============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. PHE 11 1.000 30.838 -2.861 35.165 -99.200 -91.000 PHE 27 1.000 25.971 -0.414 31.892 -99.200 -91.000 TRP 31 1.040 14.716 -5.404 24.891 -99.200 -91.000 TRP6 31 1.020 14.443 -3.179 25.597 -99.200 -91.000 PHE 41 1.000 30.923 6.770 16.015 -99.200 -91.000 PHE 42 1.000 30.952 0.985 22.780 -99.200 -91.000 HIS 43 0.900 34.200 -3.675 16.213 -99.200 -91.000 TYR 49 0.840 39.273 7.709 20.301 -99.200 -91.000 PHE 54 1.000 36.053 2.252 22.947 -99.200 -91.000 PHE 77 1.000 26.975 4.753 24.378 -99.200 -91.000 PHE 79 1.000 31.637 7.906 28.449 -99.200 -91.000 PHE 80 1.000 32.245 2.937 35.075 -99.200 -91.000 PHE 89 1.000 26.491 9.853 25.918 -99.200 -91.000