NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -4 Q 4.2738 8.3449 119.6866 54.6598 30.1032 174.7064 -3 P 4.0630 0.0000 0.0000 61.7059 31.8353 175.3868 -2 L 3.7596 10.0274 126.8080 59.4980 42.7311 179.5436 -1 N 3.2764 6.7068 112.2526 54.1156 39.9375 171.8442 -3 P 4.0630 0.0000 0.0000 61.7059 31.8353 175.3868 -2 K 3.7396 10.1574 125.4080 60.5980 33.4310 178.5436 -1 I 2.7064 6.3068 113.4526 62.1156 39.8375 173.0442 4 I 4.3569 8.4966 131.2446 60.5382 37.9591 175.5225 5 I 4.4782 8.7271 129.1391 59.1101 39.0195 174.3121 6 F 4.1274 9.3284 128.2652 57.5614 39.1040 175.2643 7 E 4.1086 8.5321 123.3428 58.9715 29.2902 176.9794 8 Q 3.9406 8.0559 118.6472 56.2763 29.8194 175.3186 9 E 3.8462 8.4999 125.5957 56.3098 31.4594 175.8289 10 N 3.4007 8.8397 120.9199 55.6236 36.7283 173.4597 11 F 3.1050 7.5405 110.8441 58.0255 37.2432 176.1206 12 Q 4.3099 8.0852 120.5612 56.7863 30.6421 176.5233 13 G 4.1090 9.3674 112.3366 46.7854 0.0000 174.8714 14 H 4.5535 10.1414 119.2922 55.8826 26.4665 175.2496 15 S 3.6379 7.4572 113.7756 59.2375 64.5128 175.2824 16 H 4.8882 7.9644 117.6319 54.2621 32.3953 172.8937 17 E 4.5584 8.8620 124.3644 56.1500 30.7773 175.1416 18 L 4.5250 7.9606 123.1180 54.2178 44.9659 174.3240 19 N 5.4657 8.6393 120.1001 52.5968 40.7012 173.8613 20 G 4.0775 7.4659 106.2531 44.3836 0.0000 171.3478 21 P 4.3012 0.0000 0.0000 62.5936 31.8326 176.3382 22 C 4.5812 8.2983 121.1554 56.9429 32.5386 172.5038 23 P 4.3663 0.0000 0.0000 63.2947 31.3301 176.3622 24 N 4.2633 7.6337 112.1257 53.1750 41.5787 174.6469 25 L 4.3198 8.0133 126.8293 56.4096 42.3670 179.7056 26 K 4.2007 10.1127 117.8051 59.0781 32.2769 178.3983 27 E 4.0606 7.9230 117.2269 59.4953 29.4395 177.6858 28 T 4.0086 7.1029 112.9195 63.0340 69.3488 174.8549 *328 G 3.7334 8.3888 110.4154 46.0637 0.0000 172.8812 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ -4 Q 8.34 4.27 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 -3 P 0.00 4.06 0.00 2.25 2.01 0.00 4.17 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.97 0.00 -2 L 10.03 3.76 0.00 1.58 1.70 0.91 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 -1 N 6.71 3.28 0.00 3.02 2.76 0.00 0.00 6.79 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -3 P 0.00 4.06 0.00 2.25 2.01 0.00 4.17 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.97 0.00 -2 K 10.16 3.74 0.00 1.80 1.83 0.00 1.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.54 7.81 -1 I 6.31 2.71 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.41 0.91 0.00 0.00 4 I 8.50 4.36 2.02 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.97 0.69 0.00 0.00 5 I 8.73 4.48 1.95 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.53 1.02 0.00 0.00 6 F 9.33 4.13 0.00 2.97 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.53 4.11 0.00 1.63 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.16 0.00 8 Q 8.06 3.94 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.71 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 9 E 8.50 3.85 0.00 1.93 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.26 0.00 10 N 8.84 3.40 0.00 2.68 2.66 0.00 0.00 7.17 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 F 7.54 3.10 0.00 2.86 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 Q 8.09 4.31 0.00 2.39 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.85 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 13 G 9.37 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 H 10.14 4.55 0.00 3.34 3.48 0.00 5.46 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 7.46 3.64 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 H 7.96 4.89 0.00 3.21 3.13 0.00 5.63 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.86 4.56 0.00 1.94 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.28 0.00 18 L 7.96 4.52 0.00 1.64 1.47 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.64 5.47 0.00 2.66 2.73 0.00 0.00 6.75 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 7.47 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 4.30 0.00 2.05 1.99 0.00 3.62 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 22 C 8.30 4.58 0.00 2.89 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 P 0.00 4.37 0.00 2.08 2.08 0.00 3.77 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 24 N 7.63 4.26 0.00 2.63 2.65 0.00 0.00 7.15 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.01 4.32 0.00 1.77 1.71 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 26 K 10.11 4.20 0.00 1.91 1.88 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.57 7.81 27 E 7.92 4.06 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 28 T 7.10 4.01 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 *328 G 8.39 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.