============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 6 rings ring int. center anis. iso. PHE 1 1.000 51.346 44.490 -15.730 -99.200 -91.000 HIS 43 0.900 26.132 54.739 -18.671 -99.200 -91.000 TYR 59 0.840 14.625 49.383 -21.003 -99.200 -91.000 HIS 71 0.900 24.888 40.543 -36.765 -99.200 -91.000 TRP 77 1.040 24.741 33.666 -24.114 -99.200 -91.000 TRP6 77 1.020 26.749 32.823 -25.022 -99.200 -91.000