============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. PHE 3 1.000 26.808 14.665 2.869 -99.200 -91.000 PHE 18 1.000 31.729 13.093 -3.866 -99.200 -91.000 TYR 36 0.840 36.392 22.144 15.367 -99.200 -91.000 HIS 40 0.900 31.413 6.410 6.151 -99.200 -91.000 PHE 49 1.000 14.613 8.028 -3.622 -99.200 -91.000 HIS 62 0.900 24.295 12.552 12.073 -99.200 -91.000 TYR 75 0.840 23.319 23.233 5.876 -99.200 -91.000 TYR 95 0.840 13.890 10.043 0.341 -99.200 -91.000 TYR 98 0.840 19.706 18.423 5.823 -99.200 -91.000 TYR 99 0.840 19.777 12.449 11.835 -99.200 -91.000 TRP 108 1.040 37.059 15.787 18.690 -99.200 -91.000 TRP6 108 1.020 38.039 17.612 19.846 -99.200 -91.000 PHE 113 1.000 32.899 18.703 19.600 -99.200 -91.000