============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 5 rings ring int. center anis. iso. HIS 4 0.900 -2.812 -12.974 58.755 -99.200 -91.000 HIS 9 0.900 3.029 -3.474 59.114 -99.200 -91.000 TYR 15 0.840 14.981 -3.058 54.552 -99.200 -91.000 PHE 23 1.000 14.334 -6.923 51.445 -99.200 -91.000 PHE 24 1.000 11.855 -7.816 43.094 -99.200 -91.000