=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 42 rings
        ring        int.           center             anis.    iso.
       HIS  5     0.900   -21.419 -39.080  47.832  -99.200  -91.000
       PHE 12     1.000   -24.619 -23.029  43.401  -99.200  -91.000
       TYR 18     0.840   -19.919 -41.269  31.633  -99.200  -91.000
       PHE 52     1.000   -45.640 -58.029  18.835  -99.200  -91.000
       HIS 54     0.900   -52.289 -52.001  24.573  -99.200  -91.000
       HIS 57     0.900   -47.923 -61.523  14.641  -99.200  -91.000
       TYR 59     0.840   -49.424 -49.905  15.294  -99.200  -91.000
       HIS 60     0.900   -46.801 -54.176  17.741  -99.200  -91.000
       PHE 94     1.000   -63.981 -50.183  26.453  -99.200  -91.000
       TYR 108     0.840   -75.872 -54.194  33.065  -99.200  -91.000
       PHE 115     1.000   -72.622 -58.096  23.567  -99.200  -91.000
       PHE 124     1.000   -66.042 -53.022  30.399  -99.200  -91.000
       TYR 125     0.840   -64.563 -60.438  25.254  -99.200  -91.000
       TYR 128     0.840   -59.820 -66.283  33.669  -99.200  -91.000
       TYR 140     0.840   -63.546 -53.587  46.202  -99.200  -91.000
       TYR 142     0.840   -58.416 -54.413  42.256  -99.200  -91.000
       HIS 155     0.900   -72.513 -64.455  39.137  -99.200  -91.000
       HIS 169     0.900   -59.055 -43.705  34.252  -99.200  -91.000
       PHE 199     1.000   -44.023 -59.960  13.619  -99.200  -91.000
       PHE 209     1.000   -38.335 -54.817  26.979  -99.200  -91.000
       PHE 212     1.000   -49.370 -59.926  34.019  -99.200  -91.000
       HIS 242     0.900   -47.781 -63.584  46.615  -99.200  -91.000
       TYR 304     0.840   -52.704 -37.096  29.856  -99.200  -91.000
       PHE 321     1.000   -29.949 -40.327  43.330  -99.200  -91.000
       TYR 338     0.840   -46.599 -31.225  25.490  -99.200  -91.000
       TYR 345     0.840   -38.163 -31.703  32.433  -99.200  -91.000
       TYR 360     0.840   -13.532 -46.129  45.588  -99.200  -91.000
       PHE 362     1.000   -24.462 -49.112  42.109  -99.200  -91.000
       PHE 363     1.000   -14.455 -51.297  41.894  -99.200  -91.000
       HIS 371     0.900   -18.294 -68.654  45.742  -99.200  -91.000
       TYR 389     0.840   -13.914 -45.926  40.597  -99.200  -91.000
       TYR 412     0.840   -17.183 -56.240  39.273  -99.200  -91.000
       PHE 441     1.000   -20.245 -53.842  12.545  -99.200  -91.000
       PHE 442     1.000   -12.100 -54.034  13.485  -99.200  -91.000
       HIS 449     0.900   -11.941 -63.549  11.008  -99.200  -91.000
       HIS 455     0.900    -5.441 -53.643  12.575  -99.200  -91.000
       PHE 463     1.000   -17.801 -43.905  20.408  -99.200  -91.000
       TYR 469     0.840   -16.954 -40.193  26.135  -99.200  -91.000
       TYR 475     0.840    -2.073 -42.778  33.173  -99.200  -91.000
       HIS 480     0.900    -6.705 -56.668  24.189  -99.200  -91.000
       HIS 483     0.900    -0.714 -61.301  20.516  -99.200  -91.000
       TYR 488     0.840   -10.926 -66.718  29.659  -99.200  -91.000