=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 31 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900     6.687  14.680 -54.704  -99.200  -91.000
       HIS  2     0.900     2.860  22.455 -56.234  -99.200  -91.000
       TYR 30     0.840    29.976  31.146 -26.228  -99.200  -91.000
       TRP 36     1.040    43.261  29.769 -23.970  -99.200  -91.000
      TRP6 36     1.020    43.356  30.513 -21.723  -99.200  -91.000
       TYR 38     0.840    36.981  21.124 -20.046  -99.200  -91.000
       HIS 40     0.900    45.722  27.714 -21.536  -99.200  -91.000
       PHE 48     1.000    28.784  29.353 -18.143  -99.200  -91.000
       PHE 50     1.000    30.979  19.743 -24.168  -99.200  -91.000
       HIS 52     0.900    26.261  29.932 -23.836  -99.200  -91.000
       TYR 57     0.840    23.952  21.367 -33.338  -99.200  -91.000
       HIS 59     0.900    19.504  28.612 -27.729  -99.200  -91.000
       PHE 66     1.000     8.932  29.440 -37.483  -99.200  -91.000
       HIS 84     0.900    41.869  27.274 -33.553  -99.200  -91.000
       PHE 86     1.000    39.704  32.350 -27.170  -99.200  -91.000
       PHE 93     1.000    33.333  33.204 -18.736  -99.200  -91.000
       TYR 97     0.840    27.856  41.573 -20.922  -99.200  -91.000
       HIS 99     0.900    29.271  35.450 -30.001  -99.200  -91.000
       HIS 102     0.900    28.388  42.703 -30.960  -99.200  -91.000
       HIS 113     0.900    12.219  42.216 -42.107  -99.200  -91.000
       HIS 120     0.900     2.186  40.234 -35.469  -99.200  -91.000
       PHE 123     1.000     6.241  39.579 -31.320  -99.200  -91.000
       PHE 125     1.000    10.434  29.427 -33.828  -99.200  -91.000
       TRP 128     1.040    11.650  29.312 -28.970  -99.200  -91.000
      TRP6 128     1.020    13.978  28.853 -29.074  -99.200  -91.000
       TYR 129     0.840    17.087  32.514 -30.854  -99.200  -91.000
       HIS 134     0.900    16.812  39.522 -20.142  -99.200  -91.000
       PHE 140     1.000    28.288  33.566 -21.438  -99.200  -91.000
       HIS 155     0.900    44.118  31.850  -2.538  -99.200  -91.000
       TYR 158     0.840    40.337  26.579  -6.097  -99.200  -91.000
       TYR 163     0.840    29.898  32.693  -8.897  -99.200  -91.000