============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 39 rings ring int. center anis. iso. TYR 6 0.840 31.540 -3.627 -14.089 -99.200 -91.000 TYR 10 0.840 35.712 7.901 -23.051 -99.200 -91.000 TYR 17 0.840 26.357 15.933 -5.288 -99.200 -91.000 TRP 34 1.040 32.976 3.493 -12.689 -99.200 -91.000 TRP6 34 1.020 34.155 1.497 -12.169 -99.200 -91.000 TYR 39 0.840 32.050 4.318 1.395 -99.200 -91.000 HIS 62 0.900 9.334 3.419 -18.770 -99.200 -91.000 TYR 68 0.840 21.477 -0.886 -9.869 -99.200 -91.000 TYR 69 0.840 22.908 -2.522 -17.210 -99.200 -91.000 TYR 81 0.840 34.296 2.843 -8.298 -99.200 -91.000 TYR 86 0.840 28.085 5.594 -23.699 -99.200 -91.000 TYR 105 0.840 14.679 28.276 -33.327 -99.200 -91.000 PHE 110 1.000 15.647 15.731 -29.799 -99.200 -91.000 HIS 126 0.900 3.876 11.421 -11.891 -99.200 -91.000 HIS 131 0.900 16.225 12.045 -5.333 -99.200 -91.000 PHE 140 1.000 21.996 11.559 -18.950 -99.200 -91.000 PHE 152 1.000 23.406 8.304 -9.424 -99.200 -91.000 HIS 160 0.900 25.231 16.216 4.238 -99.200 -91.000 PHE 164 1.000 24.148 26.608 1.502 -99.200 -91.000 PHE 168 1.000 22.307 31.230 -1.229 -99.200 -91.000 TYR 173 0.840 16.890 29.461 -15.125 -99.200 -91.000 TYR 174 0.840 13.123 23.265 -16.808 -99.200 -91.000 TYR 185 0.840 3.732 12.798 -5.226 -99.200 -91.000 TRP 192 1.040 5.771 24.908 -14.220 -99.200 -91.000 TRP6 192 1.020 4.510 26.866 -14.574 -99.200 -91.000 TYR 199 0.840 8.858 28.514 -24.059 -99.200 -91.000 PHE 208 1.000 7.146 31.152 -16.857 -99.200 -91.000 PHE 211 1.000 20.025 39.103 -16.147 -99.200 -91.000 PHE 225 1.000 3.869 30.461 -21.653 -99.200 -91.000 TYR 230 0.840 5.239 32.921 -34.825 -99.200 -91.000 TYR 232 0.840 9.865 24.174 -32.717 -99.200 -91.000 TYR 249 0.840 -7.955 24.055 -11.048 -99.200 -91.000 HIS 250 0.900 -7.879 25.459 -15.544 -99.200 -91.000 HIS 266 0.900 6.850 8.691 -35.954 -99.200 -91.000 HIS 267 0.900 6.051 11.255 -32.759 -99.200 -91.000 HIS 268 0.900 4.737 5.853 -27.980 -99.200 -91.000 HIS 269 0.900 10.634 1.118 -25.879 -99.200 -91.000 HIS 270 0.900 10.377 2.679 -32.176 -99.200 -91.000 HIS 271 0.900 15.149 0.669 -25.779 -99.200 -91.000