============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 6 rings ring int. center anis. iso. TRP 15 1.040 30.600 -19.818 16.833 -99.200 -91.000 TRP6 15 1.020 28.311 -19.885 17.411 -99.200 -91.000 TYR 20 0.840 21.437 -11.352 9.356 -99.200 -91.000 PHE 25 1.000 9.949 -7.358 0.872 -99.200 -91.000 PHE 34 1.000 23.519 -23.173 15.127 -99.200 -91.000 PHE 58 1.000 23.639 -20.977 21.009 -99.200 -91.000