============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 45 rings ring int. center anis. iso. TYR 5 0.840 -1.078 4.818 26.419 -99.200 -91.000 PHE 23 1.000 1.637 -16.707 3.521 -99.200 -91.000 TYR 33 0.840 -11.906 -15.786 14.875 -99.200 -91.000 TYR 43 0.840 5.015 -20.486 11.974 -99.200 -91.000 PHE 47 1.000 12.581 -19.554 5.307 -99.200 -91.000 PHE 49 1.000 14.869 -17.102 9.375 -99.200 -91.000 TRP 59 1.040 15.900 -6.208 -4.239 -99.200 -91.000 TRP6 59 1.020 15.187 -5.192 -6.255 -99.200 -91.000 PHE 86 1.000 4.285 -16.892 8.319 -99.200 -91.000 HIS 95 0.900 -11.152 -2.900 17.215 -99.200 -91.000 TRP 130 1.040 1.578 -7.892 25.019 -99.200 -91.000 TRP6 130 1.020 1.359 -9.880 26.299 -99.200 -91.000 HIS 133 0.900 8.701 -12.007 26.085 -99.200 -91.000 PHE 137 1.000 16.485 -13.068 11.241 -99.200 -91.000 PHE 151 1.000 15.756 -7.543 3.407 -99.200 -91.000 HIS 162 0.900 -7.785 3.195 19.595 -99.200 -91.000 HIS 163 0.900 -6.148 3.212 24.081 -99.200 -91.000 TYR 168 0.840 9.473 -7.982 28.696 -99.200 -91.000 TYR 170 0.840 17.899 -9.585 19.587 -99.200 -91.000 TYR 172 0.840 19.105 -10.349 14.956 -99.200 -91.000 TYR 174 0.840 13.686 -4.940 10.197 -99.200 -91.000 TYR 182 0.840 0.283 7.395 5.431 -99.200 -91.000 TYR 196 0.840 6.822 1.910 20.328 -99.200 -91.000 HIS 197 0.900 6.819 -2.998 28.701 -99.200 -91.000 HIS 198 0.900 10.943 -4.118 30.676 -99.200 -91.000 PHE 201 1.000 13.799 -0.973 19.977 -99.200 -91.000 PHE 213 1.000 0.221 13.773 12.737 -99.200 -91.000 HIS 217 0.900 5.636 4.920 29.862 -99.200 -91.000 TYR 219 0.840 7.935 1.018 30.702 -99.200 -91.000 TYR 222 0.840 21.439 -2.809 25.192 -99.200 -91.000 PHE 223 1.000 16.446 2.915 22.399 -99.200 -91.000 TYR 245 0.840 22.825 0.471 29.513 -99.200 -91.000 PHE 246 1.000 18.295 6.275 24.933 -99.200 -91.000 TYR 263 0.840 6.551 19.840 20.873 -99.200 -91.000 TRP 264 1.040 12.887 15.483 23.833 -99.200 -91.000 TRP6 264 1.020 13.133 15.717 21.492 -99.200 -91.000 TYR 270 0.840 23.893 3.731 32.266 -99.200 -91.000 TRP 277 1.040 23.998 14.129 20.470 -99.200 -91.000 TRP6 277 1.020 21.693 13.665 20.707 -99.200 -91.000 TYR 286 0.840 18.921 19.917 13.519 -99.200 -91.000 TRP 292 1.040 20.847 12.990 27.039 -99.200 -91.000 TRP6 292 1.020 19.670 11.129 26.159 -99.200 -91.000 PHE 298 1.000 2.159 10.788 28.142 -99.200 -91.000 TYR 304 0.840 0.514 2.546 30.837 -99.200 -91.000 TYR 306 0.840 5.102 3.360 34.202 -99.200 -91.000