============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 28 rings ring int. center anis. iso. TYR 27 0.840 27.002 -26.219 9.402 -99.200 -91.000 PHE 29 1.000 19.791 -25.897 9.643 -99.200 -91.000 TYR 32 0.840 28.521 -22.350 12.021 -99.200 -91.000 HIS 35 0.900 24.533 -14.299 6.891 -99.200 -91.000 TRP 36 1.040 18.985 -17.947 2.442 -99.200 -91.000 TRP6 36 1.020 18.572 -19.771 1.006 -99.200 -91.000 TRP 47 1.040 23.088 -10.454 3.617 -99.200 -91.000 TRP6 47 1.020 21.515 -9.453 5.049 -99.200 -91.000 TYR 52 0.840 20.944 -18.693 15.970 -99.200 -91.000 TYR 60 0.840 13.362 -11.667 6.184 -99.200 -91.000 PHE 64 1.000 16.689 -8.654 -2.675 -99.200 -91.000 TYR 80 0.840 13.053 -26.051 3.285 -99.200 -91.000 TYR 93 0.840 17.618 -15.804 -6.059 -99.200 -91.000 PHE 94 1.000 25.647 -18.273 -5.848 -99.200 -91.000 TYR 108 0.840 33.307 -25.395 4.721 -99.200 -91.000 TRP 109 1.040 30.601 -19.107 -0.087 -99.200 -91.000 TRP6 109 1.020 29.467 -17.113 -0.623 -99.200 -91.000 TYR 128 0.840 13.090 -19.180 -38.767 -99.200 -91.000 TYR 147 0.840 15.681 -22.080 -27.022 -99.200 -91.000 PHE 148 1.000 10.709 -21.395 -20.455 -99.200 -91.000 TRP 156 1.040 27.641 -25.260 -37.013 -99.200 -91.000 TRP6 156 1.020 26.153 -24.195 -38.511 -99.200 -91.000 HIS 166 0.900 33.479 -17.834 -32.434 -99.200 -91.000 PHE 168 1.000 27.890 -15.507 -31.226 -99.200 -91.000 TYR 177 0.840 15.858 -19.173 -22.174 -99.200 -91.000 TRP 190 1.040 28.318 -23.617 -48.157 -99.200 -91.000 TRP6 190 1.020 27.567 -21.461 -48.768 -99.200 -91.000 HIS 201 0.900 13.506 -26.913 -26.524 -99.200 -91.000