=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 36 rings
        ring        int.           center             anis.    iso.
       HIS 11     0.900    42.578  17.287  -2.179  -99.200  -91.000
       TRP 16     1.040    52.166  21.998   0.125  -99.200  -91.000
      TRP6 16     1.020    51.324  23.261   1.946  -99.200  -91.000
       TYR 22     0.840    50.090  15.961   8.533  -99.200  -91.000
       TYR 33     0.840    48.999  12.396 -12.111  -99.200  -91.000
       PHE 45     1.000    29.212  10.752 -13.391  -99.200  -91.000
       PHE 49     1.000    32.553   1.122 -11.309  -99.200  -91.000
       TYR 57     0.840    20.364  18.530  -2.005  -99.200  -91.000
       PHE 59     1.000    25.275  18.561   1.186  -99.200  -91.000
       TRP 96     1.040    42.333  17.765  12.732  -99.200  -91.000
      TRP6 96     1.020    41.728  15.596  13.414  -99.200  -91.000
       TYR 98     0.840    46.068  18.969   8.696  -99.200  -91.000
       TYR 101     0.840    51.303  19.828  14.964  -99.200  -91.000
       TRP 123     1.040    50.088  14.298  17.189  -99.200  -91.000
      TRP6 123     1.020    50.326  14.494  14.855  -99.200  -91.000
       TRP 126     1.040    43.604   9.260  13.086  -99.200  -91.000
      TRP6 126     1.020    42.108   9.833  11.353  -99.200  -91.000
       HIS 154     0.900    21.488   9.647   1.621  -99.200  -91.000
       HIS 157     0.900    16.560  13.500  -1.628  -99.200  -91.000
       PHE 168     1.000    33.006  15.648  -5.774  -99.200  -91.000
       HIS 170     0.900    39.852  19.251   1.927  -99.200  -91.000
       HIS 172     0.900    44.698  13.653   8.583  -99.200  -91.000
       TYR 176     0.840    36.910  12.435  13.119  -99.200  -91.000
       PHE 177     1.000    30.636  12.218   5.674  -99.200  -91.000
       TRP 181     1.040    27.286   6.387   6.699  -99.200  -91.000
      TRP6 181     1.020    26.209   8.275   5.751  -99.200  -91.000
       PHE 182     1.000    32.294   1.757   9.576  -99.200  -91.000
       TYR 202     0.840    23.736  24.342   5.347  -99.200  -91.000
       TYR 209     0.840    21.913  23.538  12.074  -99.200  -91.000
       TYR 215     0.840    30.284  16.171  19.635  -99.200  -91.000
       HIS 217     0.900    34.873  12.378  20.658  -99.200  -91.000
       PHE 224     1.000    37.854   3.685   7.895  -99.200  -91.000
       TYR 236     0.840    21.594   5.356   4.856  -99.200  -91.000
       HIS 238     0.900    19.163  -5.486   7.266  -99.200  -91.000
       HIS 239     0.900    16.124  -1.239   0.114  -99.200  -91.000
       PHE 252     1.000    33.695  -4.220  -9.158  -99.200  -91.000