============================================================================= 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 28.397 7.683 16.867 -99.200 -91.000 PHE 14 1.000 34.731 4.975 23.533 -99.200 -91.000 PHE 19 1.000 36.201 -3.564 10.840 -99.200 -91.000 PHE 40 1.000 42.321 3.114 15.859 -99.200 -91.000 PHE 89 1.000 26.608 -3.874 18.249 -99.200 -91.000 TYR 102 0.840 28.963 7.726 1.973 -99.200 -91.000 TRP 111 1.040 27.812 2.190 25.363 -99.200 -91.000 TRP6 111 1.020 27.522 3.343 23.317 -99.200 -91.000