=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 37 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    41.196   5.708   6.799  -99.200  -91.000
       TYR  7     0.840    49.564  -3.856  16.450  -99.200  -91.000
       PHE  8     1.000    47.516   2.263  21.447  -99.200  -91.000
       HIS 13     0.900    58.258   1.124  28.674  -99.200  -91.000
       PHE 21     1.000    55.155   7.557  10.400  -99.200  -91.000
       HIS 24     0.900    60.244   6.583  24.702  -99.200  -91.000
       HIS 27     0.900    52.871   6.641  33.533  -99.200  -91.000
       TYR 28     0.840    51.975   2.631  26.505  -99.200  -91.000
       TRP 33     1.040    39.186   2.856  34.062  -99.200  -91.000
      TRP6 33     1.020    39.699   2.620  36.339  -99.200  -91.000
       TYR 36     0.840    47.829   8.799  31.252  -99.200  -91.000
       HIS 42     0.900    48.938  17.734  14.597  -99.200  -91.000
       PHE 45     1.000    48.690  17.059  18.587  -99.200  -91.000
       HIS 46     0.900    54.277  20.669  23.628  -99.200  -91.000
       TYR 47     0.840    53.794  14.647  26.704  -99.200  -91.000
       TRP 51     1.040    42.740   8.104  30.720  -99.200  -91.000
      TRP6 51     1.020    43.104   6.268  32.192  -99.200  -91.000
       PHE 63     1.000    44.915  15.845  20.614  -99.200  -91.000
       HIS 64     0.900    49.354  18.412  27.608  -99.200  -91.000
       TYR 65     0.840    45.721  22.240  21.486  -99.200  -91.000
       HIS 66     0.900    53.931  22.820  18.465  -99.200  -91.000
       TYR 68     0.840    53.485  33.017  18.707  -99.200  -91.000
       HIS 69     0.900    50.845  26.733  16.048  -99.200  -91.000
       HIS 75     0.900    38.302  16.056  27.884  -99.200  -91.000
       TYR 76     0.840    39.890  17.411  19.644  -99.200  -91.000
       PHE 82     1.000    39.774   2.125  21.096  -99.200  -91.000
       TRP 89     1.040    46.327  -2.811  26.693  -99.200  -91.000
      TRP6 89     1.020    44.313  -1.889  27.543  -99.200  -91.000
       HIS 94     0.900    35.568  -0.402  14.376  -99.200  -91.000
       TYR 95     0.840    36.418   4.101   8.592  -99.200  -91.000
       HIS 117     0.900    27.370  -1.080   5.907  -99.200  -91.000
       HIS 144     0.900    26.547  11.582  33.925  -99.200  -91.000
       HIS 146     0.900    26.013  18.561  26.450  -99.200  -91.000
       TRP 151     1.040    28.895   8.421  30.626  -99.200  -91.000
      TRP6 151     1.020    30.041   7.677  28.686  -99.200  -91.000
       TRP 160     1.040    42.407  14.137  31.092  -99.200  -91.000
      TRP6 160     1.020    42.770  12.683  29.269  -99.200  -91.000