=============================================================================
          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    99.153 -25.533  76.060  -99.200  -91.000
      TRP6  8     1.020    97.605 -25.175  74.312  -99.200  -91.000
       PHE  9     1.000   102.587 -26.030  72.357  -99.200  -91.000
       TRP 21     1.040    92.978 -44.941  64.377  -99.200  -91.000
      TRP6 21     1.020    92.775 -45.709  62.151  -99.200  -91.000
       TRP 25     1.040    84.409 -39.304  62.750  -99.200  -91.000
      TRP6 25     1.020    84.502 -37.693  64.470  -99.200  -91.000
       TYR 45     0.840   107.423 -26.180  75.651  -99.200  -91.000
       HIS 46     0.900   114.964 -20.654  73.478  -99.200  -91.000
       PHE 49     1.000   110.995 -22.970  68.712  -99.200  -91.000
       HIS 50     0.900   113.288 -28.914  62.636  -99.200  -91.000
       TYR 55     0.840   109.996 -18.542  53.524  -99.200  -91.000
       PHE 70     1.000    98.118 -20.631  62.343  -99.200  -91.000
       PHE 78     1.000    98.408 -43.911  56.727  -99.200  -91.000
       PHE 79     1.000    93.860 -36.606  61.540  -99.200  -91.000
       PHE 88     1.000   107.530 -39.701  59.491  -99.200  -91.000
       TYR 102     0.840   104.600 -22.728  55.921  -99.200  -91.000
       HIS 103     0.900   111.543 -18.768  58.323  -99.200  -91.000
       TRP 106     1.040   109.193 -29.939  67.692  -99.200  -91.000
      TRP6 106     1.020   107.105 -31.040  67.485  -99.200  -91.000
       HIS 121     0.900    93.199 -27.151  58.241  -99.200  -91.000
       PHE 122     1.000    98.321 -21.622  58.216  -99.200  -91.000
       HIS 125     0.900    93.301 -21.481  61.995  -99.200  -91.000
       HIS 141     0.900    88.656 -32.471  55.555  -99.200  -91.000
       HIS 143     0.900    88.316 -37.641  54.528  -99.200  -91.000
       TYR 152     0.840    77.571 -39.799  48.629  -99.200  -91.000
       PHE 161     1.000    73.446 -32.034  54.821  -99.200  -91.000
       TRP 166     1.040    70.026 -26.133  64.027  -99.200  -91.000
      TRP6 166     1.020    68.817 -24.276  63.233  -99.200  -91.000
       PHE 176     1.000    75.070 -28.078  64.594  -99.200  -91.000
       TRP 185     1.040    83.282 -33.248  44.623  -99.200  -91.000
      TRP6 185     1.020    84.803 -32.764  42.887  -99.200  -91.000
       HIS 204     0.900    76.643 -20.911  57.584  -99.200  -91.000
       TRP 209     1.040    85.005 -28.884  51.889  -99.200  -91.000
      TRP6 209     1.020    87.317 -29.337  51.722  -99.200  -91.000
       PHE 211     1.000    78.349 -35.626  46.360  -99.200  -91.000
       HIS 212     0.900    87.024 -34.229  50.789  -99.200  -91.000
       PHE 215     1.000    88.179 -28.087  55.873  -99.200  -91.000
       PHE 225     1.000    86.997 -35.372  68.581  -99.200  -91.000
       TYR 242     0.840    67.066 -38.677  57.054  -99.200  -91.000
       PHE 263     1.000    69.865 -24.154  76.735  -99.200  -91.000