============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. PHE 28 1.000 -25.300 22.940 8.478 -99.200 -91.000 HIS 30 0.900 -17.521 18.603 3.018 -99.200 -91.000 TYR 42 0.840 -30.910 0.268 10.702 -99.200 -91.000 HIS 47 0.900 -43.099 4.830 19.726 -99.200 -91.000 PHE 52 1.000 -31.318 1.483 16.692 -99.200 -91.000 TYR 66 0.840 -36.412 17.843 13.969 -99.200 -91.000 TYR 82 0.840 -52.800 20.731 4.722 -99.200 -91.000 TYR 83 0.840 -48.281 19.275 8.317 -99.200 -91.000 TYR 91 0.840 -42.588 12.706 12.733 -99.200 -91.000 PHE 93 1.000 -35.707 19.839 18.407 -99.200 -91.000 HIS 106 0.900 -40.365 20.197 1.673 -99.200 -91.000 PHE 112 1.000 -38.377 8.485 11.144 -99.200 -91.000 HIS 115 0.900 -37.278 11.313 27.056 -99.200 -91.000 TYR 122 0.840 -24.426 18.386 22.906 -99.200 -91.000 HIS 133 0.900 -29.177 25.266 8.670 -99.200 -91.000 PHE 137 1.000 -23.335 20.006 17.760 -99.200 -91.000 TYR 143 0.840 -17.680 2.851 21.038 -99.200 -91.000 TYR 150 0.840 -32.997 16.449 22.406 -99.200 -91.000 TYR 152 0.840 -38.489 13.099 22.597 -99.200 -91.000 PHE 154 1.000 -42.394 15.983 25.354 -99.200 -91.000 PHE 168 1.000 -45.398 8.386 34.765 -99.200 -91.000