=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 31 rings
        ring        int.           center             anis.    iso.
       HIS  6     0.900    38.025 111.106 -27.700  -99.200  -91.000
       PHE 13     1.000    44.026 105.801 -37.889  -99.200  -91.000
       HIS 19     0.900    43.415 101.512 -39.960  -99.200  -91.000
       PHE 21     1.000    41.530 101.443 -29.388  -99.200  -91.000
       PHE 33     1.000    42.049 102.041 -22.869  -99.200  -91.000
       HIS 36     0.900    30.896 101.130 -21.569  -99.200  -91.000
       HIS 46     0.900    31.181 100.281 -28.503  -99.200  -91.000
       HIS 47     0.900    31.889 107.752 -25.948  -99.200  -91.000
       TYR 74     0.840    31.996 105.975 -40.709  -99.200  -91.000
       HIS 79     0.900    33.459  91.419 -35.929  -99.200  -91.000
       TYR 89     0.840    48.267 100.669 -27.632  -99.200  -91.000
       HIS 93     0.900    56.272 105.836 -28.057  -99.200  -91.000
       PHE 96     1.000    46.509 100.399 -22.540  -99.200  -91.000
       TYR 109     0.840    28.997  99.646 -16.717  -99.200  -91.000
       PHE 112     1.000    34.101  97.769 -16.131  -99.200  -91.000
       HIS 123     0.900    45.338  90.322 -20.153  -99.200  -91.000
       PHE 130     1.000    43.077 102.891 -13.908  -99.200  -91.000
       PHE 133     1.000    33.404 113.788 -18.537  -99.200  -91.000
       TRP 141     1.040    42.379 108.338  -2.526  -99.200  -91.000
      TRP6 141     1.020    41.190 108.000  -0.504  -99.200  -91.000
       TRP 150     1.040    36.165 115.141 -11.530  -99.200  -91.000
      TRP6 150     1.020    35.719 117.087 -10.278  -99.200  -91.000
       HIS 172     0.900    35.575 113.908  -3.426  -99.200  -91.000
       HIS 175     0.900    47.138 114.265  -5.782  -99.200  -91.000
       HIS 180     0.900    34.981 120.810 -25.229  -99.200  -91.000
       PHE 198     1.000    43.752 123.585 -17.441  -99.200  -91.000
       TRP 201     1.040    37.801 116.834 -21.182  -99.200  -91.000
      TRP6 201     1.020    35.566 117.079 -21.912  -99.200  -91.000
       HIS 204     0.900    37.939 115.735 -30.732  -99.200  -91.000
       PHE 220     1.000    46.659 118.005 -27.674  -99.200  -91.000
       HIS 235     0.900    53.428 125.704 -29.681  -99.200  -91.000