============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. HIS 6 0.900 57.259 15.366 35.779 -99.200 -91.000 PHE 10 1.000 45.947 9.776 41.338 -99.200 -91.000 PHE 12 1.000 43.049 14.110 32.218 -99.200 -91.000 HIS 16 0.900 37.946 19.686 28.577 -99.200 -91.000 TYR 37 0.840 49.098 24.997 41.063 -99.200 -91.000 TRP 38 1.040 45.184 22.574 33.675 -99.200 -91.000 TRP6 38 1.020 43.934 20.882 32.593 -99.200 -91.000 TYR 39 0.840 53.038 18.763 35.991 -99.200 -91.000 TYR 42 0.840 56.156 15.411 22.697 -99.200 -91.000 PHE 51 1.000 49.956 15.188 32.860 -99.200 -91.000 TYR 54 0.840 48.393 18.839 42.797 -99.200 -91.000 TYR 55 0.840 44.379 13.027 37.226 -99.200 -91.000