============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. TRP 6 1.040 -3.091 25.580 24.404 -99.200 -91.000 TRP6 6 1.020 -2.824 24.260 26.327 -99.200 -91.000 TRP 42 1.040 27.152 31.354 -1.358 -99.200 -91.000 TRP6 42 1.020 28.269 29.402 -0.738 -99.200 -91.000 PHE 53 1.000 27.663 20.925 15.104 -99.200 -91.000 TYR 59 0.840 22.834 33.132 0.315 -99.200 -91.000 HIS 69 0.900 4.836 42.570 12.927 -99.200 -91.000 PHE 99 1.000 7.982 32.588 32.142 -99.200 -91.000