============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. PHE 35 1.000 -0.710 32.175 -33.319 -99.200 -91.000 HIS 37 0.900 0.539 29.466 -27.365 -99.200 -91.000 TRP 38 1.040 2.896 33.126 -20.458 -99.200 -91.000 TRP6 38 1.020 5.041 33.435 -19.591 -99.200 -91.000 TYR 39 0.840 2.991 24.700 -22.226 -99.200 -91.000 TYR 52 0.840 -6.375 29.286 -24.998 -99.200 -91.000 PHE 65 1.000 -1.316 30.729 -12.340 -99.200 -91.000 PHE 74 1.000 4.094 38.006 -26.088 -99.200 -91.000 TYR 89 0.840 4.388 29.012 -12.867 -99.200 -91.000 TYR 90 0.840 9.746 25.197 -18.205 -99.200 -91.000 PHE 101 1.000 8.592 23.979 -25.041 -99.200 -91.000 PHE 121 1.000 29.573 13.280 8.592 -99.200 -91.000 PHE 138 1.000 25.805 14.714 4.711 -99.200 -91.000 PHE 142 1.000 21.963 26.011 2.407 -99.200 -91.000 TYR 143 0.840 15.076 31.627 1.639 -99.200 -91.000 TRP 151 1.040 35.270 20.641 -0.372 -99.200 -91.000 TRP6 151 1.020 35.356 19.167 1.424 -99.200 -91.000 TRP 166 1.040 23.297 23.107 -4.096 -99.200 -91.000 TRP6 166 1.020 24.460 22.576 -6.025 -99.200 -91.000 TYR 176 0.840 16.487 26.309 -1.718 -99.200 -91.000 TYR 189 0.840 42.389 11.047 4.066 -99.200 -91.000 HIS 192 0.900 48.296 17.386 1.406 -99.200 -91.000 TYR 195 0.840 42.384 16.273 4.024 -99.200 -91.000 HIS 201 0.900 23.379 31.055 4.025 -99.200 -91.000 PHE 212 1.000 38.766 15.432 8.510 -99.200 -91.000