============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 33 rings ring int. center anis. iso. TYR 12 0.840 15.675 8.887 1.239 -99.200 -91.000 TYR 20 0.840 3.092 0.054 15.253 -99.200 -91.000 TRP 21 1.040 3.978 1.334 23.218 -99.200 -91.000 TRP6 21 1.020 6.094 0.436 22.602 -99.200 -91.000 PHE 42 1.000 21.347 7.495 3.066 -99.200 -91.000 PHE 49 1.000 15.422 -11.851 -11.539 -99.200 -91.000 PHE 59 1.000 18.495 -9.377 4.374 -99.200 -91.000 TYR 60 0.840 25.569 -11.981 0.784 -99.200 -91.000 HIS 71 0.900 19.273 -15.807 3.922 -99.200 -91.000 PHE 81 1.000 6.446 -7.680 -5.248 -99.200 -91.000 PHE 88 1.000 16.180 -20.232 -5.634 -99.200 -91.000 PHE 119 1.000 10.858 -11.125 -9.084 -99.200 -91.000 PHE 134 1.000 -0.884 -6.858 6.179 -99.200 -91.000 PHE 143 1.000 6.812 1.747 0.103 -99.200 -91.000 PHE 144 1.000 2.647 7.391 0.495 -99.200 -91.000 TRP 150 1.040 -0.457 1.842 9.918 -99.200 -91.000 TRP6 150 1.020 1.191 0.479 10.950 -99.200 -91.000 TYR 158 0.840 -2.900 9.598 5.655 -99.200 -91.000 PHE 192 1.000 -1.996 -0.640 24.742 -99.200 -91.000 TRP 195 1.040 -0.647 4.158 23.804 -99.200 -91.000 TRP6 195 1.020 0.527 6.113 23.143 -99.200 -91.000 TYR 203 0.840 -4.127 9.721 12.725 -99.200 -91.000 HIS 205 0.900 -6.711 17.553 19.700 -99.200 -91.000 TYR 208 0.840 -2.501 20.769 17.388 -99.200 -91.000 PHE 214 1.000 7.949 23.227 14.877 -99.200 -91.000 HIS 228 0.900 9.243 6.297 25.558 -99.200 -91.000 PHE 238 1.000 8.864 -2.432 28.757 -99.200 -91.000 TYR 240 0.840 11.653 0.338 25.027 -99.200 -91.000 TYR 246 0.840 13.514 10.013 32.215 -99.200 -91.000 PHE 259 1.000 18.010 28.399 19.876 -99.200 -91.000 TYR 262 0.840 8.142 22.362 20.572 -99.200 -91.000 PHE 263 1.000 10.704 15.923 25.795 -99.200 -91.000 TYR 290 0.840 23.180 15.717 24.658 -99.200 -91.000