============================================================================= 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 7 0.900 12.660 55.997 37.899 -99.200 -91.000 TYR 16 0.840 16.861 57.060 30.345 -99.200 -91.000 TYR 21 0.840 20.260 55.106 18.883 -99.200 -91.000 PHE 23 1.000 27.951 62.923 22.402 -99.200 -91.000 PHE 24 1.000 29.163 57.610 21.059 -99.200 -91.000