=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 43 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900   100.689 230.996 103.867  -99.200  -91.000
       HIS  7     0.900    98.936 235.001 108.311  -99.200  -91.000
       PHE 14     1.000    97.884 233.214 124.269  -99.200  -91.000
       TYR 20     0.840   105.089 247.557 110.015  -99.200  -91.000
       PHE 54     1.000    87.403 275.318 106.640  -99.200  -91.000
       HIS 56     0.900    79.251 271.905 112.402  -99.200  -91.000
       HIS 59     0.900    87.333 281.709 105.743  -99.200  -91.000
       TYR 61     0.840    86.819 276.551 115.940  -99.200  -91.000
       HIS 62     0.900    87.312 275.671 110.639  -99.200  -91.000
       PHE 96     1.000    64.039 271.855 115.625  -99.200  -91.000
       TYR 110     0.840    51.459 272.796 108.763  -99.200  -91.000
       PHE 117     1.000    58.003 280.344 110.989  -99.200  -91.000
       PHE 126     1.000    61.137 270.871 111.232  -99.200  -91.000
       TYR 127     0.840    65.520 278.208 107.133  -99.200  -91.000
       TYR 130     0.840    67.086 272.165  97.723  -99.200  -91.000
       TYR 142     0.840    58.489 258.176 102.551  -99.200  -91.000
       TYR 144     0.840    64.937 258.900 104.221  -99.200  -91.000
       HIS 157     0.900    54.056 271.970  97.207  -99.200  -91.000
       HIS 171     0.900    64.850 259.297 119.466  -99.200  -91.000
       PHE 201     1.000    91.291 280.225 106.247  -99.200  -91.000
       PHE 211     1.000    90.205 264.492 104.869  -99.200  -91.000
       PHE 214     1.000    76.897 265.527 101.751  -99.200  -91.000
       HIS 244     0.900    71.491 255.928  94.786  -99.200  -91.000
       TYR 306     0.840    78.250 257.966 124.235  -99.200  -91.000
       PHE 323     1.000    91.679 241.844 110.625  -99.200  -91.000
       TYR 340     0.840    86.734 259.347 129.210  -99.200  -91.000
       TYR 347     0.840    90.575 250.145 124.058  -99.200  -91.000
       TYR 362     0.840   103.173 236.073  98.738  -99.200  -91.000
       PHE 364     1.000    95.313 244.110 101.257  -99.200  -91.000
       PHE 365     1.000   104.267 241.620  95.980  -99.200  -91.000
       HIS 373     0.900    96.954 246.077  80.209  -99.200  -91.000
       TYR 391     0.840   106.067 240.245 100.816  -99.200  -91.000
       TYR 414     0.840   102.330 246.996  93.244  -99.200  -91.000
       PHE 443     1.000   112.708 269.028 105.466  -99.200  -91.000
       PHE 444     1.000   119.392 265.238 102.802  -99.200  -91.000
       HIS 451     0.900   122.765 272.146  96.178  -99.200  -91.000
       TRP 453     1.040   124.301 268.122  93.151  -99.200  -91.000
      TRP6 453     1.020   122.102 268.878  92.675  -99.200  -91.000
       HIS 457     0.900   126.034 263.221 101.876  -99.200  -91.000
       PHE 465     1.000   112.109 257.285 110.774  -99.200  -91.000
       TYR 471     0.840   110.786 250.829 111.724  -99.200  -91.000
       TYR 477     0.840   120.134 240.461 102.974  -99.200  -91.000
       HIS 482     0.900   115.277 258.140  91.853  -99.200  -91.000