============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 24 0.840 30.629 26.223 10.536 -99.200 -91.000 TRP 34 1.040 36.195 41.333 7.563 -99.200 -91.000 TRP6 34 1.020 34.569 42.763 8.498 -99.200 -91.000 HIS 36 0.900 33.479 37.318 -2.343 -99.200 -91.000 PHE 38 1.000 32.097 40.701 -6.134 -99.200 -91.000 TRP 40 1.040 33.962 46.902 -1.829 -99.200 -91.000 TRP6 40 1.020 32.701 48.815 -2.401 -99.200 -91.000 PHE 42 1.000 26.919 43.671 1.007 -99.200 -91.000 TYR 56 0.840 19.873 51.389 3.557 -99.200 -91.000 TYR 57 0.840 19.926 53.661 7.833 -99.200 -91.000 TYR 77 0.840 23.801 41.510 21.072 -99.200 -91.000 TYR 78 0.840 24.856 37.028 17.411 -99.200 -91.000 TRP 79 1.040 20.564 31.260 24.887 -99.200 -91.000 TRP6 79 1.020 21.454 31.409 27.063 -99.200 -91.000 PHE 88 1.000 26.623 36.312 8.731 -99.200 -91.000 PHE 92 1.000 23.706 37.590 2.771 -99.200 -91.000 TYR 96 0.840 19.431 39.805 -2.009 -99.200 -91.000 TYR 98 0.840 17.993 52.006 -0.856 -99.200 -91.000 PHE 116 1.000 24.207 32.940 5.889 -99.200 -91.000