============================================================================= 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 -15.393 16.781 11.791 -99.200 -91.000 PHE 14 1.000 -7.825 19.878 16.749 -99.200 -91.000 PHE 19 1.000 -3.364 9.904 5.994 -99.200 -91.000 PHE 40 1.000 -1.629 20.245 7.978 -99.200 -91.000 PHE 89 1.000 -10.344 6.922 15.593 -99.200 -91.000 TYR 102 0.840 -17.023 13.064 -2.490 -99.200 -91.000 TRP 111 1.040 -11.558 14.569 20.931 -99.200 -91.000 TRP6 111 1.020 -12.664 14.771 18.833 -99.200 -91.000