============================================================================= 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. PHE 6 1.000 -12.871 -17.604 -5.175 -99.200 -91.000 PHE 25 1.000 -21.511 -13.195 -5.343 -99.200 -91.000 TRP 29 1.040 -9.785 -12.983 0.553 -99.200 -91.000 TRP6 29 1.020 -10.744 -14.541 -0.935 -99.200 -91.000 PHE 54 1.000 -24.674 -11.351 -1.204 -99.200 -91.000 TYR 55 0.840 -27.490 -15.128 -4.567 -99.200 -91.000