============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. TRP 6 1.040 9.829 -1.620 34.335 -99.200 -91.000 TRP6 6 1.020 12.177 -1.723 34.109 -99.200 -91.000 TRP 42 1.040 -15.912 -0.978 4.490 -99.200 -91.000 TRP6 42 1.020 -14.406 -1.788 2.854 -99.200 -91.000 PHE 53 1.000 3.775 -0.239 1.965 -99.200 -91.000 TYR 59 0.840 -14.926 0.460 9.250 -99.200 -91.000 HIS 69 0.900 -8.186 9.785 29.923 -99.200 -91.000 PHE 99 1.000 13.611 10.556 27.510 -99.200 -91.000