=============================================================================
          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    -3.080  27.743  67.155  -99.200  -91.000
       PHE  2     1.000    -0.728  27.893  70.732  -99.200  -91.000
       TYR  9     0.840     8.887  32.822  77.288  -99.200  -91.000
       TYR 16     0.840    20.554  18.210  80.568  -99.200  -91.000
       HIS 22     0.900    26.692  17.548  74.737  -99.200  -91.000
       PHE 23     1.000    24.015  22.396  80.999  -99.200  -91.000
       HIS 42     0.900    30.672  32.447  75.354  -99.200  -91.000
       TYR 56     0.840    12.477  37.476  68.384  -99.200  -91.000
       TYR 65     0.840    18.093  38.605  69.491  -99.200  -91.000
       TYR 75     0.840    22.290  32.264  61.339  -99.200  -91.000
       PHE 86     1.000    14.605  28.944  66.461  -99.200  -91.000
       HIS 94     0.900     9.913  15.787  81.496  -99.200  -91.000
       TYR 95     0.840    12.137  15.379  77.761  -99.200  -91.000
       TYR 98     0.840    12.866  25.863  72.544  -99.200  -91.000
       HIS 103     0.900    13.292  27.535  56.659  -99.200  -91.000
       TRP 108     1.040    14.076  21.615  58.080  -99.200  -91.000
      TRP6 108     1.020    14.997  23.267  56.661  -99.200  -91.000
       PHE 109     1.000    11.097  19.056  65.648  -99.200  -91.000
       HIS 125     0.900    13.569  11.456  62.911  -99.200  -91.000
       TYR 126     0.840     6.966  16.506  66.008  -99.200  -91.000
       PHE 133     1.000    17.436  21.494  72.991  -99.200  -91.000