============================================================================= 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 5 0.900 13.329 16.428 -19.301 -99.200 -91.000 PHE 15 1.000 7.953 17.443 -4.774 -99.200 -91.000 TYR 16 0.840 9.842 19.073 2.638 -99.200 -91.000 PHE 26 1.000 12.400 26.182 -4.651 -99.200 -91.000 PHE 72 1.000 18.171 6.591 -8.521 -99.200 -91.000