=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 41 rings
        ring        int.           center             anis.    iso.
       TRP  8     1.040   112.213 -52.836  59.904  -99.200  -91.000
      TRP6  8     1.020   110.604 -53.199  58.211  -99.200  -91.000
       PHE  9     1.000   112.059 -57.934  60.610  -99.200  -91.000
       TRP 21     1.040    90.733 -57.979  67.573  -99.200  -91.000
      TRP6 21     1.020    89.070 -59.634  67.304  -99.200  -91.000
       TRP 25     1.040    87.997 -54.183  58.346  -99.200  -91.000
      TRP6 25     1.020    89.837 -52.858  57.700  -99.200  -91.000
       TYR 45     0.840   116.617 -58.649  64.518  -99.200  -91.000
       HIS 46     0.900   123.337 -64.900  63.319  -99.200  -91.000
       PHE 49     1.000   117.105 -66.294  61.298  -99.200  -91.000
       HIS 50     0.900   111.788 -72.387  64.438  -99.200  -91.000
       TYR 55     0.840   112.228 -77.241  51.005  -99.200  -91.000
       PHE 70     1.000   107.885 -63.032  50.380  -99.200  -91.000
       PHE 78     1.000    91.114 -67.402  66.647  -99.200  -91.000
       PHE 79     1.000    94.983 -60.818  60.359  -99.200  -91.000
       PHE 88     1.000   100.470 -70.810  68.964  -99.200  -91.000
       TYR 102     0.840   107.435 -72.037  52.693  -99.200  -91.000
       HIS 103     0.900   115.288 -74.531  54.106  -99.200  -91.000
       TRP 106     1.040   111.310 -65.716  65.088  -99.200  -91.000
      TRP6 106     1.020   109.305 -64.504  64.758  -99.200  -91.000
       HIS 121     0.900    98.835 -63.169  51.445  -99.200  -91.000
       PHE 122     1.000   105.421 -66.386  49.592  -99.200  -91.000
       HIS 125     0.900   104.269 -60.271  48.471  -99.200  -91.000
       HIS 141     0.900    91.428 -62.497  52.402  -99.200  -91.000
       HIS 143     0.900    87.528 -63.127  55.943  -99.200  -91.000
       TYR 152     0.840    76.647 -61.434  50.196  -99.200  -91.000
       PHE 161     1.000    81.772 -53.989  44.347  -99.200  -91.000
       TRP 166     1.040    87.512 -44.586  41.333  -99.200  -91.000
      TRP6 166     1.020    87.515 -44.527  38.978  -99.200  -91.000
       PHE 176     1.000    89.853 -47.112  45.601  -99.200  -91.000
       TRP 185     1.040    82.338 -68.038  46.347  -99.200  -91.000
      TRP6 185     1.020    82.771 -70.337  46.028  -99.200  -91.000
       HIS 204     0.900    91.957 -53.635  38.217  -99.200  -91.000
       TRP 209     1.040    89.560 -63.270  46.457  -99.200  -91.000
      TRP6 209     1.020    90.658 -64.808  47.880  -99.200  -91.000
       PHE 211     1.000    78.553 -63.747  46.493  -99.200  -91.000
       HIS 212     0.900    87.099 -65.306  51.193  -99.200  -91.000
       PHE 215     1.000    93.974 -61.959  48.841  -99.200  -91.000
       PHE 225     1.000    94.814 -51.052  58.627  -99.200  -91.000
       TYR 242     0.840    74.664 -48.413  47.279  -99.200  -91.000
       PHE 263     1.000    94.502 -34.247  44.264  -99.200  -91.000