============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. PHE 24 1.000 58.315 4.472 15.513 -99.200 -91.000 PHE 25 1.000 55.790 3.020 19.866 -99.200 -91.000 PHE 27 1.000 57.655 13.624 15.499 -99.200 -91.000 TYR 34 0.840 47.626 13.597 6.333 -99.200 -91.000 TYR 39 0.840 41.599 13.819 15.857 -99.200 -91.000 PHE 44 1.000 46.634 15.126 11.391 -99.200 -91.000 TYR 50 0.840 62.078 10.520 13.660 -99.200 -91.000 TYR 65 0.840 44.428 9.878 24.495 -99.200 -91.000 TRP 76 1.040 54.224 2.230 32.333 -99.200 -91.000 TRP6 76 1.020 52.141 2.537 31.256 -99.200 -91.000 TYR 78 0.840 65.200 3.601 33.486 -99.200 -91.000 TRP 101 1.040 47.817 1.122 11.253 -99.200 -91.000 TRP6 101 1.020 49.397 1.458 9.529 -99.200 -91.000 PHE 103 1.000 53.571 0.848 15.423 -99.200 -91.000 PHE 139 1.000 52.372 -1.277 -1.944 -99.200 -91.000 PHE 149 1.000 43.099 7.914 18.566 -99.200 -91.000 TYR 154 0.840 47.633 -5.493 23.857 -99.200 -91.000 TRP 165 1.040 47.542 5.961 31.700 -99.200 -91.000 TRP6 165 1.020 48.273 5.260 29.572 -99.200 -91.000 PHE 172 1.000 40.317 -10.757 21.086 -99.200 -91.000 PHE 184 1.000 62.593 2.387 16.084 -99.200 -91.000 HIS 189 0.900 63.630 0.244 25.117 -99.200 -91.000 TYR 197 0.840 45.537 -5.800 4.538 -99.200 -91.000