=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 14 rings
        ring        int.           center             anis.    iso.
       TYR 15     0.840    28.431  38.314   4.181  -99.200  -91.000
       HIS 21     0.900    29.603  37.111  10.651  -99.200  -91.000
       PHE 31     1.000    18.156  46.959  14.065  -99.200  -91.000
       TYR 32     0.840    19.076  44.553  17.941  -99.200  -91.000
       PHE 44     1.000     6.546  46.059  21.123  -99.200  -91.000
       PHE 45     1.000    13.617  44.806  20.913  -99.200  -91.000
       PHE 60     1.000    16.159  37.721   8.832  -99.200  -91.000
       PHE 61     1.000    19.193  42.692  10.074  -99.200  -91.000
       TYR 71     0.840    17.456  33.339  11.236  -99.200  -91.000
       HIS 80     0.900     9.834  39.536  14.838  -99.200  -91.000
       HIS 88     0.900     4.826  54.496  14.841  -99.200  -91.000
       HIS 89     0.900     4.933  49.070  17.703  -99.200  -91.000
       PHE 90     1.000     8.975  45.847   8.915  -99.200  -91.000
       HIS 96     0.900    15.395  53.803  15.379  -99.200  -91.000