============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 5 rings ring int. center anis. iso. HIS 43 0.900 45.122 72.015 54.945 -99.200 -91.000 TYR 46 0.840 49.847 63.574 41.084 -99.200 -91.000 TYR 64 0.840 45.432 74.439 61.174 -99.200 -91.000 TRP 67 1.040 32.845 71.391 56.384 -99.200 -91.000 TRP6 67 1.020 32.400 71.816 54.115 -99.200 -91.000