============================================================================= 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. PHE 6 1.000 22.947 -11.189 10.803 -99.200 -91.000 PHE 14 1.000 30.447 -12.836 5.106 -99.200 -91.000 PHE 19 1.000 35.045 -6.266 18.177 -99.200 -91.000 PHE 40 1.000 36.639 -15.257 13.296 -99.200 -91.000 PHE 89 1.000 28.064 -0.737 9.955 -99.200 -91.000 TYR 102 0.840 21.546 -11.178 25.838 -99.200 -91.000 TRP 111 1.040 26.569 -6.630 2.645 -99.200 -91.000 TRP6 111 1.020 25.455 -7.376 4.600 -99.200 -91.000