============================================================================= 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 6 1.000 28.407 7.706 16.931 -99.200 -91.000 PHE 14 1.000 34.749 4.973 23.598 -99.200 -91.000 PHE 19 1.000 36.225 -3.528 10.859 -99.200 -91.000 PHE 40 1.000 42.350 3.138 15.915 -99.200 -91.000 PHE 89 1.000 26.638 -3.870 18.279 -99.200 -91.000 TYR 102 0.840 28.969 7.769 1.964 -99.200 -91.000 TRP 111 1.040 27.807 2.168 25.412 -99.200 -91.000 TRP6 111 1.020 27.535 3.324 23.375 -99.200 -91.000