=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 32 rings
        ring        int.           center             anis.    iso.
       HIS  5     0.900    10.488  45.797  -8.625  -99.200  -91.000
       TRP 24     1.040    20.081  26.606  -1.026  -99.200  -91.000
      TRP6 24     1.020    18.819  25.154   0.413  -99.200  -91.000
       HIS 28     0.900    21.470  17.110  -3.912  -99.200  -91.000
       HIS 34     0.900    22.517  10.957   7.708  -99.200  -91.000
       HIS 43     0.900    14.142   1.350   4.863  -99.200  -91.000
       TRP 44     1.040    13.946   4.853  12.103  -99.200  -91.000
      TRP6 44     1.020    13.527   4.894  14.442  -99.200  -91.000
       PHE 50     1.000    11.510  -3.134  21.330  -99.200  -91.000
       PHE 74     1.000    32.842  -5.634  24.269  -99.200  -91.000
       PHE 77     1.000    24.834  -3.581  23.137  -99.200  -91.000
       PHE 91     1.000    28.632  11.998   6.293  -99.200  -91.000
       PHE 98     1.000    37.323  11.818   5.041  -99.200  -91.000
       TYR 125     0.840    14.310   8.455  23.572  -99.200  -91.000
       PHE 158     1.000    18.785   4.812  25.962  -99.200  -91.000
       PHE 167     1.000    17.433  20.737  19.788  -99.200  -91.000
       TYR 202     0.840    30.668  20.296   4.929  -99.200  -91.000
       PHE 206     1.000    23.905  22.137  11.165  -99.200  -91.000
       HIS 208     0.900    24.401  31.522   5.688  -99.200  -91.000
       TYR 209     0.840    18.513  22.686   5.686  -99.200  -91.000
       HIS 212     0.900    15.040  26.785   3.119  -99.200  -91.000
       HIS 215     0.900    14.323  23.237  13.035  -99.200  -91.000
       HIS 219     0.900    16.339  31.720  22.573  -99.200  -91.000
       PHE 220     1.000    16.817  23.829  15.518  -99.200  -91.000
       TRP 221     1.040    24.079  28.735  14.601  -99.200  -91.000
      TRP6 221     1.020    24.754  26.732  13.423  -99.200  -91.000
       HIS 237     0.900    33.488   4.459  22.560  -99.200  -91.000
       PHE 241     1.000    38.384   0.564  22.154  -99.200  -91.000
       HIS 243     0.900    39.729   3.237  32.222  -99.200  -91.000
       PHE 251     1.000    38.155  -5.074  23.150  -99.200  -91.000
       PHE 255     1.000    34.703  -1.673  19.603  -99.200  -91.000
       PHE 259     1.000    35.743   3.853  18.463  -99.200  -91.000