91.000
       HIS 112     0.900    26.529   5.031  31.603  -99.200  -91.000
       HIS 141     0.900     8.413  -2.368  26.255  -99.200  -91.000
       PHE 144     1.000     4.155   2.862  23.027  -99.200  -91.000
       HIS 148     0.900    13.267   7.974  24.563  -99.200  -91.000
       HIS 152     0.900    16.856  11.121  23.075  -99.200  -91.000
       HIS 158     0.900    16.899  10.360  28.090  -99.200  -91.000
       PHE 163     1.000    17.186  20.875  28.490  -99.200  -91.000
       PHE 168     1.000    10.704  23.214  30.350  -99.200  -91.000
       TRP 190     1.040     4.382  13.696  22.310  -99.200  -91.000
      TRP6 190     1.020     6.445  12.613  21.835  -99.200  -91.000
       PHE 201     1.000    15.332  20.574  16.640  -99.200  -91.000
       HIS 206     0.900    18.798  24.141  15.670  -99.200  -91.000