=============================================================================
          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    44.682  39.837  40.292  -99.200  -91.000
       PHE  2     1.000    40.820  39.979  37.213  -99.200  -91.000
       TYR  9     0.840    29.503  44.583  33.617  -99.200  -91.000
       TYR 16     0.840    17.757  29.450  34.143  -99.200  -91.000
       HIS 22     0.900    13.929  28.532  41.544  -99.200  -91.000
       PHE 23     1.000    14.066  33.489  34.562  -99.200  -91.000
       HIS 42     0.900     8.896  43.480  41.714  -99.200  -91.000
       TYR 56     0.840    28.170  49.215  43.142  -99.200  -91.000
       TYR 65     0.840    22.746  50.262  43.897  -99.200  -91.000
       TYR 75     0.840    21.207  44.119  52.717  -99.200  -91.000
       PHE 86     1.000    27.066  40.550  45.698  -99.200  -91.000
       HIS 94     0.900    27.760  27.495  30.129  -99.200  -91.000
       TYR 95     0.840    26.838  26.959  34.446  -99.200  -91.000
       TYR 98     0.840    27.316  37.608  39.437  -99.200  -91.000
       HIS 103     0.900    31.050  39.329  54.769  -99.200  -91.000
       TRP 108     1.040    30.504  33.756  53.829  -99.200  -91.000
      TRP6 108     1.020    29.656  35.343  55.351  -99.200  -91.000
       PHE 109     1.000    31.322  31.128  45.633  -99.200  -91.000
       HIS 125     0.900    29.980  25.161  51.368  -99.200  -91.000
       TYR 126     0.840    35.259  28.693  44.178  -99.200  -91.000
       PHE 133     1.000    22.925  32.982  40.383  -99.200  -91.000