============================================================================= 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 9.701 30.317 49.948 -99.200 -91.000 PHE 14 1.000 4.038 37.703 52.200 -99.200 -91.000 PHE 19 1.000 0.370 32.279 38.427 -99.200 -91.000 PHE 40 1.000 -4.410 33.139 47.467 -99.200 -91.000 PHE 89 1.000 10.751 37.898 41.015 -99.200 -91.000 TYR 102 0.840 7.139 17.933 41.738 -99.200 -91.000 TRP 111 1.040 10.988 40.337 49.820 -99.200 -91.000 TRP6 111 1.020 10.981 37.984 49.671 -99.200 -91.000