============================================================================= 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. HIS 6 0.900 40.975 12.452 7.695 -99.200 -91.000 TYR 16 0.840 58.719 9.675 5.569 -99.200 -91.000 PHE 23 1.000 54.196 14.896 5.828 -99.200 -91.000 HIS 44 0.900 54.422 22.292 16.791 -99.200 -91.000 HIS 120 0.900 69.118 7.434 30.598 -99.200 -91.000 HIS 149 0.900 45.747 11.931 40.876 -99.200 -91.000 HIS 154 0.900 52.763 -5.700 40.037 -99.200 -91.000