============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 7 rings ring int. center anis. iso. PHE 1 1.000 36.447 -7.848 0.232 -99.200 -91.000 HIS 5 0.900 27.832 -0.106 -0.950 -99.200 -91.000 HIS 10 0.900 19.410 -4.133 4.264 -99.200 -91.000 TYR 16 0.840 16.183 8.067 9.839 -99.200 -91.000 PHE 24 1.000 23.293 6.815 11.498 -99.200 -91.000 PHE 25 1.000 29.835 5.782 16.861 -99.200 -91.000 TYR 26 0.840 28.242 2.268 8.195 -99.200 -91.000