============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. HIS 10 0.900 42.246 -3.270 38.350 -99.200 -91.000 TYR 14 0.840 40.589 -6.590 26.825 -99.200 -91.000 HIS 24 0.900 35.392 6.994 28.897 -99.200 -91.000 TRP 35 1.040 51.487 1.699 17.946 -99.200 -91.000 TRP6 35 1.020 50.871 3.630 16.718 -99.200 -91.000 HIS 41 0.900 33.577 9.532 12.477 -99.200 -91.000 HIS 57 0.900 36.367 -2.002 38.115 -99.200 -91.000 TYR 69 0.840 51.088 4.607 29.797 -99.200 -91.000 HIS 77 0.900 41.251 3.250 7.037 -99.200 -91.000 HIS 87 0.900 36.449 2.963 5.159 -99.200 -91.000 TRP 109 1.040 45.443 -7.010 16.203 -99.200 -91.000 TRP6 109 1.020 45.389 -7.099 13.841 -99.200 -91.000 TRP 127 1.040 35.226 3.184 32.931 -99.200 -91.000 TRP6 127 1.020 37.070 2.401 31.688 -99.200 -91.000 HIS 132 0.900 16.842 4.897 26.911 -99.200 -91.000 HIS 142 0.900 30.932 -7.881 31.805 -99.200 -91.000 HIS 157 0.900 16.365 -5.554 12.239 -99.200 -91.000 HIS 158 0.900 21.542 0.054 12.226 -99.200 -91.000 TYR 211 0.840 29.274 -3.733 18.492 -99.200 -91.000 TYR 217 0.840 38.778 -1.178 8.475 -99.200 -91.000 TRP 220 1.040 45.157 2.273 8.877 -99.200 -91.000 TRP6 220 1.020 44.055 2.435 10.962 -99.200 -91.000