============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. TYR 9 0.840 17.814 20.779 13.501 -99.200 -91.000 PHE 21 1.000 29.912 25.680 13.886 -99.200 -91.000 PHE 31 1.000 22.059 18.591 14.720 -99.200 -91.000 HIS 36 0.900 15.410 29.784 18.571 -99.200 -91.000 PHE 54 1.000 16.652 19.531 19.632 -99.200 -91.000 PHE 59 1.000 14.400 30.202 23.969 -99.200 -91.000 TRP 66 1.040 24.549 17.748 23.657 -99.200 -91.000 TRP6 66 1.020 25.181 15.595 22.996 -99.200 -91.000 PHE 84 1.000 30.556 20.948 0.671 -99.200 -91.000 TYR 108 0.840 29.173 31.362 3.731 -99.200 -91.000 TYR 122 0.840 15.369 35.996 21.488 -99.200 -91.000 TRP 146 1.040 25.891 33.414 13.316 -99.200 -91.000 TRP6 146 1.020 26.038 35.666 12.657 -99.200 -91.000 PHE 180 1.000 28.039 35.085 16.772 -99.200 -91.000 TYR 190 0.840 25.109 21.045 26.834 -99.200 -91.000