============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 10 rings ring int. center anis. iso. TYR 19 0.840 6.980 26.741 21.454 -99.200 -91.000 HIS 42 0.900 -2.086 18.597 22.052 -99.200 -91.000 PHE 48 1.000 11.489 15.375 16.557 -99.200 -91.000 TRP 58 1.040 5.086 25.323 31.894 -99.200 -91.000 TRP6 58 1.020 5.133 26.725 29.974 -99.200 -91.000 PHE 64 1.000 12.470 24.893 20.217 -99.200 -91.000 TRP 74 1.040 1.754 22.537 15.450 -99.200 -91.000 TRP6 74 1.020 2.561 24.044 13.809 -99.200 -91.000 TRP 78 1.040 2.624 17.415 16.193 -99.200 -91.000 TRP6 78 1.020 1.680 15.768 14.763 -99.200 -91.000