============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. TYR 10 0.840 39.092 7.386 31.994 -99.200 -91.000 PHE 11 1.000 31.464 5.024 36.081 -99.200 -91.000 TYR 33 0.840 38.360 14.266 36.383 -99.200 -91.000 TYR 41 0.840 29.424 2.150 40.715 -99.200 -91.000 TRP 48 1.040 23.784 -7.834 32.940 -99.200 -91.000 TRP6 48 1.020 26.014 -7.449 32.276 -99.200 -91.000 PHE 72 1.000 43.193 25.465 41.335 -99.200 -91.000 HIS 73 0.900 42.440 27.649 36.908 -99.200 -91.000 TYR 77 0.840 41.683 20.773 30.401 -99.200 -91.000 PHE 81 1.000 36.490 14.491 22.227 -99.200 -91.000 PHE 84 1.000 28.294 8.071 28.483 -99.200 -91.000 TRP 87 1.040 26.877 1.017 33.730 -99.200 -91.000 TRP6 87 1.020 27.243 1.591 35.997 -99.200 -91.000 TRP 88 1.040 20.415 -1.546 33.765 -99.200 -91.000 TRP6 88 1.020 19.286 -3.450 32.955 -99.200 -91.000 TYR 89 0.840 18.647 -0.937 27.191 -99.200 -91.000 PHE 98 1.000 32.871 15.512 34.515 -99.200 -91.000 TYR 102 0.840 33.770 20.185 37.573 -99.200 -91.000 PHE 104 1.000 31.552 20.725 32.683 -99.200 -91.000 PHE 112 1.000 35.012 8.840 25.352 -99.200 -91.000 HIS 128 0.900 21.985 15.641 22.373 -99.200 -91.000 TYR 131 0.840 22.908 17.539 32.622 -99.200 -91.000 TRP 136 1.040 24.543 18.335 25.246 -99.200 -91.000 TRP6 136 1.020 25.864 16.851 26.520 -99.200 -91.000 TRP 154 1.040 33.592 12.407 16.844 -99.200 -91.000 TRP6 154 1.020 34.431 11.214 18.669 -99.200 -91.000 PHE 155 1.000 38.836 16.644 17.350 -99.200 -91.000