============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 38 rings ring int. center anis. iso. HIS 15 0.900 -20.579 -21.798 -6.003 -99.200 -91.000 TYR 22 0.840 -29.069 -3.439 0.446 -99.200 -91.000 HIS 26 0.900 -25.979 -6.037 3.339 -99.200 -91.000 PHE 29 1.000 -17.898 -14.965 0.296 -99.200 -91.000 TYR 35 0.840 -22.280 -14.316 9.131 -99.200 -91.000 TRP 49 1.040 -28.604 -13.730 -0.450 -99.200 -91.000 TRP6 49 1.020 -30.718 -14.589 -1.080 -99.200 -91.000 TYR 59 0.840 -32.231 -17.850 -8.314 -99.200 -91.000 PHE 70 1.000 -30.281 -31.756 -0.638 -99.200 -91.000 TRP 84 1.040 -39.656 -12.366 9.796 -99.200 -91.000 TRP6 84 1.020 -39.326 -10.767 11.521 -99.200 -91.000 TYR 88 0.840 -38.959 -22.127 2.738 -99.200 -91.000 TYR 92 0.840 -36.864 -31.972 -6.226 -99.200 -91.000 TRP 99 1.040 -32.872 -27.340 -11.919 -99.200 -91.000 TRP6 99 1.020 -32.428 -26.609 -9.719 -99.200 -91.000 PHE 100 1.000 -38.242 -33.098 -12.057 -99.200 -91.000 TYR 102 0.840 -41.553 -30.098 -0.393 -99.200 -91.000 HIS 120 0.900 -41.400 -28.430 5.010 -99.200 -91.000 PHE 121 1.000 -36.980 -32.906 9.925 -99.200 -91.000 PHE 122 1.000 -37.010 -30.646 1.805 -99.200 -91.000 HIS 134 0.900 -36.596 -20.271 -6.696 -99.200 -91.000 TRP 138 1.040 -40.382 -9.594 1.142 -99.200 -91.000 TRP6 138 1.020 -40.884 -10.609 -0.933 -99.200 -91.000 HIS 141 0.900 -33.970 -6.361 1.382 -99.200 -91.000 PHE 148 1.000 -30.977 -26.289 1.386 -99.200 -91.000 TYR 149 0.840 -30.254 -29.361 9.312 -99.200 -91.000 TYR 165 0.840 -5.178 -69.490 -17.666 -99.200 -91.000 PHE 187 1.000 -5.913 -53.738 -5.676 -99.200 -91.000 PHE 189 1.000 -7.167 -46.208 -8.805 -99.200 -91.000 PHE 191 1.000 -8.677 -49.847 -4.547 -99.200 -91.000 PHE 201 1.000 -13.459 -70.690 -9.230 -99.200 -91.000 PHE 227 1.000 -6.214 -59.586 -5.487 -99.200 -91.000 PHE 231 1.000 -6.235 -68.545 -10.026 -99.200 -91.000 TYR 232 0.840 -8.772 -72.467 -2.443 -99.200 -91.000 TRP 234 1.040 -10.516 -79.549 -0.595 -99.200 -91.000 TRP6 234 1.020 -11.504 -77.767 -1.807 -99.200 -91.000 TYR 240 0.840 -4.803 -77.925 -18.995 -99.200 -91.000 TYR 246 0.840 -8.448 -57.283 -9.531 -99.200 -91.000