============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. TYR 4 0.840 20.713 25.789 30.485 -99.200 -91.000 HIS 20 0.900 31.069 28.985 15.512 -99.200 -91.000 TYR 38 0.840 21.854 18.756 22.565 -99.200 -91.000 TRP 44 1.040 22.246 32.114 28.689 -99.200 -91.000 TRP6 44 1.020 24.400 32.769 27.924 -99.200 -91.000 HIS 46 0.900 19.528 32.831 18.162 -99.200 -91.000 HIS 48 0.900 22.188 35.941 28.223 -99.200 -91.000 TYR 50 0.840 28.463 34.942 24.222 -99.200 -91.000 PHE 56 1.000 27.542 33.294 9.848 -99.200 -91.000 PHE 60 1.000 29.420 33.643 3.971 -99.200 -91.000 TYR 69 0.840 34.619 33.624 -4.056 -99.200 -91.000 TRP 99 1.040 25.618 42.052 -5.822 -99.200 -91.000 TRP6 99 1.020 27.090 40.955 -4.336 -99.200 -91.000 TYR 111 0.840 40.045 37.245 -17.594 -99.200 -91.000 PHE 119 1.000 31.386 35.669 -29.451 -99.200 -91.000 PHE 128 1.000 37.527 35.434 -12.882 -99.200 -91.000 TYR 131 0.840 32.349 27.734 -14.024 -99.200 -91.000 TYR 134 0.840 31.072 38.947 -9.304 -99.200 -91.000 TRP 143 1.040 33.369 43.618 -22.148 -99.200 -91.000 TRP6 143 1.020 32.739 41.646 -21.014 -99.200 -91.000