============================================================================= 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 17.718 20.684 13.407 -99.200 -91.000 PHE 21 1.000 29.808 25.663 13.978 -99.200 -91.000 PHE 31 1.000 22.096 18.538 14.616 -99.200 -91.000 HIS 36 0.900 15.375 29.639 18.826 -99.200 -91.000 PHE 54 1.000 16.677 19.597 19.596 -99.200 -91.000 PHE 59 1.000 14.456 30.168 24.030 -99.200 -91.000 TRP 66 1.040 24.589 17.611 23.697 -99.200 -91.000 TRP6 66 1.020 25.198 15.468 22.940 -99.200 -91.000 PHE 84 1.000 30.521 20.871 0.785 -99.200 -91.000 TYR 108 0.840 29.166 31.367 3.748 -99.200 -91.000 TYR 122 0.840 15.366 35.854 21.366 -99.200 -91.000 TRP 146 1.040 25.872 33.461 13.227 -99.200 -91.000 TRP6 146 1.020 26.057 35.731 12.604 -99.200 -91.000 PHE 180 1.000 28.043 35.075 16.838 -99.200 -91.000 TYR 190 0.840 24.952 21.113 26.718 -99.200 -91.000