============================================================================= 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. HIS 19 0.900 30.716 32.473 -15.347 -99.200 -91.000 TYR 20 0.840 34.947 26.052 -13.397 -99.200 -91.000 TRP 40 1.040 19.373 32.396 -11.694 -99.200 -91.000 TRP6 40 1.020 18.146 34.415 -11.799 -99.200 -91.000 TRP 53 1.040 24.817 21.448 -10.205 -99.200 -91.000 TRP6 53 1.020 25.660 23.641 -10.497 -99.200 -91.000 TRP 65 1.040 38.177 21.939 -18.946 -99.200 -91.000 TRP6 65 1.020 38.099 23.426 -17.096 -99.200 -91.000 PHE 86 1.000 32.688 21.573 7.926 -99.200 -91.000 HIS 90 0.900 24.697 15.616 1.689 -99.200 -91.000 PHE 142 1.000 44.206 33.000 8.418 -99.200 -91.000 TYR 146 0.840 36.418 37.172 15.717 -99.200 -91.000 TYR 151 0.840 40.275 24.887 18.430 -99.200 -91.000 PHE 157 1.000 41.227 24.105 7.576 -99.200 -91.000 HIS 158 0.900 46.079 19.565 2.887 -99.200 -91.000 PHE 166 1.000 42.554 41.534 5.986 -99.200 -91.000 HIS 173 0.900 45.534 52.071 2.434 -99.200 -91.000 TYR 204 0.840 51.663 38.746 -10.407 -99.200 -91.000 PHE 206 1.000 54.068 44.066 0.049 -99.200 -91.000 PHE 214 1.000 50.117 28.233 -5.340 -99.200 -91.000 PHE 228 1.000 40.179 27.798 -15.433 -99.200 -91.000