============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 11 rings ring int. center anis. iso. HIS 2 0.900 26.390 9.878 22.003 -99.200 -91.000 TRP 12 1.040 12.705 18.683 34.870 -99.200 -91.000 TRP6 12 1.020 13.161 20.980 34.520 -99.200 -91.000 PHE 13 1.000 11.193 22.432 27.245 -99.200 -91.000 PHE 19 1.000 14.726 26.500 32.350 -99.200 -91.000 PHE 21 1.000 18.125 18.526 33.296 -99.200 -91.000 PHE 32 1.000 19.617 22.910 29.981 -99.200 -91.000 HIS 34 0.900 17.740 27.652 25.573 -99.200 -91.000 PHE 35 1.000 14.250 29.304 23.445 -99.200 -91.000 PHE 43 1.000 6.471 29.121 22.625 -99.200 -91.000 PHE 54 1.000 18.249 12.933 23.203 -99.200 -91.000