============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. HIS 11 0.900 15.872 -67.929 -18.489 -99.200 -91.000 TYR 20 0.840 12.666 -56.627 -34.617 -99.200 -91.000 TYR 25 0.840 16.451 -51.252 -37.467 -99.200 -91.000 HIS 26 0.900 21.302 -55.769 -42.596 -99.200 -91.000 PHE 35 1.000 31.778 -59.840 -24.508 -99.200 -91.000 PHE 40 1.000 36.267 -52.665 -11.757 -99.200 -91.000 TYR 72 0.840 17.324 -58.531 -14.065 -99.200 -91.000 HIS 73 0.900 15.573 -56.876 -7.371 -99.200 -91.000 PHE 86 1.000 35.369 -55.736 -15.921 -99.200 -91.000 PHE 92 1.000 30.153 -46.629 -22.850 -99.200 -91.000 TYR 94 0.840 33.134 -35.404 -26.810 -99.200 -91.000 TYR 124 0.840 32.278 -36.551 -18.555 -99.200 -91.000 HIS 138 0.900 5.138 -53.222 -25.691 -99.200 -91.000 PHE 164 1.000 20.253 -36.460 -31.466 -99.200 -91.000