============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. HIS 6 0.900 -38.314 52.121 -41.321 -99.200 -91.000 PHE 22 1.000 -43.514 31.145 -34.920 -99.200 -91.000 TYR 27 0.840 -42.329 19.934 -40.769 -99.200 -91.000 PHE 55 1.000 -32.518 22.409 -39.192 -99.200 -91.000 TYR 66 0.840 -30.098 35.976 -29.064 -99.200 -91.000 TYR 79 0.840 -43.958 29.196 -30.528 -99.200 -91.000 HIS 99 0.900 -20.410 36.426 -29.902 -99.200 -91.000 TYR 125 0.840 -27.492 48.637 -42.656 -99.200 -91.000 TYR 132 0.840 -27.426 59.034 -52.871 -99.200 -91.000 PHE 142 1.000 -18.843 42.810 -49.308 -99.200 -91.000 PHE 147 1.000 -15.020 40.383 -44.553 -99.200 -91.000 TYR 149 0.840 -23.306 33.445 -43.992 -99.200 -91.000 PHE 150 1.000 -14.807 33.346 -46.323 -99.200 -91.000 HIS 151 0.900 -13.579 35.801 -39.489 -99.200 -91.000 HIS 159 0.900 -15.435 21.911 -32.007 -99.200 -91.000 TYR 175 0.840 -28.244 32.140 -57.608 -99.200 -91.000 TYR 184 0.840 -28.920 41.414 -48.827 -99.200 -91.000 PHE 194 1.000 -18.004 30.110 -46.935 -99.200 -91.000 TRP 218 1.040 -44.473 39.856 -42.794 -99.200 -91.000 TRP6 218 1.020 -44.009 42.092 -43.385 -99.200 -91.000 PHE 226 1.000 -36.322 46.460 -48.643 -99.200 -91.000 PHE 234 1.000 -40.715 41.577 -48.683 -99.200 -91.000 TYR 246 0.840 -45.906 28.215 -43.814 -99.200 -91.000 TYR 252 0.840 -32.660 27.227 -44.437 -99.200 -91.000 TYR 254 0.840 -33.303 17.730 -50.312 -99.200 -91.000 TYR 262 0.840 -24.910 11.198 -55.899 -99.200 -91.000 HIS 268 0.900 -31.828 29.219 -56.869 -99.200 -91.000