============================================================================= 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 16 1.000 18.379 1.366 39.433 -99.200 -91.000 HIS 25 0.900 12.454 9.164 26.863 -99.200 -91.000 TYR 27 0.840 8.618 2.722 33.328 -99.200 -91.000 TYR 30 0.840 16.051 -2.098 31.435 -99.200 -91.000 TYR 40 0.840 10.565 -15.773 20.872 -99.200 -91.000 HIS 42 0.900 8.924 -20.468 19.385 -99.200 -91.000 PHE 67 1.000 16.411 -14.906 35.242 -99.200 -91.000 PHE 90 1.000 8.132 1.007 51.584 -99.200 -91.000 PHE 105 1.000 8.808 12.644 51.539 -99.200 -91.000 HIS 125 0.900 -6.429 15.521 50.773 -99.200 -91.000 HIS 126 0.900 -1.934 11.844 45.090 -99.200 -91.000 TYR 133 0.840 -7.628 5.018 51.982 -99.200 -91.000 PHE 134 1.000 2.780 0.820 51.125 -99.200 -91.000 PHE 137 1.000 -5.199 3.827 47.316 -99.200 -91.000 TYR 164 0.840 -24.015 12.828 33.576 -99.200 -91.000 PHE 172 1.000 -15.047 -4.489 33.734 -99.200 -91.000 HIS 188 0.900 -25.297 15.559 29.614 -99.200 -91.000 PHE 191 1.000 -16.987 18.346 27.504 -99.200 -91.000 HIS 203 0.900 -19.427 19.368 42.183 -99.200 -91.000 HIS 213 0.900 -22.178 7.812 52.722 -99.200 -91.000 PHE 214 1.000 -18.110 2.977 43.842 -99.200 -91.000 PHE 226 1.000 -12.863 11.817 41.917 -99.200 -91.000 TYR 241 0.840 -16.763 -5.969 49.169 -99.200 -91.000 HIS 243 0.900 -11.322 2.685 52.292 -99.200 -91.000 TYR 256 0.840 -17.736 6.420 24.125 -99.200 -91.000 TYR 257 0.840 -17.445 5.576 19.025 -99.200 -91.000 TYR 262 0.840 -4.345 7.686 26.161 -99.200 -91.000 PHE 263 1.000 -9.251 8.394 28.662 -99.200 -91.000 PHE 269 1.000 -3.716 -1.194 21.080 -99.200 -91.000 HIS 276 0.900 0.769 0.758 11.762 -99.200 -91.000 PHE 282 1.000 -4.077 8.649 8.728 -99.200 -91.000 TYR 287 0.840 -8.672 15.038 24.903 -99.200 -91.000 PHE 311 1.000 -7.800 -1.154 16.251 -99.200 -91.000 TYR 313 0.840 -10.111 7.470 9.757 -99.200 -91.000 TRP 316 1.040 -1.511 -1.873 13.165 -99.200 -91.000 TRP6 316 1.020 -1.365 -1.611 15.509 -99.200 -91.000 TYR 318 0.840 -11.950 -3.823 16.600 -99.200 -91.000