=============================================================================
          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.
       PHE  9     1.000     6.744  -8.468  18.902  -99.200  -91.000
       TYR 17     0.840    18.812   1.713  31.781  -99.200  -91.000
       TYR 23     0.840    10.324  -7.247  22.626  -99.200  -91.000
       HIS 34     0.900    11.233 -17.742  17.959  -99.200  -91.000
       TYR 39     0.840    -4.873  -7.613  18.301  -99.200  -91.000
       TRP 45     1.040     7.649 -15.799   9.471  -99.200  -91.000
      TRP6 45     1.020     8.806 -17.661  10.370  -99.200  -91.000
       HIS 50     0.900    22.578  -3.971  12.198  -99.200  -91.000
       PHE 71     1.000     1.076  -3.649   8.601  -99.200  -91.000
       PHE 78     1.000    -1.533  -0.691  12.183  -99.200  -91.000
       PHE 88     1.000     5.611  10.242   3.715  -99.200  -91.000
       HIS 96     0.900     7.728   5.694   0.544  -99.200  -91.000
       PHE 107     1.000    10.607  16.687   7.837  -99.200  -91.000
       HIS 124     0.900    19.202  27.307  26.116  -99.200  -91.000
       PHE 126     1.000     7.901  25.285  25.677  -99.200  -91.000
       PHE 143     1.000    13.525  20.470  28.081  -99.200  -91.000
       TYR 160     0.840     2.966  25.496  21.563  -99.200  -91.000
       HIS 163     0.900    -0.040  24.369  24.002  -99.200  -91.000
       PHE 165     1.000    -8.209  18.954  19.059  -99.200  -91.000
       PHE 166     1.000    -1.159  20.710  18.382  -99.200  -91.000
       TYR 192     0.840    -6.219  21.587  14.832  -99.200  -91.000
       PHE 200     1.000    -2.329  26.537   6.125  -99.200  -91.000
       HIS 239     0.900     3.087  17.221  18.771  -99.200  -91.000
       HIS 256     0.900    23.738   3.518  32.031  -99.200  -91.000
       TYR 260     0.840    23.912  13.728  32.192  -99.200  -91.000
       TYR 280     0.840    21.588   0.742  26.329  -99.200  -91.000
       TYR 323     0.840    25.286  -1.725  16.900  -99.200  -91.000
       HIS 332     0.900    33.299   7.599  26.032  -99.200  -91.000
       HIS 337     0.900    27.452   1.344   9.937  -99.200  -91.000
       HIS 338     0.900    20.870   4.210  15.182  -99.200  -91.000
       PHE 341     1.000    16.621   8.185  13.748  -99.200  -91.000
       PHE 343     1.000    18.862  -0.519   4.617  -99.200  -91.000
       HIS 346     0.900     7.973   2.621   3.589  -99.200  -91.000
       TRP 399     1.040    15.899  22.838  39.278  -99.200  -91.000
      TRP6 399     1.020    13.808  22.128  38.424  -99.200  -91.000
       HIS 400     0.900    21.206  24.716  44.898  -99.200  -91.000
       HIS 401     0.900    13.765  27.544  42.877  -99.200  -91.000