============================================================================= 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. TYR 4 0.840 5.988 61.324 3.813 -99.200 -91.000 PHE 7 1.000 3.531 52.777 -0.449 -99.200 -91.000 PHE 12 1.000 8.684 52.383 6.892 -99.200 -91.000 PHE 25 1.000 22.199 70.992 9.188 -99.200 -91.000 TYR 41 0.840 14.915 70.351 -7.486 -99.200 -91.000