============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 31 rings ring int. center anis. iso. TYR 13 0.840 -5.401 4.631 14.329 -99.200 -91.000 TYR 16 0.840 -10.023 10.062 28.225 -99.200 -91.000 TYR 24 0.840 -17.191 20.603 30.912 -99.200 -91.000 PHE 29 1.000 -13.057 11.146 24.339 -99.200 -91.000 TYR 32 0.840 -6.708 9.281 10.440 -99.200 -91.000 PHE 46 1.000 -21.893 13.048 11.287 -99.200 -91.000 TYR 48 0.840 -18.916 14.612 16.162 -99.200 -91.000 TYR 58 0.840 -9.773 -2.166 17.980 -99.200 -91.000 TRP 67 1.040 -21.089 -10.518 16.213 -99.200 -91.000 TRP6 67 1.020 -19.047 -10.196 15.084 -99.200 -91.000 HIS 77 0.900 -30.503 -0.914 15.782 -99.200 -91.000 TYR 90 0.840 -17.376 -14.097 4.666 -99.200 -91.000 PHE 98 1.000 -16.826 -2.768 8.730 -99.200 -91.000 PHE 102 1.000 -10.823 5.325 8.720 -99.200 -91.000 TYR 111 0.840 16.354 -6.850 11.493 -99.200 -91.000 TYR 131 0.840 11.072 -15.456 11.004 -99.200 -91.000 PHE 142 1.000 -1.200 -13.326 6.180 -99.200 -91.000 PHE 143 1.000 3.318 -14.234 8.829 -99.200 -91.000 TYR 151 0.840 3.545 -14.569 3.432 -99.200 -91.000 TRP 155 1.040 1.667 -21.048 12.186 -99.200 -91.000 TRP6 155 1.020 1.461 -19.626 14.059 -99.200 -91.000 PHE 157 1.000 12.125 -18.924 13.467 -99.200 -91.000 TYR 182 0.840 11.143 -10.529 17.646 -99.200 -91.000 TYR 193 0.840 2.269 6.825 16.611 -99.200 -91.000 TYR 213 0.840 -7.167 0.474 10.523 -99.200 -91.000 TYR 223 0.840 -26.631 9.228 9.319 -99.200 -91.000 HIS 241 0.900 0.089 13.534 2.318 -99.200 -91.000 TRP 247 1.040 -3.715 13.146 14.434 -99.200 -91.000 TRP6 247 1.020 -3.560 13.900 16.675 -99.200 -91.000 TRP 248 1.040 0.979 6.969 11.413 -99.200 -91.000 TRP6 248 1.020 -1.346 7.148 11.833 -99.200 -91.000