============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. TYR 14 0.840 1.634 -5.150 4.310 -99.200 -91.000 TYR 39 0.840 6.902 5.439 -3.622 -99.200 -91.000 HIS 41 0.900 9.841 8.215 -2.908 -99.200 -91.000 TYR 43 0.840 14.912 4.783 6.658 -99.200 -91.000 TYR 44 0.840 18.196 10.371 2.872 -99.200 -91.000 TRP 60 1.040 20.364 1.906 5.357 -99.200 -91.000 TRP6 60 1.020 20.862 3.573 6.958 -99.200 -91.000 PHE 63 1.000 8.962 -0.695 -4.939 -99.200 -91.000 TYR 67 0.840 -2.123 -6.964 2.442 -99.200 -91.000 TYR 71 0.840 3.928 1.686 -6.014 -99.200 -91.000 TYR 72 0.840 1.444 -2.722 -11.470 -99.200 -91.000 TYR 78 0.840 1.335 6.856 -11.281 -99.200 -91.000 TYR 88 0.840 15.685 -1.556 -1.550 -99.200 -91.000 PHE 95 1.000 13.507 -6.867 6.411 -99.200 -91.000 HIS 101 0.900 4.891 7.852 5.526 -99.200 -91.000 TYR 107 0.840 2.480 15.887 6.348 -99.200 -91.000 PHE 110 1.000 8.785 6.120 6.132 -99.200 -91.000