============================================================================= 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 21.914 -15.263 0.001 -99.200 -91.000 HIS 5 0.900 15.267 -10.625 -6.548 -99.200 -91.000 HIS 10 0.900 21.011 -3.194 -1.457 -99.200 -91.000 TYR 16 0.840 15.154 7.728 -7.816 -99.200 -91.000 PHE 24 1.000 17.326 3.418 -13.172 -99.200 -91.000 PHE 25 1.000 20.805 1.815 -20.174 -99.200 -91.000 TYR 26 0.840 18.468 -4.125 -13.195 -99.200 -91.000