============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. HIS 23 0.900 -3.476 7.728 55.454 -99.200 -91.000 TYR 27 0.840 -5.502 0.668 49.080 -99.200 -91.000 HIS 32 0.900 9.734 7.605 43.593 -99.200 -91.000 TYR 33 0.840 11.831 11.446 48.871 -99.200 -91.000 HIS 34 0.900 15.274 12.324 41.275 -99.200 -91.000 PHE 79 1.000 5.617 -7.476 49.287 -99.200 -91.000 PHE 82 1.000 3.146 0.580 54.928 -99.200 -91.000 PHE 95 1.000 5.022 17.635 29.860 -99.200 -91.000 TYR 96 0.840 13.168 16.641 29.561 -99.200 -91.000 PHE 123 1.000 10.054 -4.562 31.673 -99.200 -91.000 PHE 129 1.000 1.818 -5.288 42.609 -99.200 -91.000 PHE 161 1.000 6.392 18.633 25.209 -99.200 -91.000 TYR 164 0.840 4.726 13.160 27.877 -99.200 -91.000 HIS 169 0.900 1.603 6.203 21.253 -99.200 -91.000 TYR 185 0.840 1.494 -14.840 38.102 -99.200 -91.000 TRP 211 1.040 -1.810 24.277 26.895 -99.200 -91.000 TRP6 211 1.020 -2.003 22.448 25.406 -99.200 -91.000 PHE 233 1.000 -14.463 2.153 38.416 -99.200 -91.000 TYR 241 0.840 -14.982 -9.944 33.796 -99.200 -91.000 HIS 257 0.900 -12.765 19.952 14.470 -99.200 -91.000