============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 7 rings ring int. center anis. iso. PHE 2 1.000 30.285 23.419 -62.794 -99.200 -91.000 PHE 11 1.000 35.426 12.889 -34.607 -99.200 -91.000 PHE 24 1.000 47.123 8.826 -36.936 -99.200 -91.000 TRP 46 1.040 35.481 15.511 -39.256 -99.200 -91.000 TRP6 46 1.020 33.446 15.765 -38.091 -99.200 -91.000 TRP 60 1.040 45.201 -1.550 -42.674 -99.200 -91.000 TRP6 60 1.020 42.971 -1.944 -42.020 -99.200 -91.000