============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. TYR 6 0.840 -7.401 -5.674 -10.538 -99.200 -91.000 PHE 13 1.000 -17.357 -16.019 -18.930 -99.200 -91.000 PHE 19 1.000 -26.599 -27.478 -18.373 -99.200 -91.000 PHE 22 1.000 -27.440 -34.343 -19.314 -99.200 -91.000 HIS 26 0.900 -31.012 -37.033 -19.354 -99.200 -91.000 TYR 42 0.840 -19.272 -26.181 -14.576 -99.200 -91.000 PHE 45 1.000 -14.090 -27.844 -15.746 -99.200 -91.000 PHE 56 1.000 1.916 -18.906 -11.043 -99.200 -91.000 TYR 58 0.840 -9.904 -14.587 -7.185 -99.200 -91.000 TYR 67 0.840 -14.905 -23.596 -12.946 -99.200 -91.000 HIS 79 0.900 5.405 -14.912 -16.288 -99.200 -91.000 HIS 80 0.900 -2.034 -11.366 -19.070 -99.200 -91.000 HIS 86 0.900 0.766 -24.516 -19.556 -99.200 -91.000 HIS 112 0.900 -10.916 -10.523 -25.443 -99.200 -91.000 TYR 128 0.840 -13.105 -9.567 -6.869 -99.200 -91.000 PHE 131 1.000 -19.671 -5.332 -12.409 -99.200 -91.000 TYR 155 0.840 -8.041 -7.566 -28.984 -99.200 -91.000 TYR 157 0.840 -1.689 -16.365 -32.194 -99.200 -91.000 PHE 170 1.000 0.266 -22.399 -23.862 -99.200 -91.000 HIS 171 0.900 -1.392 -27.930 -32.940 -99.200 -91.000 HIS 174 0.900 -6.383 -17.803 -38.752 -99.200 -91.000 TRP 190 1.040 -4.435 -18.366 -34.107 -99.200 -91.000 TRP6 190 1.020 -4.943 -16.079 -34.271 -99.200 -91.000 PHE 191 1.000 -10.757 -23.984 -33.758 -99.200 -91.000