============================================================================= 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 4 0.900 -7.708 -16.249 -2.375 -99.200 -91.000 HIS 9 0.900 -6.833 -19.001 -13.333 -99.200 -91.000 TYR 15 0.840 -11.219 -9.100 -23.080 -99.200 -91.000 PHE 23 1.000 -7.822 -5.655 -18.011 -99.200 -91.000 PHE 24 1.000 -7.867 1.779 -13.877 -99.200 -91.000