=============================================================================
          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    42.591  39.539  42.929  -99.200  -91.000
       PHE  2     1.000    40.855  39.175  37.321  -99.200  -91.000
       TYR  9     0.840    29.467  43.402  33.486  -99.200  -91.000
       TYR 16     0.840    18.095  27.890  34.459  -99.200  -91.000
       HIS 22     0.900    13.938  27.325  42.052  -99.200  -91.000
       PHE 23     1.000    14.188  32.064  35.082  -99.200  -91.000
       HIS 42     0.900     9.090  42.073  42.156  -99.200  -91.000
       TYR 56     0.840    27.970  48.156  43.365  -99.200  -91.000
       TYR 65     0.840    22.617  49.048  43.694  -99.200  -91.000
       TYR 75     0.840    21.399  43.212  52.714  -99.200  -91.000
       PHE 86     1.000    27.165  39.761  45.734  -99.200  -91.000
       HIS 94     0.900    28.213  26.701  29.766  -99.200  -91.000
       TYR 95     0.840    27.238  25.674  34.564  -99.200  -91.000
       TYR 98     0.840    27.335  36.510  39.528  -99.200  -91.000
       HIS 103     0.900    31.275  38.596  54.899  -99.200  -91.000
       TRP 108     1.040    30.790  33.177  53.881  -99.200  -91.000
      TRP6 108     1.020    29.886  34.735  55.423  -99.200  -91.000
       PHE 109     1.000    31.600  30.282  45.755  -99.200  -91.000
       HIS 125     0.900    30.518  23.314  49.841  -99.200  -91.000
       TYR 126     0.840    35.780  28.202  44.304  -99.200  -91.000
       PHE 133     1.000    23.139  31.851  40.461  -99.200  -91.000