============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 36 rings ring int. center anis. iso. HIS 14 0.900 -41.447 128.910 -29.255 -99.200 -91.000 HIS 15 0.900 -37.448 127.221 -27.364 -99.200 -91.000 PHE 18 1.000 -43.390 128.685 -17.483 -99.200 -91.000 TRP 24 1.040 -50.681 118.074 -9.290 -99.200 -91.000 TRP6 24 1.020 -48.349 118.269 -8.936 -99.200 -91.000 TYR 60 0.840 -24.903 134.435 -13.092 -99.200 -91.000 HIS 66 0.900 -38.148 119.853 -11.963 -99.200 -91.000 HIS 67 0.900 -37.766 119.433 -6.583 -99.200 -91.000 PHE 71 1.000 -47.038 121.803 -4.470 -99.200 -91.000 TYR 82 0.840 -38.851 125.384 2.752 -99.200 -91.000 HIS 92 0.900 -29.592 140.307 -0.752 -99.200 -91.000 HIS 100 0.900 -42.356 120.512 -9.653 -99.200 -91.000 TYR 108 0.840 -35.691 118.229 -27.412 -99.200 -91.000 TYR 133 0.840 -56.829 119.237 -35.434 -99.200 -91.000 TYR 134 0.840 -62.567 122.457 -30.751 -99.200 -91.000 PHE 139 1.000 -60.250 126.766 -41.095 -99.200 -91.000 TYR 144 0.840 -54.674 130.380 -29.612 -99.200 -91.000 PHE 159 1.000 -69.671 129.037 -37.391 -99.200 -91.000 PHE 161 1.000 -65.113 126.505 -34.670 -99.200 -91.000 TYR 170 0.840 -45.222 119.602 -24.888 -99.200 -91.000 PHE 187 1.000 -30.096 100.676 -16.498 -99.200 -91.000 PHE 202 1.000 -30.342 95.272 -7.637 -99.200 -91.000 TYR 223 0.840 -47.343 108.086 -13.574 -99.200 -91.000 TYR 225 0.840 -47.700 97.513 -10.201 -99.200 -91.000 PHE 235 1.000 -41.495 103.856 -12.839 -99.200 -91.000 HIS 242 0.900 -40.854 96.891 3.462 -99.200 -91.000 HIS 243 0.900 -45.835 97.858 3.657 -99.200 -91.000 HIS 251 0.900 -48.448 92.549 -7.701 -99.200 -91.000 HIS 260 0.900 -38.125 113.954 -5.420 -99.200 -91.000 TYR 261 0.840 -29.269 116.098 -5.065 -99.200 -91.000 TYR 264 0.840 -27.141 115.433 -10.003 -99.200 -91.000 TRP 277 1.040 -34.292 126.647 -25.727 -99.200 -91.000 TRP6 277 1.020 -35.214 126.335 -23.562 -99.200 -91.000 PHE 278 1.000 -30.856 133.249 -22.475 -99.200 -91.000 PHE 297 1.000 -32.753 111.562 2.544 -99.200 -91.000 TYR 299 0.840 -27.802 108.717 0.284 -99.200 -91.000