============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. TYR 2 0.840 58.431 13.473 -33.879 -99.200 -91.000 PHE 3 1.000 63.633 15.357 -39.000 -99.200 -91.000 HIS 10 0.900 54.154 5.195 -28.468 -99.200 -91.000 TYR 12 0.840 50.298 3.684 -31.802 -99.200 -91.000 HIS 23 0.900 62.041 13.272 -18.477 -99.200 -91.000 HIS 26 0.900 50.742 16.946 -29.358 -99.200 -91.000 PHE 42 1.000 40.207 6.598 -30.411 -99.200 -91.000 TRP 43 1.040 36.544 2.607 -30.488 -99.200 -91.000 TRP6 43 1.020 35.690 3.866 -28.658 -99.200 -91.000 PHE 50 1.000 47.178 7.444 -23.515 -99.200 -91.000 PHE 71 1.000 39.993 15.834 -27.948 -99.200 -91.000 TRP 97 1.040 26.000 -14.208 -21.307 -99.200 -91.000 TRP6 97 1.020 27.573 -14.292 -19.542 -99.200 -91.000 TYR 98 0.840 28.715 -9.384 -30.345 -99.200 -91.000 TYR 106 0.840 34.231 -0.709 -28.920 -99.200 -91.000 PHE 110 1.000 37.673 6.793 -24.399 -99.200 -91.000 HIS 125 0.900 41.439 21.762 -32.405 -99.200 -91.000 TYR 143 0.840 45.653 23.882 -19.454 -99.200 -91.000 PHE 149 1.000 30.849 21.659 -30.397 -99.200 -91.000 PHE 150 1.000 34.822 20.445 -23.504 -99.200 -91.000 PHE 184 1.000 18.843 13.088 -16.985 -99.200 -91.000 PHE 204 1.000 45.428 28.172 -22.430 -99.200 -91.000 TYR 238 0.840 42.774 3.495 -2.464 -99.200 -91.000 HIS 242 0.900 39.260 3.152 -2.824 -99.200 -91.000 TYR 250 0.840 46.394 2.384 -2.126 -99.200 -91.000 TRP 254 1.040 52.144 4.918 -3.690 -99.200 -91.000 TRP6 254 1.020 51.461 3.177 -5.172 -99.200 -91.000