=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 45 rings
        ring        int.           center             anis.    iso.
       HIS  6     0.900   -29.395  -5.051  -2.077  -99.200  -91.000
       PHE 15     1.000   -25.445  -1.524 -13.676  -99.200  -91.000
       PHE 21     1.000   -15.893   0.685   6.520  -99.200  -91.000
       PHE 46     1.000   -20.471  -1.978   4.489  -99.200  -91.000
       HIS 47     0.900   -21.180  -4.657  -3.737  -99.200  -91.000
       HIS 48     0.900   -19.245   3.303  -2.789  -99.200  -91.000
       PHE 49     1.000   -14.715  -1.495   0.792  -99.200  -91.000
       TYR 55     0.840   -10.819  10.547   3.051  -99.200  -91.000
       HIS 60     0.900    -1.926   1.372   5.482  -99.200  -91.000
       PHE 80     1.000   -18.397   3.023  -7.864  -99.200  -91.000
       TYR 81     0.840   -10.124   3.291  -3.987  -99.200  -91.000
       TRP 86     1.040    -6.149  18.471  -0.241  -99.200  -91.000
      TRP6 86     1.020    -8.143  18.634   1.026  -99.200  -91.000
       HIS 91     0.900    -3.073  25.633 -10.172  -99.200  -91.000
       PHE 108     1.000    -7.495  -1.009  -6.434  -99.200  -91.000
       TYR 110     0.840   -10.916  -0.414 -12.958  -99.200  -91.000
       TYR 114     0.840    -9.171  11.458  -9.141  -99.200  -91.000
       HIS 117     0.900   -12.174  15.653  -0.199  -99.200  -91.000
       TYR 118     0.840   -13.958  20.505   1.072  -99.200  -91.000
       PHE 129     1.000    -5.570  19.579   5.619  -99.200  -91.000
       HIS 134     0.900    -0.618  36.571  11.163  -99.200  -91.000
       PHE 139     1.000    -8.334  30.449   1.614  -99.200  -91.000
       TRP 148     1.040   -16.220  18.242 -15.768  -99.200  -91.000
      TRP6 148     1.020   -16.510  16.798 -13.904  -99.200  -91.000
       PHE 168     1.000   -17.881  21.255  -7.411  -99.200  -91.000
       TYR 170     0.840   -28.951  26.395  -8.942  -99.200  -91.000
       TYR 184     0.840   -17.029  11.742 -20.982  -99.200  -91.000
       HIS 194     0.900   -26.821  15.380   9.506  -99.200  -91.000
       TYR 196     0.840   -30.349  16.569  14.566  -99.200  -91.000
       PHE 205     1.000   -29.263  21.830  -9.892  -99.200  -91.000
       TYR 216     0.840   -19.487  14.846   3.828  -99.200  -91.000
       TYR 224     0.840   -13.692  12.994  10.802  -99.200  -91.000
       TRP 227     1.040   -11.338  18.705   9.683  -99.200  -91.000
      TRP6 227     1.020   -11.542  19.805   7.631  -99.200  -91.000
       TYR 248     0.840   -40.372   1.379  11.324  -99.200  -91.000
       TYR 259     0.840   -34.712  11.047   6.200  -99.200  -91.000
       PHE 284     1.000   -28.641  -2.879   1.196  -99.200  -91.000
       PHE 286     1.000   -35.092  -0.766   8.928  -99.200  -91.000
       TYR 305     0.840   -23.545  16.899  13.264  -99.200  -91.000
       PHE 311     1.000   -10.333  24.250   2.840  -99.200  -91.000
       HIS 314     0.900   -11.090  29.223  -2.144  -99.200  -91.000
       TRP 317     1.040   -16.645  27.907   3.162  -99.200  -91.000
      TRP6 317     1.020   -18.518  28.654   4.390  -99.200  -91.000
       PHE 319     1.000   -20.048  23.477   2.832  -99.200  -91.000
       TYR 323     0.840   -30.970  25.307  -3.820  -99.200  -91.000