============================================================================= 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. PHE 5 1.000 18.323 7.537 10.228 -99.200 -91.000 HIS 7 0.900 21.177 10.824 3.796 -99.200 -91.000 HIS 17 0.900 12.935 23.429 10.164 -99.200 -91.000 HIS 19 0.900 12.033 20.890 -0.200 -99.200 -91.000 TRP 20 1.040 15.494 20.143 2.781 -99.200 -91.000 TRP6 20 1.020 15.598 18.371 1.217 -99.200 -91.000 HIS 21 0.900 7.915 19.617 9.677 -99.200 -91.000 HIS 36 0.900 8.474 10.751 17.506 -99.200 -91.000 TYR 38 0.840 11.771 17.830 10.948 -99.200 -91.000 PHE 49 1.000 18.845 23.669 6.951 -99.200 -91.000 PHE 54 1.000 12.430 11.084 5.881 -99.200 -91.000