============================================================================= 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 28.730 7.672 17.263 -99.200 -91.000 PHE 14 1.000 35.269 4.888 24.009 -99.200 -91.000 PHE 19 1.000 36.740 -3.596 11.112 -99.200 -91.000 PHE 40 1.000 42.926 3.179 16.196 -99.200 -91.000 PHE 89 1.000 27.028 -3.937 18.585 -99.200 -91.000 TYR 102 0.840 29.290 7.814 2.064 -99.200 -91.000 TRP 111 1.040 28.290 2.142 25.780 -99.200 -91.000 TRP6 111 1.020 27.969 3.278 23.716 -99.200 -91.000