=============================================================================
          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     1.146  24.540  57.880  -99.200  -91.000
       PHE  2     1.000    -0.457  27.840  70.706  -99.200  -91.000
       TYR  9     0.840     9.258  32.488  77.452  -99.200  -91.000
       TYR 16     0.840    20.417  17.544  80.683  -99.200  -91.000
       HIS 22     0.900    27.015  16.999  75.070  -99.200  -91.000
       PHE 23     1.000    24.061  21.811  81.267  -99.200  -91.000
       HIS 42     0.900    31.108  31.848  75.499  -99.200  -91.000
       TYR 56     0.840    12.882  37.118  68.616  -99.200  -91.000
       TYR 65     0.840    18.520  38.228  69.701  -99.200  -91.000
       TYR 75     0.840    22.566  31.932  61.202  -99.200  -91.000
       PHE 86     1.000    14.914  28.589  66.547  -99.200  -91.000
       HIS 94     0.900     9.716  15.911  81.969  -99.200  -91.000
       TYR 95     0.840    12.186  14.926  78.062  -99.200  -91.000
       TYR 98     0.840    13.084  25.530  72.689  -99.200  -91.000
       HIS 103     0.900    13.491  27.278  56.729  -99.200  -91.000
       TRP 108     1.040    14.278  21.320  58.114  -99.200  -91.000
      TRP6 108     1.020    15.140  22.968  56.648  -99.200  -91.000
       PHE 109     1.000    11.225  18.788  65.604  -99.200  -91.000
       HIS 125     0.900    13.369  11.498  63.029  -99.200  -91.000
       TYR 126     0.840     6.888  16.479  66.073  -99.200  -91.000
       PHE 133     1.000    17.490  21.212  73.155  -99.200  -91.000