============================================================================= 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 27.773 32.313 29.726 -99.200 -91.000 HIS 5 0.900 27.123 45.531 36.820 -99.200 -91.000 HIS 10 0.900 31.042 43.132 26.221 -99.200 -91.000 TYR 16 0.840 25.026 32.464 19.257 -99.200 -91.000 PHE 24 1.000 19.397 36.614 21.126 -99.200 -91.000 PHE 25 1.000 11.667 38.257 23.986 -99.200 -91.000 TYR 26 0.840 19.746 44.002 22.872 -99.200 -91.000