=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 44 rings
        ring        int.           center             anis.    iso.
       PHE  4     1.000    44.529 168.136  23.301  -99.200  -91.000
       TYR  9     0.840    46.231 173.345  23.147  -99.200  -91.000
       HIS 16     0.900    44.893 180.396  31.276  -99.200  -91.000
       TYR 29     0.840    58.079 191.588  26.172  -99.200  -91.000
       PHE 37     1.000    56.697 175.902  13.541  -99.200  -91.000
       HIS 41     0.900    56.349 162.451  24.943  -99.200  -91.000
       PHE 49     1.000    49.385 169.009  21.425  -99.200  -91.000
       HIS 79     0.900    80.821 177.686  14.280  -99.200  -91.000
       TYR 89     0.840    71.167 175.676  19.873  -99.200  -91.000
       PHE 100     1.000    57.178 180.815  14.736  -99.200  -91.000
       PHE 105     1.000    51.995 182.607  13.653  -99.200  -91.000
       HIS 109     0.900    61.723 193.817  17.348  -99.200  -91.000
       PHE 125     1.000    72.784 185.338  13.766  -99.200  -91.000
       HIS 139     0.900    68.495 191.704  25.737  -99.200  -91.000
       TYR 145     0.840    69.372 186.311  35.719  -99.200  -91.000
       PHE 158     1.000    66.753 192.069  33.842  -99.200  -91.000
       TYR 163     0.840    61.920 198.181  24.476  -99.200  -91.000
       TYR 191     0.840    65.122 197.963  34.132  -99.200  -91.000
       HIS 192     0.900    65.573 197.846  28.670  -99.200  -91.000
       HIS 194     0.900    56.608 197.280  34.573  -99.200  -91.000
       TYR 202     0.840    58.296 184.841  32.404  -99.200  -91.000
       PHE 205     1.000    52.087 176.907  25.264  -99.200  -91.000
       PHE 208     1.000    53.089 166.704  27.383  -99.200  -91.000
       TRP 211     1.040    47.801 173.640  35.224  -99.200  -91.000
      TRP6 211     1.020    46.084 174.121  36.782  -99.200  -91.000
       HIS 217     0.900    46.508 161.189  33.587  -99.200  -91.000
       TYR 223     0.840    58.219 166.400  31.358  -99.200  -91.000
       HIS 238     0.900    58.051 173.881  47.845  -99.200  -91.000
       PHE 239     1.000    58.145 177.548  45.854  -99.200  -91.000
       HIS 240     0.900    48.743 176.519  42.820  -99.200  -91.000
       TYR 244     0.840    46.922 180.079  45.277  -99.200  -91.000
       TYR 251     0.840    59.742 171.808  34.901  -99.200  -91.000
       PHE 258     1.000    57.436 181.064  42.314  -99.200  -91.000
       TYR 274     0.840    52.849 184.961  37.232  -99.200  -91.000
       HIS 297     0.900    45.997 151.169  25.644  -99.200  -91.000
       TYR 307     0.840    62.703 148.775  30.313  -99.200  -91.000
       PHE 308     1.000    61.276 146.651  25.399  -99.200  -91.000
       HIS 390     0.900    44.933 139.405   9.424  -99.200  -91.000
       HIS 399     0.900    54.692 130.189  -1.610  -99.200  -91.000
       HIS 416     0.900    77.725 140.076 -10.010  -99.200  -91.000
       HIS 425     0.900    69.544 142.759   4.801  -99.200  -91.000
       HIS 459     0.900    60.147 143.871  21.483  -99.200  -91.000
       PHE 472     1.000    60.076 147.591  10.243  -99.200  -91.000
       PHE 485     1.000    74.477 145.229  19.031  -99.200  -91.000