============================================================================= 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 33.013 5.506 11.729 -99.200 -91.000 TRP6 6 1.020 32.461 4.307 13.672 -99.200 -91.000 TRP 42 1.040 10.433 8.120 -20.124 -99.200 -91.000 TRP6 42 1.020 8.605 6.872 -19.271 -99.200 -91.000 PHE 53 1.000 4.732 -1.531 -6.686 -99.200 -91.000 TYR 59 0.840 15.097 9.065 -18.292 -99.200 -91.000 HIS 68 0.900 36.594 8.646 -9.884 -99.200 -91.000 PHE 98 1.000 34.902 -7.078 5.570 -99.200 -91.000