=============================================================================
          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    43.112  39.252  42.619  -99.200  -91.000
       PHE  2     1.000    40.800  39.409  37.358  -99.200  -91.000
       TYR  9     0.840    29.388  44.012  33.697  -99.200  -91.000
       TYR 16     0.840    18.100  28.550  34.566  -99.200  -91.000
       HIS 22     0.900    13.756  27.845  42.106  -99.200  -91.000
       PHE 23     1.000    14.286  32.723  35.159  -99.200  -91.000
       HIS 42     0.900     9.264  42.780  42.233  -99.200  -91.000
       TYR 56     0.840    28.195  48.701  43.272  -99.200  -91.000
       TYR 65     0.840    22.884  49.666  44.181  -99.200  -91.000
       TYR 75     0.840    21.559  43.768  52.951  -99.200  -91.000
       PHE 86     1.000    27.337  40.160  45.894  -99.200  -91.000
       HIS 94     0.900    27.902  27.053  29.982  -99.200  -91.000
       TYR 95     0.840    26.989  26.345  34.648  -99.200  -91.000
       TYR 98     0.840    27.370  37.053  39.611  -99.200  -91.000
       HIS 103     0.900    31.387  38.967  54.933  -99.200  -91.000
       TRP 108     1.040    30.808  33.373  53.917  -99.200  -91.000
      TRP6 108     1.020    30.012  34.971  55.454  -99.200  -91.000
       PHE 109     1.000    31.596  30.706  45.807  -99.200  -91.000
       HIS 125     0.900    30.692  23.470  49.468  -99.200  -91.000
       TYR 126     0.840    35.823  28.634  44.461  -99.200  -91.000
       PHE 133     1.000    23.090  32.335  40.603  -99.200  -91.000