============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. TYR 26 0.840 17.143 32.672 10.619 -99.200 -91.000 TYR 29 0.840 19.899 38.029 4.364 -99.200 -91.000 HIS 49 0.900 13.967 22.610 -2.692 -99.200 -91.000 TRP 60 1.040 18.244 15.688 6.981 -99.200 -91.000 TRP6 60 1.020 17.540 13.599 7.831 -99.200 -91.000 PHE 61 1.000 21.195 16.808 13.930 -99.200 -91.000 TYR 84 0.840 26.176 21.408 13.503 -99.200 -91.000 HIS 92 0.900 12.247 26.441 20.760 -99.200 -91.000 TRP 111 1.040 -6.483 22.443 26.545 -99.200 -91.000 TRP6 111 1.020 -7.475 24.583 26.518 -99.200 -91.000 PHE 123 1.000 10.690 22.528 30.609 -99.200 -91.000 PHE 143 1.000 10.862 30.255 23.815 -99.200 -91.000 TRP 156 1.040 -8.452 32.900 17.687 -99.200 -91.000 TRP6 156 1.020 -6.856 32.183 16.104 -99.200 -91.000 TYR 159 0.840 -1.738 29.328 18.032 -99.200 -91.000 PHE 164 1.000 -2.734 35.499 27.252 -99.200 -91.000 TYR 177 0.840 19.538 31.072 30.877 -99.200 -91.000 TYR 207 0.840 10.285 34.830 11.814 -99.200 -91.000 TRP 209 1.040 16.775 43.970 14.611 -99.200 -91.000 TRP6 209 1.020 15.519 43.757 16.598 -99.200 -91.000 PHE 223 1.000 11.297 42.577 19.446 -99.200 -91.000