============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. TYR 4 0.840 1.982 19.367 32.524 -99.200 -91.000 PHE 19 1.000 -1.297 15.380 31.630 -99.200 -91.000 TYR 25 0.840 5.405 22.516 11.938 -99.200 -91.000 PHE 50 1.000 5.470 2.820 30.414 -99.200 -91.000 TRP 52 1.040 1.438 3.970 25.109 -99.200 -91.000 TRP6 52 1.020 -0.574 2.880 25.664 -99.200 -91.000 TYR 75 0.840 13.411 11.896 25.161 -99.200 -91.000 PHE 99 1.000 0.259 15.271 17.305 -99.200 -91.000 HIS 107 0.900 9.421 0.412 34.608 -99.200 -91.000 HIS 108 0.900 4.543 -2.921 38.582 -99.200 -91.000 TRP 115 1.040 12.172 -20.854 34.801 -99.200 -91.000 TRP6 115 1.020 11.429 -19.214 33.275 -99.200 -91.000