=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 21 rings
        ring        int.           center             anis.    iso.
       TYR 12     0.840    35.486   4.828   9.882  -99.200  -91.000
       HIS 16     0.900    31.403  14.102   9.677  -99.200  -91.000
       PHE 29     1.000    28.920   4.200  14.842  -99.200  -91.000
       PHE 38     1.000    27.216  -8.997   8.563  -99.200  -91.000
       HIS 39     0.900    31.342  -2.699   9.030  -99.200  -91.000
       TYR 43     0.840    28.927   0.391  -3.475  -99.200  -91.000
       TYR 44     0.840    20.105   4.844  -8.319  -99.200  -91.000
       PHE 54     1.000    23.636  -5.596   9.431  -99.200  -91.000
       HIS 55     0.900    28.225  -5.186  17.524  -99.200  -91.000
       HIS 59     0.900    18.936  -5.100  24.994  -99.200  -91.000
       TYR 68     0.840    25.622 -11.414  14.305  -99.200  -91.000
       TYR 78     0.840    21.746   8.818  -4.675  -99.200  -91.000
       HIS 90     0.900    23.767  -9.454   0.778  -99.200  -91.000
       TRP 104     1.040    20.196  -6.390  19.694  -99.200  -91.000
      TRP6 104     1.020    21.100  -4.420  20.681  -99.200  -91.000
       TYR 114     0.840    14.577   1.255   7.177  -99.200  -91.000
       TYR 115     0.840    15.335   0.347  11.922  -99.200  -91.000
       PHE 120     1.000    14.333  -4.754  12.508  -99.200  -91.000
       PHE 127     1.000    17.362   4.011  24.483  -99.200  -91.000
       HIS 135     0.900    19.016   6.938  19.320  -99.200  -91.000
       TYR 138     0.840    11.691  -7.934  19.490  -99.200  -91.000