============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 37 rings ring int. center anis. iso. PHE 4 1.000 -24.241 -19.929 -22.087 -99.200 -91.000 PHE 28 1.000 -25.289 -24.385 -39.604 -99.200 -91.000 PHE 30 1.000 -27.711 -20.170 -43.649 -99.200 -91.000 TYR 37 0.840 -21.437 -21.002 -42.008 -99.200 -91.000 PHE 53 1.000 -14.489 -3.021 -42.656 -99.200 -91.000 PHE 62 1.000 -7.262 -18.768 -36.235 -99.200 -91.000 PHE 65 1.000 -20.929 -14.587 -40.804 -99.200 -91.000 HIS 69 0.900 -18.072 -0.706 -36.680 -99.200 -91.000 HIS 71 0.900 -22.416 3.093 -35.496 -99.200 -91.000 TYR 72 0.840 -15.628 -0.443 -40.012 -99.200 -91.000 TRP 77 1.040 -18.838 -1.725 -44.965 -99.200 -91.000 TRP6 77 1.020 -19.227 -4.051 -44.830 -99.200 -91.000 PHE 80 1.000 -12.182 -6.485 -44.680 -99.200 -91.000 HIS 90 0.900 -17.739 -18.083 -43.890 -99.200 -91.000 PHE 102 1.000 -33.611 -1.354 -46.465 -99.200 -91.000 TYR 117 0.840 -24.045 -15.446 -44.630 -99.200 -91.000 TYR 126 0.840 -39.882 -11.202 -27.511 -99.200 -91.000 HIS 129 0.900 -41.198 0.277 -37.327 -99.200 -91.000 PHE 130 1.000 -36.114 -7.035 -35.831 -99.200 -91.000 PHE 133 1.000 -35.477 -3.114 -41.207 -99.200 -91.000 PHE 141 1.000 -30.985 -5.920 -50.129 -99.200 -91.000 HIS 144 0.900 -28.010 -10.080 -50.362 -99.200 -91.000 TYR 188 0.840 -36.883 -17.636 -21.157 -99.200 -91.000 HIS 202 0.900 -32.109 -26.360 -34.426 -99.200 -91.000 HIS 207 0.900 -30.032 -23.175 -40.072 -99.200 -91.000 PHE 224 1.000 -20.900 -23.634 -31.363 -99.200 -91.000 PHE 230 1.000 -24.364 -19.602 -37.922 -99.200 -91.000 HIS 240 0.900 -8.648 -10.341 -28.032 -99.200 -91.000 TYR 255 0.840 -6.329 -0.847 -17.464 -99.200 -91.000 PHE 258 1.000 -17.031 -5.168 -24.865 -99.200 -91.000 TYR 259 0.840 -18.021 1.955 -26.694 -99.200 -91.000 TYR 270 0.840 -21.293 5.179 -32.921 -99.200 -91.000 TYR 277 0.840 -37.448 8.554 -26.098 -99.200 -91.000 PHE 289 1.000 -3.209 -4.721 -26.206 -99.200 -91.000 HIS 295 0.900 -1.132 -15.326 -29.662 -99.200 -91.000 TYR 310 0.840 -12.537 -34.209 -21.404 -99.200 -91.000 PHE 325 1.000 -26.281 -28.765 -21.573 -99.200 -91.000