============================================================================= 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 24.857 11.090 19.554 -99.200 -91.000 TRP6 6 1.020 27.173 11.262 19.131 -99.200 -91.000 TRP 42 1.040 -0.507 40.360 11.801 -99.200 -91.000 TRP6 42 1.020 0.885 41.546 10.318 -99.200 -91.000 PHE 53 1.000 18.693 41.931 11.629 -99.200 -91.000 TYR 59 0.840 0.208 36.492 14.530 -99.200 -91.000 HIS 69 0.900 6.957 19.180 29.131 -99.200 -91.000 PHE 99 1.000 28.765 22.025 29.012 -99.200 -91.000