============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. TRP 3 1.040 -5.507 9.630 0.329 -99.200 -91.000 TRP6 3 1.020 -3.661 8.431 1.186 -99.200 -91.000 PHE 11 1.000 5.734 0.210 -3.722 -99.200 -91.000 PHE 18 1.000 8.835 0.499 7.457 -99.200 -91.000 TYR 29 0.840 -2.374 -2.333 17.640 -99.200 -91.000 PHE 34 1.000 2.838 -9.430 5.319 -99.200 -91.000 TYR 47 0.840 2.715 17.869 -4.147 -99.200 -91.000 PHE 52 1.000 16.576 26.549 -4.954 -99.200 -91.000 TYR 58 0.840 6.088 9.635 -4.339 -99.200 -91.000 TYR 60 0.840 3.542 4.181 -1.051 -99.200 -91.000 TYR 63 0.840 -8.382 -1.498 4.479 -99.200 -91.000 TYR 65 0.840 -6.938 -9.884 6.551 -99.200 -91.000 PHE 71 1.000 -3.908 -5.304 13.458 -99.200 -91.000 TYR 79 0.840 11.557 12.559 -5.571 -99.200 -91.000 PHE 89 1.000 -0.271 -1.934 12.713 -99.200 -91.000