=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 12 rings
        ring        int.           center             anis.    iso.
       PHE 26     1.000    10.871  32.175  80.636  -99.200  -91.000
       PHE 39     1.000     3.653  27.311  82.913  -99.200  -91.000
       HIS 40     0.900    -1.357  29.291  85.189  -99.200  -91.000
       PHE 48     1.000     2.722  22.747  79.297  -99.200  -91.000
       PHE 53     1.000    12.550  29.749  74.547  -99.200  -91.000
       PHE 73     1.000     8.920  33.041  72.184  -99.200  -91.000
       HIS 74     0.900     1.414  36.068  74.144  -99.200  -91.000
       PHE 76     1.000     5.028  31.008  65.954  -99.200  -91.000
       HIS 80     0.900    -0.004  18.173  72.936  -99.200  -91.000
       HIS 107     0.900     3.343  17.827  58.140  -99.200  -91.000
       HIS 115     0.900    20.669  16.811  82.331  -99.200  -91.000
       TYR 116     0.840    20.857  19.647  76.659  -99.200  -91.000