============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 7 rings ring int. center anis. iso. PHE 1 1.000 -2.177 13.992 17.771 -99.200 -91.000 HIS 5 0.900 0.080 9.174 8.608 -99.200 -91.000 HIS 10 0.900 -3.180 -0.241 6.551 -99.200 -91.000 TYR 16 0.840 -9.454 3.564 -5.286 -99.200 -91.000 PHE 24 1.000 -12.304 7.646 -0.447 -99.200 -91.000 PHE 25 1.000 -18.187 11.483 3.865 -99.200 -91.000 TYR 26 0.840 -9.408 9.938 6.329 -99.200 -91.000