=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 15 rings
        ring        int.           center             anis.    iso.
       TYR  6     0.840    27.755  -8.612  34.413  -99.200  -91.000
       PHE  8     1.000    18.435  -4.084  31.601  -99.200  -91.000
       HIS 25     0.900    39.737  -5.884  28.616  -99.200  -91.000
       HIS 30     0.900    18.909  -0.058  34.345  -99.200  -91.000
       HIS 41     0.900    30.256  12.331  37.496  -99.200  -91.000
       TYR 42     0.840    35.762  18.420  36.580  -99.200  -91.000
       TYR 46     0.840    38.505   9.158  26.341  -99.200  -91.000
       HIS 48     0.900    30.490   6.740  23.629  -99.200  -91.000
       HIS 65     0.900    23.782  21.704  25.024  -99.200  -91.000
       TYR 67     0.840    21.702  15.713  24.118  -99.200  -91.000
       TYR 74     0.840    32.986  11.225  23.309  -99.200  -91.000
       PHE 77     1.000    40.296  11.125  31.336  -99.200  -91.000
       PHE 92     1.000    21.356   7.818  32.621  -99.200  -91.000
       PHE 93     1.000    21.065  -0.205  29.819  -99.200  -91.000
       HIS 99     0.900    38.265   0.163  35.859  -99.200  -91.000