============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 7 rings ring int. center anis. iso. HIS 31 0.900 -3.272 -8.006 5.886 -99.200 -91.000 HIS 32 0.900 -2.306 -0.499 4.650 -99.200 -91.000 TRP 40 1.040 -2.259 5.298 7.832 -99.200 -91.000 TRP6 40 1.020 -3.848 5.036 6.123 -99.200 -91.000 PHE 47 1.000 -6.683 1.818 1.019 -99.200 -91.000 PHE 66 1.000 -3.343 0.343 -2.206 -99.200 -91.000 PHE 68 1.000 -3.864 5.824 0.301 -99.200 -91.000