============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 29 rings ring int. center anis. iso. TRP 27 1.040 -19.309 -28.445 21.054 -99.200 -91.000 TRP6 27 1.020 -17.594 -30.064 20.901 -99.200 -91.000 TYR 35 0.840 -16.567 -37.988 12.493 -99.200 -91.000 TYR 43 0.840 -7.717 -44.371 28.576 -99.200 -91.000 TYR 60 0.840 -19.865 -35.551 21.340 -99.200 -91.000 PHE 65 1.000 -20.606 -26.349 13.935 -99.200 -91.000 HIS 69 0.900 -10.883 -35.358 17.881 -99.200 -91.000 PHE 87 1.000 -11.482 -30.970 11.982 -99.200 -91.000 TYR 92 0.840 -25.479 -26.032 6.413 -99.200 -91.000 PHE 97 1.000 -13.624 -23.215 19.339 -99.200 -91.000 TYR 128 0.840 -18.374 -16.799 12.056 -99.200 -91.000 PHE 140 1.000 -5.342 -12.687 26.794 -99.200 -91.000 TRP 149 1.040 2.648 -25.090 12.363 -99.200 -91.000 TRP6 149 1.020 0.524 -25.140 13.386 -99.200 -91.000 PHE 153 1.000 -3.888 -21.577 13.973 -99.200 -91.000 TYR 156 0.840 -11.044 -10.515 14.785 -99.200 -91.000 PHE 159 1.000 1.410 -19.514 20.458 -99.200 -91.000 PHE 171 1.000 -7.221 -18.951 25.697 -99.200 -91.000 PHE 178 1.000 -12.363 -16.198 19.661 -99.200 -91.000 HIS 182 0.900 -18.133 -21.797 14.625 -99.200 -91.000 HIS 184 0.900 -27.250 -15.720 16.279 -99.200 -91.000 HIS 200 0.900 -16.638 -21.401 2.594 -99.200 -91.000 HIS 206 0.900 -3.299 -24.068 3.202 -99.200 -91.000 TYR 207 0.840 -7.647 -25.611 10.870 -99.200 -91.000 PHE 225 1.000 0.039 -44.059 21.801 -99.200 -91.000 TRP 229 1.040 -0.710 -44.983 17.842 -99.200 -91.000 TRP6 229 1.020 -1.295 -42.843 18.714 -99.200 -91.000 TYR 233 0.840 -4.476 -39.654 17.970 -99.200 -91.000 PHE 239 1.000 -4.975 -31.335 13.288 -99.200 -91.000