=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 48 rings
        ring        int.           center             anis.    iso.
       HIS  5     0.900   -25.819  16.729 -40.879  -99.200  -91.000
       TYR 13     0.840   -17.447  19.158 -32.355  -99.200  -91.000
       TYR 23     0.840    -8.142  19.709 -44.691  -99.200  -91.000
       PHE 25     1.000    -1.613  13.268 -44.908  -99.200  -91.000
       PHE 42     1.000   -10.037  18.271 -26.986  -99.200  -91.000
       PHE 55     1.000     3.198  13.501 -40.953  -99.200  -91.000
       HIS 58     0.900     6.038  14.314 -37.008  -99.200  -91.000
       HIS 60     0.900     3.928  17.348 -33.478  -99.200  -91.000
       HIS 64     0.900     2.181  14.021 -23.926  -99.200  -91.000
       TYR 83     0.840     8.049   1.043 -29.499  -99.200  -91.000
       TYR 90     0.840    -1.811   6.744 -25.675  -99.200  -91.000
       HIS 99     0.900     5.950  12.331 -33.312  -99.200  -91.000
       TYR 101     0.840     1.814   7.981 -39.795  -99.200  -91.000
       HIS 105     0.900    -2.788  -3.933 -49.276  -99.200  -91.000
       TYR 112     0.840    -6.971  10.794 -29.148  -99.200  -91.000
       HIS 119     0.900    -3.505  26.067 -40.710  -99.200  -91.000
       TYR 121     0.840    -2.739  16.103 -40.152  -99.200  -91.000
       TYR 128     0.840   -10.330  12.410 -51.105  -99.200  -91.000
       HIS 130     0.900   -14.944  10.582 -53.032  -99.200  -91.000
       HIS 133     0.900    -6.441   4.017 -48.540  -99.200  -91.000
       TYR 136     0.840    -3.406   2.439 -57.715  -99.200  -91.000
       PHE 146     1.000     6.079  16.757 -45.936  -99.200  -91.000
       PHE 157     1.000     7.830  18.259 -41.503  -99.200  -91.000
       TYR 182     0.840     2.909   5.381 -22.102  -99.200  -91.000
       HIS 199     0.900   -14.916   3.023 -17.215  -99.200  -91.000
       PHE 212     1.000    -2.952  13.704 -23.507  -99.200  -91.000
       HIS 228     0.900   -21.689  12.796 -15.920  -99.200  -91.000
       TYR 229     0.840   -23.161  20.872 -14.043  -99.200  -91.000
       HIS 230     0.900   -17.504  15.870 -16.117  -99.200  -91.000
       TYR 232     0.840   -13.888  24.566 -12.272  -99.200  -91.000
       HIS 233     0.900   -13.477  17.007 -16.794  -99.200  -91.000
       PHE 237     1.000   -18.373  11.006 -23.431  -99.200  -91.000
       TYR 238     0.840   -13.336   8.010 -32.914  -99.200  -91.000
       TRP 245     1.040   -30.516  10.264 -23.174  -99.200  -91.000
      TRP6 245     1.020   -29.749   8.056 -22.878  -99.200  -91.000
       PHE 258     1.000   -14.902  13.663 -31.295  -99.200  -91.000
       HIS 260     0.900   -16.098  19.793 -27.916  -99.200  -91.000
       HIS 267     0.900   -21.226  14.692 -19.723  -99.200  -91.000
       TYR 269     0.840   -20.966   6.095 -20.838  -99.200  -91.000
       HIS 274     0.900   -25.651  -9.414 -26.175  -99.200  -91.000
       TYR 275     0.840   -15.952  -5.658 -26.538  -99.200  -91.000
       PHE 286     1.000   -10.731  19.484 -11.236  -99.200  -91.000
       PHE 289     1.000   -18.693   9.862 -10.061  -99.200  -91.000
       PHE 290     1.000   -12.819   5.853 -15.411  -99.200  -91.000
       TYR 297     0.840   -11.688  -7.164 -13.481  -99.200  -91.000
       HIS 300     0.900    -5.167  -8.049 -18.690  -99.200  -91.000
       PHE 302     1.000   -17.865  -6.933 -20.898  -99.200  -91.000
       PHE 311     1.000   -23.172   5.936  -6.843  -99.200  -91.000