============================================================================= 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. TYR 7 0.840 4.884 20.346 6.479 -99.200 -91.000 TYR 16 0.840 18.304 29.022 2.814 -99.200 -91.000 PHE 17 1.000 15.845 25.916 -6.886 -99.200 -91.000 PHE 33 1.000 5.510 29.094 3.538 -99.200 -91.000 PHE 38 1.000 -0.949 24.104 -0.059 -99.200 -91.000 HIS 47 0.900 -5.517 18.346 -3.242 -99.200 -91.000 PHE 56 1.000 -11.032 24.986 2.310 -99.200 -91.000 TRP 67 1.040 -2.211 18.168 9.180 -99.200 -91.000 TRP6 67 1.020 -1.086 20.185 8.743 -99.200 -91.000 TYR 78 0.840 -9.571 8.892 6.683 -99.200 -91.000 HIS 79 0.900 -12.683 14.489 3.617 -99.200 -91.000 PHE 87 1.000 -0.020 24.571 5.349 -99.200 -91.000 PHE 99 1.000 16.215 31.278 8.688 -99.200 -91.000 TYR 103 0.840 2.245 34.424 9.246 -99.200 -91.000