============================================================================= 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. PHE 6 1.000 -20.467 -33.338 5.726 -99.200 -91.000 TRP 14 1.040 -28.370 -23.263 -7.604 -99.200 -91.000 TRP6 14 1.020 -29.171 -25.158 -8.773 -99.200 -91.000 PHE 15 1.000 -23.139 -22.245 -1.819 -99.200 -91.000 TYR 19 0.840 -14.185 -18.277 0.313 -99.200 -91.000 HIS 22 0.900 -10.550 -10.255 7.376 -99.200 -91.000 TYR 28 0.840 -18.556 -19.105 3.118 -99.200 -91.000 TRP 39 1.040 -25.816 -9.306 -13.283 -99.200 -91.000 TRP6 39 1.020 -25.435 -7.442 -11.868 -99.200 -91.000 HIS 45 0.900 -27.517 -11.409 6.944 -99.200 -91.000 PHE 47 1.000 -22.284 -9.441 0.397 -99.200 -91.000 TYR 50 0.840 -15.813 -5.407 7.436 -99.200 -91.000 TYR 56 0.840 -17.252 -8.299 0.321 -99.200 -91.000 TYR 59 0.840 -12.460 -18.938 -4.847 -99.200 -91.000 PHE 75 1.000 -16.212 -15.863 -11.834 -99.200 -91.000 HIS 83 0.900 -34.365 -3.360 -1.444 -99.200 -91.000 TYR 86 0.840 -29.968 -4.712 5.939 -99.200 -91.000 HIS 92 0.900 -30.559 -9.201 9.531 -99.200 -91.000 HIS 93 0.900 -38.331 -5.796 8.337 -99.200 -91.000 TYR 124 0.840 -46.189 -10.046 -5.740 -99.200 -91.000 PHE 129 1.000 -50.487 -24.540 4.391 -99.200 -91.000 PHE 138 1.000 -18.683 -24.393 1.421 -99.200 -91.000 TYR 146 0.840 -13.673 -20.432 17.025 -99.200 -91.000 TYR 148 0.840 -18.791 -20.594 9.368 -99.200 -91.000 HIS 162 0.900 -46.982 -13.368 7.139 -99.200 -91.000 HIS 169 0.900 -48.218 -18.485 20.890 -99.200 -91.000 TYR 170 0.840 -44.227 -21.504 14.771 -99.200 -91.000 TYR 171 0.840 -38.810 -16.494 13.971 -99.200 -91.000 TRP 187 1.040 -39.767 -27.737 15.799 -99.200 -91.000 TRP6 187 1.020 -40.287 -25.785 14.569 -99.200 -91.000 TRP 216 1.040 -35.149 -12.765 9.545 -99.200 -91.000 TRP6 216 1.020 -36.547 -13.246 11.398 -99.200 -91.000 TYR 229 0.840 -34.882 -20.056 4.417 -99.200 -91.000 HIS 234 0.900 -44.033 -11.514 -2.371 -99.200 -91.000 PHE 235 1.000 -37.458 -8.352 -1.923 -99.200 -91.000 TRP 238 1.040 -33.620 -4.028 -5.535 -99.200 -91.000 TRP6 238 1.020 -31.909 -5.641 -5.301 -99.200 -91.000 HIS 242 0.900 -31.423 -2.168 -8.213 -99.200 -91.000