=============================================================================
          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.
       HIS  2     0.900    29.598  15.308 -38.609  -99.200  -91.000
       PHE  6     1.000    18.239  16.825 -38.271  -99.200  -91.000
       TYR 22     0.840     7.677  22.065 -17.816  -99.200  -91.000
       HIS 24     0.900     1.744  32.414 -18.129  -99.200  -91.000
       TRP 30     1.040    -2.186  27.918 -11.940  -99.200  -91.000
      TRP6 30     1.020    -3.508  27.484 -13.848  -99.200  -91.000
       PHE 43     1.000    14.739  37.425  12.474  -99.200  -91.000
       PHE 46     1.000    20.446  33.434  17.891  -99.200  -91.000
       PHE 54     1.000    20.913  45.700  17.527  -99.200  -91.000
       TYR 74     0.840    16.134  42.774  15.558  -99.200  -91.000
       PHE 89     1.000    17.282  29.308  19.257  -99.200  -91.000
       PHE 118     1.000     9.689  43.941  24.691  -99.200  -91.000
       TYR 122     0.840     5.984  47.284  25.491  -99.200  -91.000
       PHE 123     1.000     6.453  43.938  19.453  -99.200  -91.000
       TYR 127     0.840     2.439  29.976  18.048  -99.200  -91.000
       TYR 137     0.840    19.673  28.705  29.424  -99.200  -91.000
       HIS 140     0.900    27.318  19.951  30.927  -99.200  -91.000
       HIS 142     0.900    28.535  17.829  25.905  -99.200  -91.000
       TYR 147     0.840    24.320   8.620  33.507  -99.200  -91.000
       TYR 168     0.840    11.965  28.245  28.505  -99.200  -91.000
       HIS 174     0.900     1.732  32.655  22.062  -99.200  -91.000
       HIS 200     0.900    -5.802  23.624  28.248  -99.200  -91.000
       PHE 203     1.000     2.490  22.991  17.148  -99.200  -91.000
       TYR 207     0.840    14.798  22.243  17.440  -99.200  -91.000
       PHE 211     1.000    19.608  13.494  10.059  -99.200  -91.000
       TYR 216     0.840    23.718  21.651  13.877  -99.200  -91.000
       PHE 219     1.000    22.366  28.205  18.210  -99.200  -91.000
       TYR 235     0.840    23.971  15.235  22.646  -99.200  -91.000
       PHE 267     1.000    24.381  21.065   2.560  -99.200  -91.000
       TYR 268     0.840    21.139  16.497   7.067  -99.200  -91.000
       TYR 287     0.840    16.758  26.452  13.207  -99.200  -91.000
       HIS 288     0.900    18.816  28.574   5.084  -99.200  -91.000
       TYR 293     0.840    21.649  34.022   7.297  -99.200  -91.000
       HIS 297     0.900    23.892  36.468   3.765  -99.200  -91.000
       PHE 312     1.000    11.878  34.539  -3.183  -99.200  -91.000
       HIS 315     0.900    14.584  29.946   2.828  -99.200  -91.000
       PHE 318     1.000    14.465  25.216   3.335  -99.200  -91.000
       TYR 329     0.840    19.515  32.207  11.919  -99.200  -91.000
       PHE 334     1.000    12.587  34.073   1.602  -99.200  -91.000
       TRP 337     1.040    13.697  39.632  -1.068  -99.200  -91.000
      TRP6 337     1.020    15.173  37.927  -0.375  -99.200  -91.000