=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 41 rings
        ring        int.           center             anis.    iso.
       TYR  3     0.840    23.341  -4.049  16.049  -99.200  -91.000
       TYR 32     0.840    16.802   8.635   7.621  -99.200  -91.000
       TYR 37     0.840    11.838  10.103   4.928  -99.200  -91.000
       TYR 47     0.840    18.689   3.547  11.238  -99.200  -91.000
       HIS 51     0.900    20.887   2.248   8.259  -99.200  -91.000
       TRP 70     1.040    -1.108  13.571  20.565  -99.200  -91.000
      TRP6 70     1.020    -1.746  11.985  18.912  -99.200  -91.000
       HIS 75     0.900    -0.737  19.434  14.654  -99.200  -91.000
       TRP 77     1.040     6.683  14.131  10.982  -99.200  -91.000
      TRP6 77     1.020     8.844  13.225  11.313  -99.200  -91.000
       PHE 79     1.000     5.221   9.571  18.341  -99.200  -91.000
       PHE 89     1.000    10.478  -1.015  17.805  -99.200  -91.000
       HIS 91     0.900    10.635  -3.836  26.826  -99.200  -91.000
       PHE 98     1.000    19.132  19.675  29.293  -99.200  -91.000
       HIS 110     0.900    32.891  10.513  24.621  -99.200  -91.000
       PHE 114     1.000    35.369  24.818  30.798  -99.200  -91.000
       TYR 128     0.840    24.550  24.956  34.042  -99.200  -91.000
       HIS 138     0.900    18.938  19.124  39.363  -99.200  -91.000
       HIS 141     0.900    24.311   4.562  41.292  -99.200  -91.000
       TRP 146     1.040    24.017   6.681  37.052  -99.200  -91.000
      TRP6 146     1.020    24.543   8.457  38.545  -99.200  -91.000
       HIS 155     0.900    11.474  27.822  31.430  -99.200  -91.000
       PHE 158     1.000    19.826  37.936  35.688  -99.200  -91.000
       HIS 178     0.900     9.830  34.826  36.138  -99.200  -91.000
       TYR 194     0.840    23.117  44.393  20.698  -99.200  -91.000
       PHE 232     1.000    25.826  32.126  27.922  -99.200  -91.000
       PHE 238     1.000    20.614  28.220  36.259  -99.200  -91.000
       PHE 249     1.000    28.556  16.878  47.954  -99.200  -91.000
       PHE 253     1.000    28.857  15.659  34.078  -99.200  -91.000
       PHE 262     1.000    29.734  31.089  23.815  -99.200  -91.000
       PHE 265     1.000    34.098  35.976  25.253  -99.200  -91.000
       PHE 266     1.000    32.070  28.223  29.387  -99.200  -91.000
       PHE 271     1.000    31.294  27.813  34.056  -99.200  -91.000
       PHE 275     1.000    30.448  25.330  40.141  -99.200  -91.000
       PHE 281     1.000    27.253  27.272  53.102  -99.200  -91.000
       TYR 284     0.840    27.871  21.983  49.639  -99.200  -91.000
       HIS 286     0.900    38.493  25.681  45.380  -99.200  -91.000
       TYR 291     0.840    33.973  16.614  34.466  -99.200  -91.000
       HIS 295     0.900    28.921  11.092  22.381  -99.200  -91.000
       HIS 306     0.900    14.537   5.728  29.625  -99.200  -91.000
       HIS 313     0.900    21.236  -5.082  29.482  -99.200  -91.000