=============================================================================
          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  3     0.900    10.323  -5.142  60.218  -99.200  -91.000
       TRP 22     1.040    20.133  13.906  52.361  -99.200  -91.000
      TRP6 22     1.020    18.904  15.315  50.903  -99.200  -91.000
       HIS 26     0.900    21.500  23.215  55.064  -99.200  -91.000
       HIS 32     0.900    22.600  29.381  43.318  -99.200  -91.000
       HIS 41     0.900    12.333  37.790  46.504  -99.200  -91.000
       TRP 42     1.040    14.131  35.265  38.431  -99.200  -91.000
      TRP6 42     1.020    13.641  35.408  36.123  -99.200  -91.000
       PHE 48     1.000    11.500  43.272  29.388  -99.200  -91.000
       PHE 72     1.000    32.606  45.641  26.530  -99.200  -91.000
       PHE 75     1.000    24.804  43.528  27.530  -99.200  -91.000
       PHE 89     1.000    28.605  28.267  44.763  -99.200  -91.000
       PHE 96     1.000    37.377  28.503  45.963  -99.200  -91.000
       TYR 123     0.840    14.425  31.440  27.345  -99.200  -91.000
       PHE 156     1.000    18.897  35.050  24.841  -99.200  -91.000
       PHE 165     1.000    17.474  19.391  31.436  -99.200  -91.000
       TYR 200     0.840    30.725  20.005  46.321  -99.200  -91.000
       PHE 204     1.000    23.981  18.020  40.043  -99.200  -91.000
       HIS 206     0.900    24.470   8.735  45.722  -99.200  -91.000
       TYR 207     0.840    18.606  17.576  45.555  -99.200  -91.000
       HIS 210     0.900    15.141  13.448  48.295  -99.200  -91.000
       HIS 213     0.900    14.295  16.938  38.268  -99.200  -91.000
       HIS 217     0.900    16.443   8.269  28.986  -99.200  -91.000
       PHE 218     1.000    16.740  16.294  35.703  -99.200  -91.000
       TRP 219     1.040    24.060  11.412  36.777  -99.200  -91.000
      TRP6 219     1.020    24.730  13.403  37.856  -99.200  -91.000
       HIS 235     0.900    33.429  35.606  28.293  -99.200  -91.000
       PHE 239     1.000    38.413  39.525  28.695  -99.200  -91.000
       HIS 241     0.900    39.783  36.891  18.579  -99.200  -91.000
       PHE 250     1.000    38.100  45.174  27.700  -99.200  -91.000
       PHE 254     1.000    34.596  41.567  31.237  -99.200  -91.000
       PHE 258     1.000    35.759  36.258  32.500  -99.200  -91.000