============================================================================= 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 6 1.000 18.536 -9.710 24.576 -99.200 -91.000 TRP 14 1.040 6.660 -2.723 14.635 -99.200 -91.000 TRP6 14 1.020 8.529 -1.455 14.060 -99.200 -91.000 HIS 32 0.900 20.093 -8.951 10.728 -99.200 -91.000 PHE 36 1.000 25.130 -2.613 24.292 -99.200 -91.000 PHE 40 1.000 17.777 -14.520 22.916 -99.200 -91.000 HIS 64 0.900 14.159 -22.392 15.268 -99.200 -91.000 TRP 98 1.040 10.948 -8.038 38.254 -99.200 -91.000 TRP6 98 1.020 9.353 -9.724 38.684 -99.200 -91.000 HIS 101 0.900 11.454 -17.051 27.377 -99.200 -91.000 TYR 102 0.840 6.436 -12.040 25.441 -99.200 -91.000 TYR 106 0.840 1.674 -25.400 18.357 -99.200 -91.000 PHE 108 1.000 -1.127 -27.427 28.728 -99.200 -91.000 TRP 116 1.040 -4.806 -27.995 26.931 -99.200 -91.000 TRP6 116 1.020 -5.012 -30.022 28.127 -99.200 -91.000 TYR 128 0.840 7.471 -23.160 19.186 -99.200 -91.000 HIS 146 0.900 10.046 -17.339 36.778 -99.200 -91.000 PHE 149 1.000 3.512 -12.258 30.620 -99.200 -91.000 TRP 153 1.040 -3.587 -21.135 17.367 -99.200 -91.000 TRP6 153 1.020 -5.766 -21.639 16.680 -99.200 -91.000 TYR 155 0.840 -3.752 -11.264 15.701 -99.200 -91.000 PHE 162 1.000 -4.712 -19.470 9.530 -99.200 -91.000 TYR 183 0.840 -12.994 -27.270 18.573 -99.200 -91.000 HIS 198 0.900 -1.337 -1.556 31.408 -99.200 -91.000 TYR 213 0.840 1.184 -14.775 35.931 -99.200 -91.000 HIS 214 0.900 -1.890 -21.696 30.436 -99.200 -91.000 TRP 223 1.040 -5.082 -23.270 13.194 -99.200 -91.000 TRP6 223 1.020 -3.793 -21.290 13.499 -99.200 -91.000 HIS 224 0.900 -13.200 -23.560 7.125 -99.200 -91.000 TYR 226 0.840 -6.904 -16.412 12.755 -99.200 -91.000 PHE 231 1.000 -10.272 -16.464 3.296 -99.200 -91.000 TYR 254 0.840 -4.577 -31.321 1.824 -99.200 -91.000 PHE 271 1.000 -1.897 -11.129 32.136 -99.200 -91.000 PHE 275 1.000 0.627 -9.897 36.090 -99.200 -91.000 TRP 282 1.040 -11.485 -15.571 18.475 -99.200 -91.000 TRP6 282 1.020 -11.527 -15.338 16.109 -99.200 -91.000 PHE 294 1.000 -8.634 -6.090 4.849 -99.200 -91.000