============================================================================= 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 26.470 38.753 44.311 -99.200 -91.000 PHE 14 1.000 32.835 36.024 50.985 -99.200 -91.000 PHE 19 1.000 34.292 27.516 38.256 -99.200 -91.000 PHE 40 1.000 40.425 34.154 43.250 -99.200 -91.000 PHE 89 1.000 24.699 27.194 45.689 -99.200 -91.000 TYR 102 0.840 27.061 38.852 29.348 -99.200 -91.000 TRP 111 1.040 25.907 33.269 52.774 -99.200 -91.000 TRP6 111 1.020 25.648 34.385 50.723 -99.200 -91.000