=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 43 rings
        ring        int.           center             anis.    iso.
       PHE  5     1.000    45.198  14.648  54.119  -99.200  -91.000
       HIS  6     0.900    40.567  21.340  52.936  -99.200  -91.000
       HIS 16     0.900    33.342  19.660  39.215  -99.200  -91.000
       HIS 18     0.900    41.277  17.186  33.263  -99.200  -91.000
       PHE 23     1.000    30.734  -0.741  33.732  -99.200  -91.000
       TRP 35     1.040    46.512  11.846  42.469  -99.200  -91.000
      TRP6 35     1.020    44.316  12.383  41.767  -99.200  -91.000
       PHE 85     1.000    36.335  23.778  41.001  -99.200  -91.000
       HIS 93     0.900    32.988  13.270  38.536  -99.200  -91.000
       HIS 97     0.900    28.922   9.519  41.807  -99.200  -91.000
       PHE 99     1.000    32.624  15.342  49.487  -99.200  -91.000
       HIS 100     0.900    30.066  10.774  46.843  -99.200  -91.000
       PHE 123     1.000    40.998   2.748  52.173  -99.200  -91.000
       PHE 125     1.000    39.430   4.920  45.871  -99.200  -91.000
       PHE 151     1.000    31.479   0.220  57.948  -99.200  -91.000
       HIS 153     0.900    25.327  10.650  46.635  -99.200  -91.000
       PHE 176     1.000     5.264  -0.756  36.054  -99.200  -91.000
       TRP 215     1.040    -6.537   9.848  11.278  -99.200  -91.000
      TRP6 215     1.020    -8.829   9.906  10.696  -99.200  -91.000
       PHE 230     1.000    11.978   4.609  50.895  -99.200  -91.000
       HIS 241     0.900    -2.606  -5.065  45.634  -99.200  -91.000
       TYR 252     0.840   -12.475  -2.074  29.960  -99.200  -91.000
       PHE 258     1.000     3.640  -6.830  36.628  -99.200  -91.000
       TRP 260     1.040     9.620  -7.474  39.635  -99.200  -91.000
      TRP6 260     1.020     8.503  -5.523  40.367  -99.200  -91.000
       PHE 261     1.000    11.739  -6.909  32.327  -99.200  -91.000
       TYR 263     0.840    18.411   0.158  37.721  -99.200  -91.000
       PHE 273     1.000    28.669  -2.705  60.996  -99.200  -91.000
       TYR 286     0.840    34.172  16.692  61.623  -99.200  -91.000
       HIS 290     0.900    16.341   9.124  62.210  -99.200  -91.000
       PHE 300     1.000    27.327   0.948  50.667  -99.200  -91.000
       TYR 303     0.840    29.503  -2.771  46.810  -99.200  -91.000
       PHE 310     1.000    24.974   3.157  59.673  -99.200  -91.000
       PHE 311     1.000    25.469   5.443  50.701  -99.200  -91.000
       TRP 313     1.040    21.283  11.135  53.896  -99.200  -91.000
      TRP6 313     1.020    21.383  10.016  51.811  -99.200  -91.000
       TRP 321     1.040    22.662  14.138  45.432  -99.200  -91.000
      TRP6 321     1.020    21.392  12.477  46.535  -99.200  -91.000
       HIS 322     0.900    21.816  12.441  38.507  -99.200  -91.000
       HIS 323     0.900    20.116  22.664  38.599  -99.200  -91.000
       PHE 326     1.000    26.297  18.203  43.119  -99.200  -91.000
       TYR 339     0.840    31.539   9.590  59.891  -99.200  -91.000
       PHE 340     1.000    32.910   7.304  55.205  -99.200  -91.000