=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 30 rings
        ring        int.           center             anis.    iso.
       TYR  7     0.840     6.140   7.522  43.067  -99.200  -91.000
       PHE 11     1.000    10.240  14.941  37.115  -99.200  -91.000
       HIS 20     0.900     7.585  10.311  22.481  -99.200  -91.000
       TYR 25     0.840    10.147  16.076  25.112  -99.200  -91.000
       PHE 39     1.000    19.940  23.784  37.740  -99.200  -91.000
       PHE 46     1.000    25.456  17.509  33.923  -99.200  -91.000
       TYR 53     0.840    21.716   5.299  13.632  -99.200  -91.000
       TYR 55     0.840    26.309   7.909  10.566  -99.200  -91.000
       TYR 57     0.840    29.939  10.849  20.847  -99.200  -91.000
       HIS 61     0.900    31.089  14.353  21.052  -99.200  -91.000
       PHE 77     1.000    28.398   5.139  30.785  -99.200  -91.000
       PHE 96     1.000    18.096   8.534  28.619  -99.200  -91.000
       HIS 97     0.900    21.833  14.598  22.315  -99.200  -91.000
       PHE 100     1.000    16.137  15.715  12.904  -99.200  -91.000
       PHE 111     1.000    16.691  -0.961  27.247  -99.200  -91.000
       TYR 122     0.840     5.490   1.404  43.153  -99.200  -91.000
       TYR 126     0.840    19.990   0.775  41.053  -99.200  -91.000
       TYR 127     0.840    20.809   5.736  36.381  -99.200  -91.000
       TYR 131     0.840    14.681  16.701  33.791  -99.200  -91.000
       TYR 137     0.840    25.349  18.222  17.984  -99.200  -91.000
       PHE 140     1.000    23.639  22.224  23.450  -99.200  -91.000
       PHE 141     1.000    27.134  23.165  15.493  -99.200  -91.000
       HIS 144     0.900    23.675  27.661  24.299  -99.200  -91.000
       PHE 147     1.000    28.541  25.823  26.960  -99.200  -91.000
       TYR 153     0.840    23.112  18.592  12.533  -99.200  -91.000
       HIS 158     0.900    27.383  14.115   5.255  -99.200  -91.000
       PHE 161     1.000    29.932  10.092   7.395  -99.200  -91.000
       PHE 168     1.000    24.272   1.880  15.628  -99.200  -91.000
       TRP 175     1.040    15.045  -4.696  11.400  -99.200  -91.000
      TRP6 175     1.020    17.161  -5.746  11.521  -99.200  -91.000