============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. TRP 6 1.040 16.272 -2.597 -33.825 -99.200 -91.000 TRP6 6 1.020 13.950 -2.776 -33.565 -99.200 -91.000 TRP 40 1.040 40.642 -0.481 -3.645 -99.200 -91.000 TRP6 40 1.020 39.094 -1.355 -2.109 -99.200 -91.000 PHE 50 1.000 21.286 0.198 -2.280 -99.200 -91.000 TYR 56 0.840 40.085 0.770 -8.184 -99.200 -91.000 HIS 65 0.900 33.861 9.460 -29.319 -99.200 -91.000 PHE 94 1.000 12.221 10.151 -27.622 -99.200 -91.000