============================================================================= 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 4 1.040 -59.732 -25.457 -2.188 -99.200 -91.000 TRP6 4 1.020 -59.609 -25.511 0.178 -99.200 -91.000 PHE 70 1.000 -69.548 -1.563 3.900 -99.200 -91.000 TYR 103 0.840 -43.013 1.050 2.095 -99.200 -91.000 TYR 104 0.840 -40.885 3.496 5.862 -99.200 -91.000 PHE 113 1.000 -30.407 2.583 4.855 -99.200 -91.000 PHE 119 1.000 -18.311 -11.898 14.129 -99.200 -91.000 TRP 130 1.040 -27.842 -2.904 -0.216 -99.200 -91.000 TRP6 130 1.020 -28.969 -3.054 -2.293 -99.200 -91.000 TYR 152 0.840 -24.651 8.171 22.662 -99.200 -91.000 TYR 163 0.840 -31.452 12.605 7.371 -99.200 -91.000 PHE 167 1.000 -35.827 1.985 8.304 -99.200 -91.000 HIS 175 0.900 -32.294 -19.293 18.089 -99.200 -91.000 HIS 178 0.900 -27.432 -14.712 28.485 -99.200 -91.000 TRP 203 1.040 -40.435 -3.396 12.498 -99.200 -91.000 TRP6 203 1.020 -40.523 -2.039 10.571 -99.200 -91.000 PHE 221 1.000 -32.816 -12.843 17.701 -99.200 -91.000 HIS 222 0.900 -42.102 -10.587 22.134 -99.200 -91.000 PHE 257 1.000 -42.714 -2.693 5.244 -99.200 -91.000 PHE 270 1.000 -48.734 -10.832 6.264 -99.200 -91.000 PHE 275 1.000 -48.075 -15.820 4.422 -99.200 -91.000