============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. PHE 17 1.000 32.811 19.250 29.972 -99.200 -91.000 HIS 25 0.900 30.664 -0.000 32.737 -99.200 -91.000 HIS 30 0.900 23.855 18.768 32.074 -99.200 -91.000 HIS 38 0.900 29.040 28.748 42.805 -99.200 -91.000 TYR 39 0.840 30.243 32.965 36.940 -99.200 -91.000 TYR 55 0.840 13.535 8.722 32.638 -99.200 -91.000 TYR 64 0.840 33.238 18.252 44.982 -99.200 -91.000 TYR 66 0.840 36.635 14.739 44.168 -99.200 -91.000