============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 6 rings ring int. center anis. iso. PHE 1 1.000 9.569 20.191 -8.390 -99.200 -91.000 HIS 5 0.900 13.911 11.494 -5.157 -99.200 -91.000 HIS 10 0.900 8.825 3.499 -0.648 -99.200 -91.000 TYR 16 0.840 15.279 -5.906 -8.662 -99.200 -91.000 PHE 24 1.000 12.367 -1.212 -13.162 -99.200 -91.000 PHE 25 1.000 14.295 1.279 -20.957 -99.200 -91.000