============================================================================= 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. TYR 6 0.840 34.611 6.273 10.987 -99.200 -91.000 HIS 26 0.900 34.647 18.846 24.729 -99.200 -91.000 TYR 27 0.840 37.958 18.667 14.809 -99.200 -91.000 TYR 36 0.840 29.685 16.190 7.795 -99.200 -91.000 TYR 37 0.840 22.969 20.858 8.799 -99.200 -91.000 TYR 42 0.840 33.146 8.073 19.814 -99.200 -91.000 TRP 45 1.040 41.604 2.861 14.483 -99.200 -91.000 TRP6 45 1.020 42.507 2.215 16.568 -99.200 -91.000 TYR 49 0.840 30.549 5.857 14.323 -99.200 -91.000 PHE 51 1.000 27.305 7.682 18.361 -99.200 -91.000 TYR 69 0.840 36.766 0.884 19.183 -99.200 -91.000