============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 4 rings ring int. center anis. iso. PHE 4 1.000 15.128 5.812 8.630 -99.200 -91.000 PHE 45 1.000 13.059 6.842 21.185 -99.200 -91.000 TYR 59 0.840 13.779 1.902 26.353 -99.200 -91.000 HIS 68 0.900 20.708 10.113 17.282 -99.200 -91.000