============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 30 rings ring int. center anis. iso. TYR 13 0.840 -1.359 8.832 -42.709 -99.200 -91.000 HIS 20 0.900 15.413 2.255 -37.921 -99.200 -91.000 TYR 29 0.840 7.958 -0.956 -38.466 -99.200 -91.000 TYR 32 0.840 -4.432 8.562 -37.661 -99.200 -91.000 HIS 43 0.900 -14.203 -2.881 -30.996 -99.200 -91.000 PHE 46 1.000 -6.422 -7.860 -34.516 -99.200 -91.000 TYR 48 0.840 -0.860 -4.949 -33.526 -99.200 -91.000 TYR 58 0.840 -0.676 4.669 -50.224 -99.200 -91.000 TRP 68 1.040 -6.001 -6.316 -57.874 -99.200 -91.000 TRP6 68 1.020 -6.777 -4.085 -57.799 -99.200 -91.000 TYR 77 0.840 -2.934 -11.316 -56.180 -99.200 -91.000 PHE 99 1.000 -10.845 0.173 -49.135 -99.200 -91.000 PHE 103 1.000 -7.799 5.505 -41.411 -99.200 -91.000 TYR 132 0.840 -2.408 24.780 -62.770 -99.200 -91.000 PHE 143 1.000 -11.770 16.415 -59.115 -99.200 -91.000 PHE 144 1.000 -7.123 18.581 -60.910 -99.200 -91.000 PHE 152 1.000 -12.348 21.505 -59.962 -99.200 -91.000 TRP 156 1.040 -6.959 16.232 -68.187 -99.200 -91.000 TRP6 156 1.020 -5.086 15.107 -67.281 -99.200 -91.000 TYR 158 0.840 -0.677 24.407 -66.908 -99.200 -91.000 PHE 167 1.000 0.649 15.529 -65.185 -99.200 -91.000 TYR 185 0.840 4.916 22.108 -59.285 -99.200 -91.000 TYR 187 0.840 2.344 17.572 -55.237 -99.200 -91.000 TYR 196 0.840 3.443 15.081 -41.317 -99.200 -91.000 TYR 217 0.840 -6.185 8.801 -46.539 -99.200 -91.000 TRP 251 1.040 0.627 10.285 -34.280 -99.200 -91.000 TRP6 251 1.020 2.889 9.766 -33.839 -99.200 -91.000 TRP 252 1.040 -1.781 15.794 -40.046 -99.200 -91.000 TRP6 252 1.020 -2.059 13.457 -39.820 -99.200 -91.000 TYR 253 0.840 -3.251 20.361 -36.948 -99.200 -91.000