=============================================================================
          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.
       HIS  7     0.900    85.972  74.359 -17.989  -99.200  -91.000
       TYR 12     0.840    87.274  62.959  -8.660  -99.200  -91.000
       HIS 16     0.900    83.997  63.469  -3.204  -99.200  -91.000
       TRP 27     1.040    81.079  62.110   9.130  -99.200  -91.000
      TRP6 27     1.020    82.673  63.815   9.553  -99.200  -91.000
       TYR 33     0.840    93.463  59.519  10.120  -99.200  -91.000
       HIS 54     0.900    84.490  70.515  23.738  -99.200  -91.000
       PHE 57     1.000    86.540  69.065  19.734  -99.200  -91.000
       TYR 60     0.840    97.206  64.890  17.523  -99.200  -91.000
       HIS 62     0.900   102.070  64.518  16.947  -99.200  -91.000
       TYR 78     0.840    98.080  74.008  27.025  -99.200  -91.000
       HIS 87     0.900   105.532  70.150  -0.754  -99.200  -91.000
       TYR 94     0.840    96.442  77.414   7.027  -99.200  -91.000
       HIS 103     0.900    93.675  81.849  33.833  -99.200  -91.000
       PHE 108     1.000    94.924  85.305  19.875  -99.200  -91.000
       TRP 109     1.040    96.379  90.028  22.220  -99.200  -91.000
      TRP6 109     1.020    96.441  90.764  19.974  -99.200  -91.000
       TRP 113     1.040   106.485  90.239  20.168  -99.200  -91.000
      TRP6 113     1.020   106.037  92.297  19.083  -99.200  -91.000
       TYR 137     0.840    91.061  87.892  19.739  -99.200  -91.000
       TRP 138     1.040    88.326  93.163  18.958  -99.200  -91.000
      TRP6 138     1.020    87.366  91.009  19.018  -99.200  -91.000
       TYR 146     0.840    94.432  92.877  25.359  -99.200  -91.000
       HIS 147     0.900   103.324  90.177  30.471  -99.200  -91.000
       TYR 149     0.840   102.958  90.505  24.143  -99.200  -91.000
       HIS 157     0.900    86.092  98.494   4.253  -99.200  -91.000
       TRP 159     1.040    85.647  94.585   3.496  -99.200  -91.000
      TRP6 159     1.020    86.020  95.559   1.369  -99.200  -91.000
       PHE 163     1.000    83.589  89.456   4.011  -99.200  -91.000
       PHE 168     1.000    92.876  94.989  16.173  -99.200  -91.000
       TYR 169     0.840   101.764 101.086  15.933  -99.200  -91.000
       PHE 184     1.000    91.737  89.777   6.479  -99.200  -91.000
       HIS 185     0.900    84.458  88.808  14.335  -99.200  -91.000
       PHE 186     1.000    81.903  84.178   7.182  -99.200  -91.000
       TRP 189     1.040    81.000  78.271   9.507  -99.200  -91.000
      TRP6 189     1.020    83.082  78.051   8.415  -99.200  -91.000
       PHE 204     1.000    86.853  85.905   6.466  -99.200  -91.000
       TYR 212     0.840   103.692  91.913   5.276  -99.200  -91.000
       HIS 222     0.900    89.815  83.252  17.170  -99.200  -91.000
       TYR 233     0.840    89.763  80.275   6.300  -99.200  -91.000
       HIS 258     0.900    99.318  66.797   5.715  -99.200  -91.000
       PHE 273     1.000    84.528  65.112   3.912  -99.200  -91.000
       PHE 275     1.000    80.262  75.958   3.982  -99.200  -91.000