=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 32 rings
        ring        int.           center             anis.    iso.
       TYR  3     0.840   -30.734 -48.007  56.517  -99.200  -91.000
       PHE  4     1.000   -31.079 -42.808  55.880  -99.200  -91.000
       HIS  7     0.900   -41.552 -50.128  64.845  -99.200  -91.000
       PHE 23     1.000   -25.522 -35.049  59.053  -99.200  -91.000
       TYR 32     0.840   -28.543 -16.672  55.802  -99.200  -91.000
       PHE 37     1.000   -35.580 -25.218  57.992  -99.200  -91.000
       PHE 45     1.000   -33.795 -27.005  68.920  -99.200  -91.000
       TYR 46     0.840   -30.132 -23.191  69.457  -99.200  -91.000
       HIS 48     0.900   -37.882 -26.305  73.686  -99.200  -91.000
       HIS 49     0.900   -34.419 -28.163  79.942  -99.200  -91.000
       PHE 51     1.000   -41.426 -32.643  76.499  -99.200  -91.000
       PHE 61     1.000   -53.436 -19.370  80.422  -99.200  -91.000
       TYR 83     0.840   -35.900 -43.371  63.823  -99.200  -91.000
       PHE 84     1.000   -41.838 -43.056  67.139  -99.200  -91.000
       TYR 85     0.840   -40.779 -47.897  60.076  -99.200  -91.000
       PHE 91     1.000   -54.277 -37.535  74.065  -99.200  -91.000
       PHE 99     1.000   -41.970 -42.762  77.464  -99.200  -91.000
       HIS 102     0.900   -37.737 -36.421  79.794  -99.200  -91.000
       TYR 108     0.840   -29.132 -38.169  70.259  -99.200  -91.000
       PHE 116     1.000   -29.666 -36.931  65.541  -99.200  -91.000
       TYR 117     0.840   -37.028 -29.712  62.163  -99.200  -91.000
       TYR 122     0.840   -41.514 -35.331  50.805  -99.200  -91.000
       PHE 123     1.000   -36.316 -29.839  53.925  -99.200  -91.000
       TYR 128     0.840   -38.208 -38.245  52.207  -99.200  -91.000
       HIS 136     0.900   -35.664 -30.840  43.127  -99.200  -91.000
       TYR 137     0.840   -37.881 -27.873  46.110  -99.200  -91.000
       PHE 138     1.000   -34.936 -22.386  46.655  -99.200  -91.000
       HIS 151     0.900   -22.040 -20.089  51.015  -99.200  -91.000
       TYR 170     0.840   -47.581 -24.291  52.466  -99.200  -91.000
       PHE 179     1.000   -44.505 -22.060  49.883  -99.200  -91.000
       TYR 195     0.840   -32.341 -16.862  64.528  -99.200  -91.000
       TYR 201     0.840   -38.832  -7.965  56.697  -99.200  -91.000