============================================================================= 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. TYR 2 0.840 0.621 -2.667 37.904 -99.200 -91.000 PHE 60 1.000 14.592 -2.230 28.798 -99.200 -91.000 PHE 74 1.000 19.681 20.370 46.819 -99.200 -91.000 PHE 78 1.000 18.069 16.845 50.596 -99.200 -91.000 PHE 82 1.000 12.432 13.293 39.644 -99.200 -91.000 PHE 83 1.000 15.146 9.850 37.873 -99.200 -91.000 TRP 86 1.040 13.494 4.341 38.500 -99.200 -91.000 TRP6 86 1.020 12.390 2.641 37.277 -99.200 -91.000 TYR 103 0.840 16.044 4.473 19.158 -99.200 -91.000 PHE 126 1.000 22.226 -1.705 25.302 -99.200 -91.000 PHE 214 1.000 29.293 -5.435 40.332 -99.200 -91.000 TYR 224 0.840 27.052 -12.138 51.813 -99.200 -91.000 PHE 229 1.000 29.418 -24.268 48.783 -99.200 -91.000 HIS 230 0.900 31.058 -22.761 54.818 -99.200 -91.000 PHE 233 1.000 26.817 -27.743 51.275 -99.200 -91.000 PHE 245 1.000 26.270 -34.730 39.122 -99.200 -91.000 PHE 253 1.000 16.335 -28.194 42.320 -99.200 -91.000 HIS 255 0.900 11.140 -23.728 43.827 -99.200 -91.000