============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. PHE 19 1.000 1.746 19.251 -14.725 -99.200 -91.000 HIS 20 0.900 5.020 13.113 -14.456 -99.200 -91.000 TYR 22 0.840 3.805 11.847 -7.480 -99.200 -91.000 HIS 33 0.900 7.875 2.994 -14.588 -99.200 -91.000 HIS 38 0.900 9.929 6.607 -32.933 -99.200 -91.000 TRP 45 1.040 -4.545 15.400 -24.615 -99.200 -91.000 TRP6 45 1.020 -4.147 14.944 -22.329 -99.200 -91.000 PHE 51 1.000 -11.355 8.830 -14.916 -99.200 -91.000 TYR 57 0.840 -4.286 4.394 -21.622 -99.200 -91.000 HIS 59 0.900 -0.899 -4.939 -21.851 -99.200 -91.000 PHE 60 1.000 -2.491 -8.567 -16.806 -99.200 -91.000 PHE 69 1.000 -16.915 10.171 -18.252 -99.200 -91.000 PHE 105 1.000 -5.283 6.246 -12.316 -99.200 -91.000 HIS 112 0.900 -4.457 -3.615 -6.010 -99.200 -91.000 TYR 117 0.840 -1.202 3.548 -8.813 -99.200 -91.000 HIS 124 0.900 6.005 16.033 -21.426 -99.200 -91.000 PHE 126 1.000 11.048 15.782 -26.442 -99.200 -91.000 TRP 133 1.040 10.618 12.057 -30.513 -99.200 -91.000 TRP6 133 1.020 12.161 13.462 -31.634 -99.200 -91.000 TYR 140 0.840 3.957 3.629 -9.172 -99.200 -91.000 PHE 154 1.000 0.570 -6.970 -11.451 -99.200 -91.000