============================================================================= 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 0.701 17.961 19.404 -99.200 -91.000 TRP6 6 1.020 -1.635 17.905 19.081 -99.200 -91.000 TRP 42 1.040 26.322 -11.475 13.397 -99.200 -91.000 TRP6 42 1.020 25.068 -12.909 12.005 -99.200 -91.000 PHE 53 1.000 7.163 -13.309 11.964 -99.200 -91.000 TYR 59 0.840 25.509 -7.296 15.741 -99.200 -91.000 HIS 69 0.900 18.172 10.064 30.477 -99.200 -91.000 PHE 99 1.000 -3.759 7.409 29.344 -99.200 -91.000