============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 3 rings ring int. center anis. iso. HIS 49 0.900 -0.965 -11.811 55.807 -99.200 -91.000 TRP 67 1.040 -22.828 -22.906 73.964 -99.200 -91.000 TRP6 67 1.020 -25.027 -23.806 74.062 -99.200 -91.000