============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. PHE 8 1.000 3.669 -0.352 22.933 -99.200 -91.000 PHE 23 1.000 6.975 13.143 22.872 -99.200 -91.000 TYR 27 0.840 2.112 14.247 18.097 -99.200 -91.000 PHE 38 1.000 6.444 12.025 1.035 -99.200 -91.000 PHE 65 1.000 -3.594 12.593 2.814 -99.200 -91.000 PHE 72 1.000 0.753 -3.995 19.284 -99.200 -91.000 HIS 75 0.900 -5.943 -1.622 27.410 -99.200 -91.000 HIS 100 0.900 4.411 -7.679 12.766 -99.200 -91.000 TYR 108 0.840 -8.081 2.183 1.470 -99.200 -91.000 PHE 119 1.000 12.319 4.256 15.785 -99.200 -91.000 PHE 120 1.000 8.233 0.934 21.115 -99.200 -91.000 TRP 121 1.040 5.997 -1.837 14.056 -99.200 -91.000 TRP6 121 1.020 6.118 -0.849 11.920 -99.200 -91.000 PHE 128 1.000 9.163 -1.235 6.963 -99.200 -91.000 TYR 132 0.840 6.270 -2.153 -2.477 -99.200 -91.000 TYR 142 0.840 8.062 11.845 6.941 -99.200 -91.000 PHE 147 1.000 11.307 13.921 19.568 -99.200 -91.000 TRP 166 1.040 13.142 9.577 25.169 -99.200 -91.000 TRP6 166 1.020 14.381 11.459 24.529 -99.200 -91.000 PHE 169 1.000 13.609 2.882 22.711 -99.200 -91.000 PHE 182 1.000 13.742 -0.595 10.338 -99.200 -91.000 TYR 194 0.840 15.423 1.690 -0.035 -99.200 -91.000 PHE 203 1.000 15.071 5.502 10.607 -99.200 -91.000 TRP 204 1.040 10.951 11.175 9.735 -99.200 -91.000 TRP6 204 1.020 8.990 10.578 10.904 -99.200 -91.000