============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. PHE 20 1.000 12.936 40.255 42.693 -99.200 -91.000 TRP 32 1.040 4.765 37.492 45.533 -99.200 -91.000 TRP6 32 1.020 5.001 39.650 44.632 -99.200 -91.000 HIS 43 0.900 19.193 25.682 51.325 -99.200 -91.000 PHE 45 1.000 16.252 34.775 47.680 -99.200 -91.000 HIS 46 0.900 24.398 35.569 48.775 -99.200 -91.000 HIS 48 0.900 26.263 36.003 43.530 -99.200 -91.000 PHE 50 1.000 29.632 41.201 36.280 -99.200 -91.000 HIS 63 0.900 27.598 38.142 48.061 -99.200 -91.000 PHE 64 1.000 23.783 45.945 42.222 -99.200 -91.000 HIS 71 0.900 27.416 38.705 52.863 -99.200 -91.000 HIS 80 0.900 28.682 42.926 49.788 -99.200 -91.000 HIS 110 0.900 20.927 51.535 46.498 -99.200 -91.000 HIS 120 0.900 25.218 31.152 47.352 -99.200 -91.000