============================================================================= 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 9.721 -40.095 27.805 -99.200 -91.000 TRP6 6 1.020 11.674 -41.408 28.050 -99.200 -91.000 TRP 42 1.040 7.918 -15.354 57.335 -99.200 -91.000 TRP6 42 1.020 7.743 -13.424 55.996 -99.200 -91.000 PHE 53 1.000 14.150 -8.658 39.321 -99.200 -91.000 TYR 59 0.840 8.615 -20.030 55.771 -99.200 -91.000 HIS 69 0.900 17.747 -40.116 47.640 -99.200 -91.000 PHE 99 1.000 24.714 -34.145 27.957 -99.200 -91.000