============================================================================= 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. PHE 6 1.000 16.356 3.219 17.057 -99.200 -91.000 PHE 14 1.000 16.974 10.908 22.413 -99.200 -91.000 HIS 27 0.900 0.841 14.943 11.050 -99.200 -91.000 PHE 31 1.000 4.822 7.989 21.659 -99.200 -91.000 PHE 40 1.000 11.243 16.468 15.212 -99.200 -91.000 TYR 101 0.840 10.101 0.723 3.652 -99.200 -91.000 TRP 110 1.040 23.665 7.714 22.050 -99.200 -91.000 TRP6 110 1.020 22.091 6.675 20.638 -99.200 -91.000