============================================================================= 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 2 1.000 36.914 40.749 43.685 -99.200 -91.000 PHE 5 1.000 26.516 51.190 44.915 -99.200 -91.000 PHE 17 1.000 26.130 60.656 51.631 -99.200 -91.000 HIS 25 0.900 16.297 67.539 54.979 -99.200 -91.000 HIS 32 0.900 17.583 63.416 52.161 -99.200 -91.000 PHE 54 1.000 7.829 61.202 40.890 -99.200 -91.000 TYR 58 0.840 5.784 66.160 42.999 -99.200 -91.000 PHE 91 1.000 15.927 43.961 43.642 -99.200 -91.000 TYR 99 0.840 30.585 46.227 35.407 -99.200 -91.000 HIS 104 0.900 21.197 46.690 38.766 -99.200 -91.000 TYR 123 0.840 0.633 63.927 48.198 -99.200 -91.000