============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 11 rings ring int. center anis. iso. PHE 14 1.000 9.149 -0.884 10.674 -99.200 -91.000 HIS 17 0.900 6.827 1.897 1.045 -99.200 -91.000 TYR 19 0.840 2.713 9.723 1.414 -99.200 -91.000 HIS 21 0.900 2.173 16.357 4.179 -99.200 -91.000 PHE 28 1.000 -11.426 13.574 2.091 -99.200 -91.000 TYR 44 0.840 -6.149 -3.003 3.650 -99.200 -91.000 HIS 56 0.900 -18.320 0.635 23.771 -99.200 -91.000 TYR 94 0.840 -1.215 8.035 15.597 -99.200 -91.000 PHE 119 1.000 -3.849 -6.962 -1.265 -99.200 -91.000 TYR 123 0.840 2.263 -0.181 0.367 -99.200 -91.000 PHE 148 1.000 -6.465 -10.463 9.507 -99.200 -91.000