============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. HIS 5 0.900 34.320 -14.953 -22.370 -99.200 -91.000 HIS 10 0.900 37.555 0.927 -24.154 -99.200 -91.000 PHE 12 1.000 38.215 8.556 -29.402 -99.200 -91.000 TRP 33 1.040 25.103 -15.438 -20.650 -99.200 -91.000 TRP6 33 1.020 25.364 -16.152 -22.870 -99.200 -91.000 HIS 35 0.900 31.765 -10.410 -16.710 -99.200 -91.000 PHE 40 1.000 39.559 -2.875 -27.569 -99.200 -91.000 TYR 85 0.840 34.170 -0.099 -37.911 -99.200 -91.000 PHE 100 1.000 23.171 -4.748 -26.557 -99.200 -91.000 HIS 123 0.900 22.214 5.187 -33.316 -99.200 -91.000 TRP 125 1.040 13.984 8.216 -31.459 -99.200 -91.000 TRP6 125 1.020 13.530 7.570 -33.672 -99.200 -91.000 HIS 126 0.900 16.553 13.612 -30.144 -99.200 -91.000 TRP 138 1.040 24.867 -1.929 -41.011 -99.200 -91.000 TRP6 138 1.020 24.611 -3.508 -39.277 -99.200 -91.000 HIS 153 0.900 27.892 8.018 -29.967 -99.200 -91.000 HIS 158 0.900 17.065 6.599 -22.644 -99.200 -91.000 PHE 166 1.000 24.995 -8.195 -23.317 -99.200 -91.000