============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. HIS 34 0.900 10.919 14.615 6.917 -99.200 -91.000 PHE 41 1.000 15.315 26.329 10.857 -99.200 -91.000 PHE 54 1.000 13.515 14.847 11.641 -99.200 -91.000 TRP 62 1.040 10.956 26.476 3.660 -99.200 -91.000 TRP6 62 1.020 11.366 26.553 5.994 -99.200 -91.000 TYR 65 0.840 9.286 32.963 0.560 -99.200 -91.000 HIS 66 0.900 8.828 30.260 4.818 -99.200 -91.000 TRP 78 1.040 4.092 28.063 18.991 -99.200 -91.000 TRP6 78 1.020 4.760 26.621 20.788 -99.200 -91.000 HIS 84 0.900 -5.218 19.266 21.874 -99.200 -91.000 TYR 85 0.840 0.281 16.671 24.936 -99.200 -91.000 TYR 96 0.840 24.109 1.767 23.612 -99.200 -91.000