============================================================================= 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 8 0.900 -17.016 8.297 10.254 -99.200 -91.000 PHE 12 1.000 -11.446 2.605 17.297 -99.200 -91.000 HIS 18 0.900 -13.462 1.772 25.623 -99.200 -91.000 TYR 22 0.840 -30.161 4.072 22.730 -99.200 -91.000 PHE 27 1.000 -17.469 5.466 22.697 -99.200 -91.000 TRP 44 1.040 -17.780 0.791 27.838 -99.200 -91.000 TRP6 44 1.020 -15.824 1.815 28.639 -99.200 -91.000