============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. TRP 9 1.040 27.493 45.745 -17.716 -99.200 -91.000 TRP6 9 1.020 25.428 46.363 -18.716 -99.200 -91.000 TYR 16 0.840 10.660 60.829 -16.836 -99.200 -91.000 TRP 20 1.040 18.204 50.561 -6.674 -99.200 -91.000 TRP6 20 1.020 19.962 52.122 -6.645 -99.200 -91.000 TYR 24 0.840 29.780 49.148 -20.301 -99.200 -91.000 PHE 25 1.000 25.781 56.086 -16.717 -99.200 -91.000 PHE 33 1.000 29.085 58.537 -15.171 -99.200 -91.000 TYR 36 0.840 26.458 54.420 -24.667 -99.200 -91.000 TYR 47 0.840 19.640 56.009 -31.806 -99.200 -91.000 PHE 52 1.000 24.901 62.055 -15.738 -99.200 -91.000 PHE 70 1.000 28.772 55.862 -8.337 -99.200 -91.000 TRP 77 1.040 22.778 67.626 -13.352 -99.200 -91.000 TRP6 77 1.020 23.751 65.718 -12.386 -99.200 -91.000 PHE 85 1.000 24.965 57.003 -11.391 -99.200 -91.000 HIS 86 0.900 22.896 49.142 -6.311 -99.200 -91.000 TRP 96 1.040 31.904 53.316 -11.606 -99.200 -91.000 TRP6 96 1.020 32.021 54.192 -13.789 -99.200 -91.000