============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. HIS 12 0.900 50.571 13.381 -0.487 -99.200 -91.000 HIS 19 0.900 47.039 11.091 12.141 -99.200 -91.000 PHE 51 1.000 41.201 24.716 11.311 -99.200 -91.000 PHE 60 1.000 42.427 35.221 12.665 -99.200 -91.000 HIS 93 0.900 36.357 27.736 -5.378 -99.200 -91.000 HIS 103 0.900 40.799 2.663 8.842 -99.200 -91.000 HIS 109 0.900 46.580 20.151 -2.523 -99.200 -91.000 HIS 110 0.900 49.323 22.386 -5.352 -99.200 -91.000