============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. HIS 1 0.900 -30.939 -39.142 -3.822 -99.200 -91.000 HIS 2 0.900 -26.170 -43.232 4.337 -99.200 -91.000 TYR 9 0.840 -22.327 -33.397 -5.038 -99.200 -91.000 PHE 11 1.000 -24.096 -30.223 0.930 -99.200 -91.000 TYR 14 0.840 -24.173 -24.226 11.590 -99.200 -91.000 TYR 34 0.840 -22.103 -14.724 8.682 -99.200 -91.000 TYR 38 0.840 -30.896 -24.590 4.931 -99.200 -91.000 TYR 48 0.840 -35.507 -27.275 2.299 -99.200 -91.000 TYR 61 0.840 -38.356 -19.203 10.167 -99.200 -91.000 TYR 62 0.840 -35.761 -24.512 9.275 -99.200 -91.000 HIS 82 0.900 -42.921 -30.682 17.437 -99.200 -91.000 PHE 93 1.000 -31.145 -27.872 10.195 -99.200 -91.000 TYR 94 0.840 -24.301 -33.454 7.227 -99.200 -91.000 PHE 99 1.000 -17.451 -19.271 -5.607 -99.200 -91.000 PHE 120 1.000 -25.663 -29.258 -4.260 -99.200 -91.000 PHE 124 1.000 -27.996 -35.039 -4.215 -99.200 -91.000 TRP 128 1.040 -39.009 -32.889 4.291 -99.200 -91.000 TRP6 128 1.020 -38.128 -32.285 6.391 -99.200 -91.000