============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 7 rings ring int. center anis. iso. PHE 13 1.000 15.171 13.178 36.573 -99.200 -91.000 PHE 47 1.000 20.702 16.550 30.404 -99.200 -91.000 PHE 50 1.000 15.635 13.561 31.491 -99.200 -91.000 TYR 86 0.840 10.783 12.479 31.548 -99.200 -91.000 TYR 90 0.840 17.606 12.042 27.001 -99.200 -91.000 TRP 109 1.040 15.559 2.667 23.988 -99.200 -91.000 TRP6 109 1.020 13.410 2.501 22.996 -99.200 -91.000