=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 46 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    14.120  -3.403   9.486  -99.200  -91.000
       HIS  2     0.900     6.509   1.372   7.934  -99.200  -91.000
       TRP  3     1.040     4.952   0.661  11.691  -99.200  -91.000
      TRP6  3     1.020     2.975  -0.631  11.857  -99.200  -91.000
       TYR  5     0.840     1.101  -6.053  12.301  -99.200  -91.000
       HIS  8     0.900    14.423 -10.842  10.196  -99.200  -91.000
       HIS 13     0.900    12.876  -6.828  15.666  -99.200  -91.000
       TRP 14     1.040     6.072  -2.934  15.929  -99.200  -91.000
      TRP6 14     1.020     3.772  -3.296  16.339  -99.200  -91.000
       HIS 15     0.900    12.503  -2.436  22.215  -99.200  -91.000
       PHE 18     1.000     7.219   4.050  16.139  -99.200  -91.000
       HIS 34     0.900   -14.165 -16.075  36.164  -99.200  -91.000
       TYR 38     0.840   -22.580  -3.100  37.215  -99.200  -91.000
       TYR 49     0.840   -20.944   3.818  14.593  -99.200  -91.000
       HIS 62     0.900     1.831  -1.138   8.377  -99.200  -91.000
       PHE 64     1.000   -10.184  -4.219   5.174  -99.200  -91.000
       PHE 68     1.000   -17.242   5.364   8.205  -99.200  -91.000
       TYR 86     0.840   -14.155  10.310  23.052  -99.200  -91.000
       PHE 91     1.000   -15.318  -0.173   8.864  -99.200  -91.000
       HIS 92     0.900    -7.983  -0.333  12.414  -99.200  -91.000
       PHE 93     1.000   -13.078  -5.597   9.778  -99.200  -91.000
       HIS 94     0.900    -5.507  -4.683  14.337  -99.200  -91.000
       TRP 95     1.040    -6.640 -10.558   8.171  -99.200  -91.000
      TRP6 95     1.020    -6.865  -8.259   7.654  -99.200  -91.000
       HIS 105     0.900    -8.235  -5.091  23.170  -99.200  -91.000
       TYR 112     0.840   -13.627 -13.965  20.593  -99.200  -91.000
       HIS 117     0.900    -8.861  -2.711  17.021  -99.200  -91.000
       HIS 120     0.900   -15.786   5.663  17.433  -99.200  -91.000
       TRP 121     1.040   -11.899  12.844  15.223  -99.200  -91.000
      TRP6 121     1.020   -12.627  15.071  15.547  -99.200  -91.000
       TYR 125     0.840    -8.799  16.877  23.712  -99.200  -91.000
       PHE 128     1.000    -6.514  10.304  14.573  -99.200  -91.000
       PHE 144     1.000   -12.795  -9.744  21.456  -99.200  -91.000
       PHE 173     1.000   -16.653   0.180   1.134  -99.200  -91.000
       PHE 176     1.000   -19.762  -0.964   5.400  -99.200  -91.000
       TYR 188     0.840   -19.134  -0.566  27.979  -99.200  -91.000
       TRP 189     1.040   -15.225  -7.341  29.896  -99.200  -91.000
      TRP6 189     1.020   -15.509  -8.923  28.163  -99.200  -91.000
       TYR 191     0.840    -7.743  -1.766  27.932  -99.200  -91.000
       TRP 206     1.040    -7.981   0.302  23.513  -99.200  -91.000
      TRP6 206     1.020    -8.488  -0.606  21.391  -99.200  -91.000
       PHE 223     1.000   -11.746  -9.226   6.524  -99.200  -91.000
       PHE 228     1.000     1.133  -7.911   6.294  -99.200  -91.000
       TRP 242     1.040    -2.429 -11.716  15.334  -99.200  -91.000
      TRP6 242     1.020    -1.488 -12.670  17.289  -99.200  -91.000
       PHE 257     1.000   -20.469  -7.915  31.114  -99.200  -91.000