============================================================================= 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. TRP 8 1.040 -14.700 21.098 59.800 -99.200 -91.000 TRP6 8 1.020 -15.650 23.166 60.491 -99.200 -91.000 PHE 27 1.000 -5.847 20.151 63.323 -99.200 -91.000 TYR 31 0.840 -8.892 17.645 52.324 -99.200 -91.000 PHE 32 1.000 -12.499 10.594 48.836 -99.200 -91.000 TYR 50 0.840 1.172 21.370 66.363 -99.200 -91.000 PHE 59 1.000 -7.827 26.107 60.306 -99.200 -91.000 PHE 61 1.000 -5.767 20.758 57.218 -99.200 -91.000 HIS 64 0.900 2.322 10.652 53.714 -99.200 -91.000 TRP 65 1.040 -2.304 15.012 48.881 -99.200 -91.000 TRP6 65 1.020 -4.616 15.326 49.352 -99.200 -91.000 PHE 67 1.000 -4.849 10.585 46.155 -99.200 -91.000 TRP 74 1.040 -6.145 22.923 52.845 -99.200 -91.000 TRP6 74 1.020 -5.434 20.748 52.244 -99.200 -91.000 PHE 79 1.000 -12.241 34.841 60.865 -99.200 -91.000 HIS 89 0.900 -13.354 32.793 55.240 -99.200 -91.000 TRP 92 1.040 -5.652 25.082 48.497 -99.200 -91.000 TRP6 92 1.020 -4.597 24.641 46.424 -99.200 -91.000 TRP 105 1.040 11.154 26.119 37.161 -99.200 -91.000 TRP6 105 1.020 9.311 26.890 35.868 -99.200 -91.000 PHE 115 1.000 -11.813 22.905 53.805 -99.200 -91.000