=============================================================================
          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    46.176  24.393  -6.162  -99.200  -91.000
       TRP 19     1.040    19.048   5.382   6.685  -99.200  -91.000
      TRP6 19     1.020    19.407   5.965   8.986  -99.200  -91.000
       HIS 22     0.900    28.183   4.736  -1.529  -99.200  -91.000
       PHE 24     1.000    31.364  -1.032   5.435  -99.200  -91.000
       HIS 40     0.900    37.215  19.014  11.254  -99.200  -91.000
       PHE 43     1.000    31.721  17.614  17.335  -99.200  -91.000
       PHE 52     1.000    28.070  23.246  22.745  -99.200  -91.000
       TYR 62     0.840    37.728  12.688  22.595  -99.200  -91.000
       HIS 69     0.900    42.833   4.753  23.323  -99.200  -91.000
       TYR 70     0.840    35.392   2.934  18.649  -99.200  -91.000
       HIS 71     0.900    40.425  -3.412  20.993  -99.200  -91.000
       TYR 76     0.840    28.667  -4.561  13.736  -99.200  -91.000
       HIS 77     0.900    30.316  -4.804  18.359  -99.200  -91.000
       HIS 81     0.900    28.665  -0.317  15.272  -99.200  -91.000
       HIS 90     0.900    24.659  15.084  10.742  -99.200  -91.000
       PHE 102     1.000    16.102  15.975  20.799  -99.200  -91.000
       PHE 112     1.000    32.044  12.631  24.150  -99.200  -91.000
       HIS 117     0.900    28.135   2.920  19.776  -99.200  -91.000
       HIS 121     0.900    32.595  -4.847  21.580  -99.200  -91.000
       PHE 128     1.000    34.793 -14.882  25.616  -99.200  -91.000
       TYR 140     0.840    33.070  -1.117  34.623  -99.200  -91.000
       HIS 149     0.900    36.785  -0.626  29.190  -99.200  -91.000
       HIS 150     0.900    32.135  -0.076  24.810  -99.200  -91.000
       PHE 155     1.000    32.027  11.235  29.751  -99.200  -91.000
       PHE 166     1.000    32.684  17.171  25.774  -99.200  -91.000
       HIS 193     0.900    15.272  -4.155  21.604  -99.200  -91.000
       TYR 220     0.840    17.650  14.529  31.465  -99.200  -91.000
       HIS 232     0.900    18.351  -0.016  21.212  -99.200  -91.000
       TYR 246     0.840    20.873  -6.178   6.411  -99.200  -91.000
       TRP 249     1.040    27.145  -1.914   8.201  -99.200  -91.000
      TRP6 249     1.020    29.128  -1.338   9.365  -99.200  -91.000
       PHE 257     1.000    27.564 -12.140  17.211  -99.200  -91.000
       PHE 258     1.000    30.651 -17.697  11.747  -99.200  -91.000
       HIS 278     0.900    33.716 -25.837  12.200  -99.200  -91.000
       PHE 289     1.000    19.832  -7.655  14.189  -99.200  -91.000
       TYR 292     0.840    12.041 -13.718  16.173  -99.200  -91.000
       HIS 295     0.900     8.802  -4.396  10.949  -99.200  -91.000
       TRP 298     1.040    15.104   0.847  12.762  -99.200  -91.000
      TRP6 298     1.020    15.562   3.136  12.371  -99.200  -91.000
       TRP 301     1.040    12.896   6.739  14.720  -99.200  -91.000
      TRP6 301     1.020    13.749   7.957  16.583  -99.200  -91.000
       HIS 306     0.900     2.433   8.856  10.159  -99.200  -91.000
       TRP 322     1.040    18.709  -9.871  -1.542  -99.200  -91.000
      TRP6 322     1.020    20.559 -10.796  -0.373  -99.200  -91.000
       TYR 323     0.840    20.677 -10.869   4.649  -99.200  -91.000