=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 20 rings
        ring        int.           center             anis.    iso.
       TYR 21     0.840    45.328  78.035  25.165  -99.200  -91.000
       TYR 30     0.840    25.093  69.454  47.235  -99.200  -91.000
       PHE 31     1.000    26.721  73.834  44.373  -99.200  -91.000
       PHE 40     1.000    24.886  73.597  32.518  -99.200  -91.000
       PHE 43     1.000    34.813  73.377  37.225  -99.200  -91.000
       PHE 52     1.000    38.233  87.403  38.247  -99.200  -91.000
       PHE 57     1.000    48.619  87.860  27.889  -99.200  -91.000
       HIS 80     0.900    45.803  93.458  40.102  -99.200  -91.000
       TYR 114     0.840    52.560  82.717  38.756  -99.200  -91.000
       HIS 121     0.900    56.011 100.704  52.834  -99.200  -91.000
       PHE 125     1.000    44.560  97.760  48.786  -99.200  -91.000
       PHE 143     1.000    47.466 101.114  40.555  -99.200  -91.000
       TYR 147     0.840    38.234  97.506  41.862  -99.200  -91.000
       TYR 168     0.840    25.309  77.625  20.843  -99.200  -91.000
       HIS 208     0.900    26.725  94.981  51.726  -99.200  -91.000
       TYR 214     0.840    21.918  96.588  41.346  -99.200  -91.000
       TYR 215     0.840    21.302  96.391  47.293  -99.200  -91.000
       HIS 222     0.900    28.126  97.296  53.861  -99.200  -91.000
       TYR 242     0.840    26.979 102.736  40.786  -99.200  -91.000
       HIS 294     0.900    15.895  85.746  39.699  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================