NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 800 A 4.0530 8.2649 123.5468 51.7488 20.3742 175.4545 801 W 4.6451 8.1464 119.5060 55.4436 30.5783 174.3186 802 A 4.0457 9.3432 124.0681 54.7247 18.9895 179.2503 803 S 4.1625 8.7670 117.9904 58.6352 62.8045 172.3536 804 G 4.2780 7.8591 112.1158 47.8426 0.0000 175.7923 805 N 4.2834 8.2380 117.0867 55.8816 38.5254 177.1605 806 L 4.1660 7.8861 119.5735 57.6184 41.6889 179.2827 807 L 4.1205 7.8930 118.5173 58.0755 41.5526 179.1490 808 T 3.9130 8.0633 115.8527 67.2542 68.5039 176.4266 809 Q 4.0205 8.1271 118.6653 58.7459 28.7395 178.6243 810 A 4.0419 7.5948 122.3160 55.1469 18.5574 179.7010 811 I 3.6787 8.0949 118.7365 64.5641 37.1947 178.6687 812 R 4.0266 8.2747 119.6001 59.6731 29.8715 178.6038 813 Q 4.1857 8.3576 117.8987 58.9885 28.5796 178.4896 814 Q 3.7952 8.3895 120.7916 59.1959 28.8307 177.8130 815 Y 3.9981 7.6928 119.5358 60.9886 39.0045 177.1510 816 Y 4.2024 7.9744 115.9047 58.9850 39.4560 176.1446 817 K 4.6597 8.5415 119.5318 54.1524 32.1038 174.0900 818 P 4.5481 0.0000 0.0000 62.0975 32.4716 176.4444 819 I 4.4201 7.7861 112.4670 59.1413 40.1120 176.5086 820 D 4.5611 8.0548 120.8159 53.3908 38.9235 176.7031 821 V 3.2511 7.8034 118.0233 63.7874 31.9392 177.2619 822 D 4.4669 8.1055 118.3679 57.0329 40.4985 178.5876 823 R 3.8896 8.1966 119.0265 59.5949 30.1047 178.4257 824 M 4.0017 7.8826 117.1549 57.7030 31.9449 177.3852 825 Y 5.0285 8.1709 116.0522 58.9010 39.8232 178.2397 826 G 3.6771 7.9058 107.7253 48.0018 0.0000 174.4487 827 T 4.2228 7.3870 107.0219 62.2816 69.4595 174.8605 828 I 4.2309 7.1992 124.1202 60.2073 38.1928 175.5696 829 D 4.6505 8.4640 124.2462 54.3847 41.4177 175.5032 830 S 4.7504 8.0371 114.2681 55.5282 66.2041 172.1066 831 P 4.4436 0.0000 0.0000 62.3925 31.9578 176.3553 832 K 4.2295 9.4737 119.7261 56.0380 32.7608 178.3871 833 L 4.0450 8.7419 122.5196 58.3386 41.6460 179.7402 834 E 4.0675 8.2771 117.7585 59.5828 29.1729 179.1378 835 E 4.0523 8.0209 117.6292 59.3304 29.5888 178.7037 836 L 3.8610 7.2930 118.0692 57.1086 41.6834 177.7333 837 F 4.4864 7.5814 115.3315 59.5021 40.7539 176.0591 *838 N 4.5415 7.9953 119.9521 52.4802 38.1025 175.9210 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 800 A 8.26 4.05 1.25 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 0.00 801 W 8.15 4.65 0.00 3.36 3.09 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 0.00 802 A 9.34 4.05 1.34 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 0.00 803 S 8.77 4.16 0.00 3.64 3.78 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 0.00 804 G 7.86 4.28 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 0.00 805 N 8.24 4.28 0.00 2.72 2.92 0.00 0.00 6.92 7.85 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 0.00 806 L 7.89 4.17 0.00 1.71 1.74 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 807 L 7.89 4.12 0.00 1.86 1.74 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 808 T 8.06 3.91 4.39 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 1.23 0.00 0.00 809 Q 8.13 4.02 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 810 A 7.59 4.04 1.44 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 0.00 811 I 8.09 3.68 2.03 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 1.42 1.26 0.92 0.00 0.00 812 R 8.27 4.03 0.00 1.97 2.03 0.00 3.22 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.09 0.00 813 Q 8.36 4.19 0.00 2.36 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.57 0.00 0.00 0.00 0.00 0.00 2.44 2.62 0.00 814 Q 8.39 3.80 0.00 2.34 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 815 Y 7.69 4.00 0.00 2.91 2.97 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 0.00 816 Y 7.97 4.20 0.00 3.06 2.99 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 0.00 817 K 8.54 4.66 0.00 1.83 1.75 0.00 1.74 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.41 7.81 818 P 0.00 4.55 0.00 2.11 1.94 0.00 3.36 0.00 0.00 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.79 0.00 819 I 7.79 4.42 1.80 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.62 0.90 0.00 0.00 820 D 8.05 4.56 0.00 2.68 2.53 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 0.00 821 V 7.80 3.25 2.27 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 0.87 0.00 0.00 0.97 0.00 0.00 822 D 8.11 4.47 0.00 2.83 2.71 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 0.00 823 R 8.20 3.89 0.00 2.03 1.89 0.00 3.12 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 824 M 7.88 4.00 0.00 1.38 1.31 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.67 0.00 825 Y 8.17 5.03 0.00 3.08 2.87 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 0.00 826 G 7.91 3.68 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 0.00 827 T 7.39 4.22 4.24 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 1.22 0.00 0.00 828 I 7.20 4.23 2.07 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.94 0.94 0.00 0.00 829 D 8.46 4.65 0.00 2.65 2.61 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 0.00 830 S 8.04 4.75 0.00 3.90 3.77 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 0.00 831 P 0.00 4.44 0.00 2.17 2.07 0.00 3.74 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 832 K 9.47 4.23 0.00 1.89 1.78 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.52 7.81 833 L 8.74 4.04 0.00 1.74 1.84 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 834 E 8.28 4.07 0.00 2.04 2.04 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 2.44 2.44 0.00 835 E 8.02 4.05 0.00 2.05 1.99 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 2.35 0.00 836 L 7.29 3.86 0.00 1.43 1.03 0.85 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 837 F 7.58 4.49 0.00 3.12 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 *838 N 8.00 4.54 0.00 2.49 2.63 0.00 0.00 6.50 7.56 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.