=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 20 rings
        ring        int.           center             anis.    iso.
       HIS  2     0.900     9.600  23.667  -0.422  -99.200  -91.000
       PHE  5     1.000    17.062  24.555   6.150  -99.200  -91.000
       TYR 31     0.840    21.544  25.861  -1.335  -99.200  -91.000
       TRP 34     1.040    28.611  27.070  -5.849  -99.200  -91.000
      TRP6 34     1.020    29.708  25.938  -4.105  -99.200  -91.000
       PHE 41     1.000    22.187  16.107   3.054  -99.200  -91.000
       TYR 44     0.840    17.435  11.883  -4.382  -99.200  -91.000
       PHE 46     1.000    18.010  19.098   4.286  -99.200  -91.000
       HIS 78     0.900    33.128  31.390  14.407  -99.200  -91.000
       PHE 89     1.000    22.667  17.980  12.968  -99.200  -91.000
       PHE 90     1.000    25.795  25.327  16.263  -99.200  -91.000
       HIS 97     0.900    27.442  18.418  21.645  -99.200  -91.000
       PHE 105     1.000    21.868  11.884  -0.449  -99.200  -91.000
       PHE 111     1.000    19.717  14.910   8.155  -99.200  -91.000
       HIS 114     0.900    24.515  12.397  11.946  -99.200  -91.000
       HIS 118     0.900    19.249  17.010  27.301  -99.200  -91.000
       HIS 119     0.900    13.382  14.920  22.440  -99.200  -91.000
       HIS 120     0.900     7.641  18.203  25.865  -99.200  -91.000
       HIS 121     0.900    12.586  21.611  31.178  -99.200  -91.000
       HIS 122     0.900    10.600  14.082  30.297  -99.200  -91.000