============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 38 rings ring int. center anis. iso. HIS 2 0.900 34.077 -22.943 -64.554 -99.200 -91.000 PHE 12 1.000 44.034 -40.170 -47.351 -99.200 -91.000 PHE 15 1.000 48.607 -50.482 -48.302 -99.200 -91.000 TYR 33 0.840 49.574 -51.275 -60.400 -99.200 -91.000 HIS 43 0.900 55.217 -45.149 -48.743 -99.200 -91.000 TYR 45 0.840 56.537 -42.028 -42.692 -99.200 -91.000 PHE 46 1.000 49.780 -39.327 -40.937 -99.200 -91.000 TYR 60 0.840 53.652 -44.038 -25.924 -99.200 -91.000 HIS 73 0.900 43.702 -41.233 -28.899 -99.200 -91.000 PHE 76 1.000 50.683 -42.486 -31.717 -99.200 -91.000 TRP 81 1.040 43.414 -32.954 -36.610 -99.200 -91.000 TRP6 81 1.020 41.819 -32.120 -38.180 -99.200 -91.000 HIS 83 0.900 52.131 -35.030 -41.489 -99.200 -91.000 TRP 96 1.040 45.743 -41.458 -57.696 -99.200 -91.000 TRP6 96 1.020 44.957 -43.685 -57.742 -99.200 -91.000 TYR 102 0.840 44.100 -40.551 -42.196 -99.200 -91.000 TYR 104 0.840 40.477 -45.575 -40.835 -99.200 -91.000 TYR 109 0.840 48.379 -50.299 -32.920 -99.200 -91.000 TRP 120 1.040 38.536 -38.599 -24.430 -99.200 -91.000 TRP6 120 1.020 40.876 -38.825 -24.868 -99.200 -91.000 PHE 135 1.000 43.736 -51.827 -50.768 -99.200 -91.000 TYR 136 0.840 42.900 -55.298 -40.269 -99.200 -91.000 TYR 143 0.840 51.314 -65.290 -40.069 -99.200 -91.000 TYR 150 0.840 56.061 -58.815 -32.252 -99.200 -91.000 TYR 155 0.840 50.964 -48.974 -28.187 -99.200 -91.000 TYR 165 0.840 42.587 -60.329 -35.135 -99.200 -91.000 TYR 168 0.840 43.772 -52.107 -36.622 -99.200 -91.000 HIS 170 0.900 34.680 -50.901 -31.722 -99.200 -91.000 PHE 171 1.000 37.906 -47.893 -37.026 -99.200 -91.000 HIS 173 0.900 32.875 -57.348 -41.679 -99.200 -91.000 TYR 176 0.840 35.845 -46.784 -44.074 -99.200 -91.000 TRP 177 1.040 38.512 -52.764 -42.497 -99.200 -91.000 TRP6 177 1.020 39.804 -51.209 -41.199 -99.200 -91.000 HIS 190 0.900 51.956 -55.256 -55.797 -99.200 -91.000 PHE 207 1.000 39.693 -32.684 -50.905 -99.200 -91.000 PHE 209 1.000 36.314 -32.724 -45.122 -99.200 -91.000 TRP 211 1.040 35.880 -40.548 -36.664 -99.200 -91.000 TRP6 211 1.020 37.384 -42.279 -37.186 -99.200 -91.000