============================================================================= 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 15.898 12.655 -0.999 -99.200 -91.000 HIS 5 0.900 6.838 7.637 -16.030 -99.200 -91.000 HIS 10 0.900 1.536 2.606 -6.633 -99.200 -91.000 TYR 16 0.840 1.218 10.094 5.314 -99.200 -91.000 PHE 24 1.000 -1.235 14.597 0.435 -99.200 -91.000 PHE 25 1.000 -1.835 21.756 -3.685 -99.200 -91.000 TYR 26 0.840 -4.180 13.155 -6.561 -99.200 -91.000