============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 10 rings ring int. center anis. iso. HIS 6 0.900 6.435 -7.805 -1.826 -99.200 -91.000 HIS 16 0.900 -3.709 -9.021 -15.066 -99.200 -91.000 PHE 18 1.000 -9.087 -7.099 -17.401 -99.200 -91.000 TYR 29 0.840 -7.800 -1.806 -16.641 -99.200 -91.000 TRP 33 1.040 3.679 -3.571 -12.209 -99.200 -91.000 TRP6 33 1.020 2.940 -5.668 -13.012 -99.200 -91.000 PHE 38 1.000 -1.057 -5.499 -11.361 -99.200 -91.000 PHE 40 1.000 -9.715 -4.488 -12.200 -99.200 -91.000 HIS 45 0.900 -1.996 6.319 -7.668 -99.200 -91.000 HIS 48 0.900 6.415 3.730 -6.323 -99.200 -91.000