=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 22 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    44.184  39.385  39.760  -99.200  -91.000
       PHE  2     1.000    40.968  39.427  37.206  -99.200  -91.000
       TYR  9     0.840    29.639  43.987  33.525  -99.200  -91.000
       TYR 16     0.840    17.925  28.694  34.181  -99.200  -91.000
       HIS 22     0.900    13.763  27.903  41.772  -99.200  -91.000
       PHE 23     1.000    14.124  32.745  34.821  -99.200  -91.000
       HIS 42     0.900     9.061  43.090  41.815  -99.200  -91.000
       PHE 45     1.000    18.220  40.851  39.648  -99.200  -91.000
       TYR 56     0.840    27.998  48.901  43.389  -99.200  -91.000
       TYR 65     0.840    22.809  49.559  43.938  -99.200  -91.000
       TYR 75     0.840    21.383  43.552  52.875  -99.200  -91.000
       PHE 86     1.000    27.142  40.189  45.732  -99.200  -91.000
       HIS 94     0.900    27.950  27.061  29.868  -99.200  -91.000
       TYR 95     0.840    26.795  26.517  34.498  -99.200  -91.000
       TYR 98     0.840    27.359  37.144  39.636  -99.200  -91.000
       HIS 103     0.900    31.270  38.825  54.792  -99.200  -91.000
       TRP 108     1.040    30.763  33.286  53.872  -99.200  -91.000
      TRP6 108     1.020    29.945  34.778  55.519  -99.200  -91.000
       PHE 109     1.000    31.411  30.697  45.587  -99.200  -91.000
       HIS 125     0.900    30.108  23.419  49.437  -99.200  -91.000
       TYR 126     0.840    35.370  28.473  44.190  -99.200  -91.000
       PHE 133     1.000    22.987  32.489  40.426  -99.200  -91.000