============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 9 rings ring int. center anis. iso. PHE 40 1.000 2.816 34.607 13.017 -99.200 -91.000 PHE 42 1.000 8.253 30.978 17.109 -99.200 -91.000 TYR 53 0.840 -3.182 27.375 11.441 -99.200 -91.000 PHE 54 1.000 -11.687 24.418 11.726 -99.200 -91.000 TYR 59 0.840 3.586 27.245 8.674 -99.200 -91.000 PHE 70 1.000 4.374 17.986 9.206 -99.200 -91.000 HIS 87 0.900 -9.847 20.222 8.668 -99.200 -91.000 HIS 90 0.900 0.699 23.054 11.370 -99.200 -91.000 PHE 98 1.000 11.064 30.463 13.170 -99.200 -91.000