============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 26 rings ring int. center anis. iso. TYR 17 0.840 -8.319 14.743 22.619 -99.200 -91.000 HIS 41 0.900 -9.404 5.434 25.105 -99.200 -91.000 HIS 47 0.900 1.729 9.627 25.819 -99.200 -91.000 PHE 51 1.000 1.594 18.380 21.432 -99.200 -91.000 HIS 53 0.900 -5.288 24.573 28.950 -99.200 -91.000 TRP 56 1.040 -0.684 16.077 38.127 -99.200 -91.000 TRP6 56 1.020 1.399 15.752 37.045 -99.200 -91.000 TYR 62 0.840 -15.519 1.389 40.741 -99.200 -91.000 PHE 86 1.000 -25.534 3.758 35.192 -99.200 -91.000 TYR 117 0.840 -33.529 10.357 43.038 -99.200 -91.000 PHE 139 1.000 -34.302 23.448 17.437 -99.200 -91.000 TYR 146 0.840 -33.382 27.810 7.628 -99.200 -91.000 HIS 155 0.900 -28.695 32.561 22.753 -99.200 -91.000 TYR 157 0.840 -33.116 26.267 26.510 -99.200 -91.000 HIS 162 0.900 -30.025 11.563 24.075 -99.200 -91.000 TRP 170 1.040 -39.588 23.872 16.120 -99.200 -91.000 TRP6 170 1.020 -37.976 24.515 14.514 -99.200 -91.000 PHE 181 1.000 -30.764 36.225 13.315 -99.200 -91.000 TYR 206 0.840 -30.685 5.404 11.048 -99.200 -91.000 TYR 216 0.840 -16.229 8.570 18.779 -99.200 -91.000 TYR 217 0.840 -14.424 12.723 17.722 -99.200 -91.000 TYR 238 0.840 -24.745 24.365 30.765 -99.200 -91.000 PHE 243 1.000 -37.409 11.382 41.503 -99.200 -91.000 TYR 271 0.840 -40.848 22.377 36.724 -99.200 -91.000 PHE 294 1.000 -44.527 0.710 38.418 -99.200 -91.000 PHE 298 1.000 -33.726 0.651 39.285 -99.200 -91.000