============================================================================= 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 16.341 31.748 33.939 -99.200 -91.000 TRP6 6 1.020 14.037 32.140 33.657 -99.200 -91.000 TRP 42 1.040 41.559 29.461 4.258 -99.200 -91.000 TRP6 42 1.020 40.167 30.343 2.579 -99.200 -91.000 PHE 53 1.000 22.090 29.734 1.956 -99.200 -91.000 TYR 59 0.840 40.709 28.181 8.831 -99.200 -91.000 HIS 69 0.900 33.997 20.373 29.695 -99.200 -91.000 PHE 99 1.000 12.329 18.836 27.587 -99.200 -91.000