=============================================================================
          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  2     0.900    19.522  33.165  77.259  -99.200  -91.000
       TYR  9     0.840    -0.430  30.984  85.009  -99.200  -91.000
       TYR 11     0.840     0.764  39.711  84.652  -99.200  -91.000
       HIS 17     0.900    -5.828  28.782  95.892  -99.200  -91.000
       HIS 26     0.900     7.801  35.690  91.387  -99.200  -91.000
       HIS 27     0.900     5.505  37.682  82.843  -99.200  -91.000
       HIS 31     0.900    11.324  34.979  84.045  -99.200  -91.000
       TYR 34     0.840    16.157  37.268  88.892  -99.200  -91.000
       TYR 45     0.840    30.967  34.414  81.487  -99.200  -91.000
       PHE 66     1.000    20.773  37.165  91.804  -99.200  -91.000
       HIS 71     0.900    15.112  33.113  80.919  -99.200  -91.000
       HIS 74     0.900    12.038  33.801  89.010  -99.200  -91.000
       PHE 77     1.000     6.732  29.600  91.188  -99.200  -91.000
       TRP 78     1.040     6.950  32.593  84.940  -99.200  -91.000
      TRP6 78     1.020     6.510  33.545  87.059  -99.200  -91.000
       PHE 101     1.000     9.613  11.976  97.498  -99.200  -91.000
       PHE 104     1.000    -0.136  14.751  96.661  -99.200  -91.000
       PHE 107     1.000     5.761  15.690  96.477  -99.200  -91.000
       TRP 123     1.040    13.993  29.406  93.285  -99.200  -91.000
      TRP6 123     1.020    12.086  29.432  91.890  -99.200  -91.000
       TRP 125     1.040    14.299  23.670  92.568  -99.200  -91.000
      TRP6 125     1.020    13.079  24.117  90.594  -99.200  -91.000
       PHE 128     1.000    13.993  10.339  87.300  -99.200  -91.000
       HIS 134     0.900    16.489   7.882  94.005  -99.200  -91.000
       TRP 161     1.040    14.654  34.182  95.754  -99.200  -91.000
      TRP6 161     1.020    16.043  36.052  95.395  -99.200  -91.000
       HIS 163     0.900    11.225  37.538  94.271  -99.200  -91.000
       TYR 165     0.840     7.192  34.230 101.560  -99.200  -91.000
       TYR 166     0.840     7.263  40.444 104.297  -99.200  -91.000
       TYR 169     0.840    -0.280  33.510 101.294  -99.200  -91.000
       TYR 176     0.840     4.551  30.998  98.494  -99.200  -91.000
       TRP 181     1.040     1.328  22.037  98.989  -99.200  -91.000
      TRP6 181     1.020     2.771  20.632  97.757  -99.200  -91.000
       TRP 186     1.040    -0.327  17.994  91.154  -99.200  -91.000
      TRP6 186     1.020     1.816  17.437  91.995  -99.200  -91.000
       TYR 193     0.840     8.119  10.257  86.700  -99.200  -91.000