============================================================================= 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 24.872 11.506 19.633 -99.200 -91.000 TRP6 6 1.020 27.212 11.739 19.480 -99.200 -91.000 TRP 42 1.040 -0.937 40.711 13.428 -99.200 -91.000 TRP6 42 1.020 0.391 42.041 12.008 -99.200 -91.000 PHE 53 1.000 18.217 42.440 11.426 -99.200 -91.000 TYR 59 0.840 0.105 36.410 15.551 -99.200 -91.000 HIS 69 0.900 7.174 18.715 29.829 -99.200 -91.000 PHE 99 1.000 29.089 22.118 29.345 -99.200 -91.000