============================================================================= 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. HIS 5 0.900 43.890 80.205 78.404 -99.200 -91.000 PHE 6 1.000 42.739 89.351 73.933 -99.200 -91.000 PHE 9 1.000 47.640 95.586 66.784 -99.200 -91.000 PHE 14 1.000 46.285 99.461 75.048 -99.200 -91.000 PHE 27 1.000 26.102 92.329 83.609 -99.200 -91.000 PHE 41 1.000 25.965 85.441 71.629 -99.200 -91.000 TYR 44 0.840 26.590 87.216 66.523 -99.200 -91.000