============================================================================= 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 34 0.900 71.527 42.413 14.816 -99.200 -91.000 TYR 68 0.840 62.130 28.755 13.592 -99.200 -91.000 TYR 77 0.840 57.383 30.943 30.622 -99.200 -91.000 PHE 81 1.000 55.839 26.406 29.292 -99.200 -91.000 PHE 82 1.000 50.224 23.106 33.675 -99.200 -91.000