============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 26 rings ring int. center anis. iso. PHE 9 1.000 17.238 18.405 19.557 -99.200 -91.000 PHE 17 1.000 18.561 23.816 18.192 -99.200 -91.000 HIS 42 0.900 27.937 13.605 24.830 -99.200 -91.000 TYR 46 0.840 31.201 16.768 22.098 -99.200 -91.000 HIS 50 0.900 25.592 16.108 9.237 -99.200 -91.000 TRP 84 1.040 3.575 20.869 20.723 -99.200 -91.000 TRP6 84 1.020 5.920 20.882 21.108 -99.200 -91.000 PHE 99 1.000 3.920 9.933 17.883 -99.200 -91.000 HIS 108 0.900 3.056 16.969 17.748 -99.200 -91.000 TYR 138 0.840 0.375 26.340 3.910 -99.200 -91.000 HIS 143 0.900 -3.757 22.626 2.149 -99.200 -91.000 HIS 144 0.900 -5.217 24.422 9.472 -99.200 -91.000 PHE 159 1.000 16.699 14.121 -10.939 -99.200 -91.000 HIS 164 0.900 5.983 15.731 -17.500 -99.200 -91.000 PHE 167 1.000 14.956 18.035 -22.066 -99.200 -91.000 HIS 178 0.900 18.702 6.664 1.923 -99.200 -91.000 TYR 180 0.840 24.930 3.113 8.396 -99.200 -91.000 HIS 191 0.900 12.630 -3.062 9.489 -99.200 -91.000 TYR 274 0.840 25.205 21.029 -14.553 -99.200 -91.000 TYR 284 0.840 27.680 16.167 -3.886 -99.200 -91.000 TRP 311 1.040 26.548 13.183 -6.088 -99.200 -91.000 TRP6 311 1.020 27.286 11.193 -5.032 -99.200 -91.000 TYR 312 0.840 18.966 11.653 -1.758 -99.200 -91.000 TYR 318 0.840 12.751 15.718 4.781 -99.200 -91.000 HIS 320 0.900 20.171 23.320 6.006 -99.200 -91.000 TYR 328 0.840 5.347 28.991 0.818 -99.200 -91.000