============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. PHE 5 1.000 -18.339 -6.010 21.726 -99.200 -91.000 HIS 6 0.900 -22.735 -11.570 19.286 -99.200 -91.000 TYR 13 0.840 -13.409 -10.550 18.859 -99.200 -91.000 HIS 43 0.900 -2.350 -14.244 40.022 -99.200 -91.000 HIS 46 0.900 -3.117 -12.843 36.280 -99.200 -91.000 PHE 66 1.000 1.699 -14.661 22.454 -99.200 -91.000 PHE 89 1.000 -5.074 -10.580 20.367 -99.200 -91.000 TYR 97 0.840 6.477 -12.995 18.627 -99.200 -91.000 HIS 122 0.900 10.947 -11.635 31.897 -99.200 -91.000 PHE 123 1.000 12.432 -7.078 33.156 -99.200 -91.000 PHE 143 1.000 -6.295 -0.472 33.699 -99.200 -91.000 PHE 144 1.000 1.547 -3.805 31.715 -99.200 -91.000 TYR 149 0.840 7.958 -0.014 41.097 -99.200 -91.000 PHE 162 1.000 10.381 2.331 21.227 -99.200 -91.000 TYR 188 0.840 4.329 -24.748 40.621 -99.200 -91.000 HIS 209 0.900 4.542 0.495 58.687 -99.200 -91.000 TYR 236 0.840 16.346 -8.286 43.093 -99.200 -91.000