============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 5 rings ring int. center anis. iso. HIS 7 0.900 -11.653 53.344 11.637 -99.200 -91.000 TYR 16 0.840 -15.993 55.856 18.810 -99.200 -91.000 TYR 21 0.840 -19.894 55.612 30.009 -99.200 -91.000 PHE 23 1.000 -28.296 61.103 24.666 -99.200 -91.000 PHE 24 1.000 -28.934 56.787 26.962 -99.200 -91.000