============================================================================= 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 -0.412 4.901 1.927 -99.200 -91.000 PHE 14 1.000 2.538 9.717 -5.787 -99.200 -91.000 PHE 19 1.000 6.295 -5.256 -7.031 -99.200 -91.000 PHE 40 1.000 0.264 1.470 -12.072 -99.200 -91.000 PHE 89 1.000 11.006 2.298 1.347 -99.200 -91.000 TYR 102 0.840 -5.276 -9.441 3.984 -99.200 -91.000 TRP 111 1.040 7.271 11.113 0.015 -99.200 -91.000 TRP6 111 1.020 5.667 9.577 0.843 -99.200 -91.000