============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. PHE 6 1.000 -41.906 -22.510 20.719 -99.200 -91.000 PHE 7 1.000 -45.467 -26.402 20.312 -99.200 -91.000 HIS 27 0.900 -23.675 -14.030 30.329 -99.200 -91.000 TRP 32 1.040 -26.683 -26.901 19.739 -99.200 -91.000 TRP6 32 1.020 -25.913 -25.797 17.802 -99.200 -91.000 TYR 35 0.840 -28.512 -30.025 22.553 -99.200 -91.000 HIS 52 0.900 -21.716 -23.368 36.887 -99.200 -91.000 PHE 83 1.000 -42.722 -17.966 17.181 -99.200 -91.000 PHE 91 1.000 -30.586 -22.129 36.029 -99.200 -91.000 PHE 98 1.000 -31.659 -33.635 35.777 -99.200 -91.000 PHE 104 1.000 -29.719 -33.179 25.464 -99.200 -91.000 TRP 106 1.040 -24.291 -32.770 27.596 -99.200 -91.000 TRP6 106 1.020 -25.536 -30.775 27.715 -99.200 -91.000 TYR 122 0.840 -37.818 -10.037 10.171 -99.200 -91.000