============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 4 rings ring int. center anis. iso. TYR 63 0.840 -11.531 -25.600 -29.818 -99.200 -91.000 HIS 104 0.900 -4.182 -3.842 -44.383 -99.200 -91.000 TYR 105 0.840 -13.714 -7.008 -41.689 -99.200 -91.000 PHE 145 1.000 -13.958 -5.576 -56.402 -99.200 -91.000