============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. TYR 7 0.840 14.632 55.076 50.002 -99.200 -91.000 HIS 40 0.900 16.622 41.228 44.835 -99.200 -91.000 PHE 41 1.000 16.126 32.140 43.440 -99.200 -91.000 HIS 42 0.900 17.488 30.845 48.057 -99.200 -91.000 PHE 45 1.000 11.401 32.821 42.656 -99.200 -91.000 PHE 74 1.000 22.004 35.329 55.732 -99.200 -91.000 TRP 114 1.040 18.546 46.351 37.121 -99.200 -91.000 TRP6 114 1.020 20.099 44.576 37.289 -99.200 -91.000 PHE 138 1.000 19.484 17.194 44.842 -99.200 -91.000 PHE 148 1.000 12.089 30.864 38.161 -99.200 -91.000 HIS 165 0.900 22.562 28.543 39.033 -99.200 -91.000 PHE 167 1.000 27.676 36.350 39.642 -99.200 -91.000 PHE 175 1.000 28.831 19.304 42.284 -99.200 -91.000 PHE 180 1.000 31.383 9.441 42.653 -99.200 -91.000 PHE 182 1.000 21.202 11.725 37.606 -99.200 -91.000 PHE 224 1.000 25.546 38.292 35.100 -99.200 -91.000 TYR 228 0.840 23.871 28.679 33.370 -99.200 -91.000 PHE 229 1.000 22.269 31.355 29.564 -99.200 -91.000 PHE 246 1.000 21.838 21.830 24.521 -99.200 -91.000 TYR 262 0.840 18.826 33.979 27.087 -99.200 -91.000 PHE 269 1.000 22.817 36.069 30.584 -99.200 -91.000 PHE 270 1.000 25.702 40.707 29.826 -99.200 -91.000 PHE 273 1.000 20.754 38.582 35.310 -99.200 -91.000