=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 33 rings
        ring        int.           center             anis.    iso.
       HIS  5     0.900   113.036  27.145   9.161  -99.200  -91.000
       PHE 13     1.000   106.045  22.444  -1.308  -99.200  -91.000
       HIS 18     0.900    90.880  18.411   5.509  -99.200  -91.000
       PHE 28     1.000    98.799  11.682  19.620  -99.200  -91.000
       HIS 29     0.900    95.923   9.376  11.546  -99.200  -91.000
       TRP 32     1.040   105.516   6.108  15.911  -99.200  -91.000
      TRP6 32     1.020   106.157   8.299  15.287  -99.200  -91.000
       HIS 34     0.900   102.102   8.208  23.153  -99.200  -91.000
       TYR 37     0.840   103.199  17.699  19.656  -99.200  -91.000
       PHE 41     1.000   104.396  20.156  26.376  -99.200  -91.000
       PHE 50     1.000   114.556  19.912  25.494  -99.200  -91.000
       TYR 57     0.840   118.952  26.961  15.882  -99.200  -91.000
       HIS 66     0.900   117.068  13.286   8.698  -99.200  -91.000
       TYR 67     0.840   111.895  20.874   7.747  -99.200  -91.000
       TYR 72     0.840   104.450  18.396  13.445  -99.200  -91.000
       TYR 73     0.840   102.450  14.019  15.719  -99.200  -91.000
       TYR 76     0.840   108.275  19.034  15.828  -99.200  -91.000
       PHE 103     1.000   116.886   8.372  17.160  -99.200  -91.000
       PHE 123     1.000   107.551  49.784  16.622  -99.200  -91.000
       TYR 135     0.840   119.436  38.799   4.712  -99.200  -91.000
       HIS 139     0.900   114.008  29.681  16.607  -99.200  -91.000
       TYR 145     0.840   105.478  35.732   4.987  -99.200  -91.000
       HIS 155     0.900    96.677  42.213  20.340  -99.200  -91.000
       TRP 161     1.040   105.150  35.122  25.552  -99.200  -91.000
      TRP6 161     1.020   103.649  36.649  24.558  -99.200  -91.000
       PHE 163     1.000   114.958  38.978  19.641  -99.200  -91.000
       HIS 169     0.900   120.898  29.947  18.507  -99.200  -91.000
       TYR 180     0.840   104.736  45.774  18.973  -99.200  -91.000
       HIS 181     0.900    98.140  39.766  16.814  -99.200  -91.000
       PHE 184     1.000   104.084  42.715   7.062  -99.200  -91.000
       PHE 190     1.000   103.837  36.210  -0.740  -99.200  -91.000
       PHE 204     1.000   109.083  37.316  20.300  -99.200  -91.000
       TYR 207     0.840   112.108  38.769  15.324  -99.200  -91.000