============================================================================= 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. TYR 26 0.840 21.111 44.651 104.798 -99.200 -91.000 PHE 40 1.000 40.225 49.685 100.771 -99.200 -91.000 TYR 46 0.840 19.054 35.519 101.555 -99.200 -91.000 HIS 47 0.900 17.211 38.854 95.772 -99.200 -91.000 PHE 48 1.000 14.973 34.968 94.438 -99.200 -91.000 HIS 98 0.900 41.949 41.448 94.676 -99.200 -91.000