============================================================================= 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. PHE 6 1.000 30.439 8.455 2.353 -99.200 -91.000 PHE 14 1.000 24.904 13.885 -3.048 -99.200 -91.000 HIS 27 0.900 34.830 27.161 8.446 -99.200 -91.000 PHE 31 1.000 36.088 19.316 -2.220 -99.200 -91.000 PHE 40 1.000 25.684 21.794 4.292 -99.200 -91.000 TYR 101 0.840 36.726 10.668 15.846 -99.200 -91.000 TRP 110 1.040 21.927 7.042 -2.645 -99.200 -91.000 TRP6 110 1.020 23.806 7.276 -1.231 -99.200 -91.000