============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 4 0.840 29.643 43.923 31.371 -99.200 -91.000 PHE 5 1.000 26.071 35.760 31.364 -99.200 -91.000 TYR 13 0.840 11.233 26.819 14.286 -99.200 -91.000 TYR 15 0.840 2.922 17.716 17.073 -99.200 -91.000 PHE 21 1.000 10.524 22.602 11.455 -99.200 -91.000 HIS 23 0.900 11.227 17.955 11.425 -99.200 -91.000 TYR 25 0.840 14.764 25.498 2.874 -99.200 -91.000 TYR 26 0.840 15.288 24.097 11.800 -99.200 -91.000 HIS 30 0.900 16.629 29.022 8.747 -99.200 -91.000 TYR 42 0.840 28.829 23.763 20.427 -99.200 -91.000 TYR 43 0.840 24.355 24.242 12.889 -99.200 -91.000 PHE 60 1.000 9.099 24.009 22.671 -99.200 -91.000 PHE 65 1.000 21.517 29.275 15.778 -99.200 -91.000 PHE 73 1.000 21.827 35.555 18.608 -99.200 -91.000 TYR 74 0.840 21.132 40.058 21.879 -99.200 -91.000 TYR 77 0.840 21.515 46.887 12.363 -99.200 -91.000 TYR 78 0.840 26.032 45.014 10.422 -99.200 -91.000 HIS 79 0.900 24.557 39.054 7.954 -99.200 -91.000 TYR 90 0.840 12.645 26.659 8.440 -99.200 -91.000