============================================================================= 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 1 0.840 11.153 29.441 50.746 -99.200 -91.000 PHE 4 1.000 10.677 19.767 52.741 -99.200 -91.000 PHE 9 1.000 18.986 23.238 52.495 -99.200 -91.000 PHE 22 1.000 19.740 41.012 37.793 -99.200 -91.000 TYR 38 0.840 4.917 31.631 35.066 -99.200 -91.000