NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 T 4.6566 8.2745 114.8330 61.7120 70.1233 173.4324 *8 Y 4.6498 9.1978 127.6614 54.2961 40.8073 170.2988 9 K 5.1481 8.9845 124.5450 54.2679 36.8755 176.2676 10 L 5.2567 9.0368 126.2493 53.8427 44.6741 176.5169 11 I 4.6857 9.2173 127.0510 58.4940 37.7693 171.9847 12 L 4.7678 8.8031 132.5372 53.2515 43.1143 172.6139 13 N 5.0230 9.3801 126.3351 50.0013 38.1704 170.8183 14 G 4.2222 8.4838 117.1152 43.4815 0.0000 171.7670 15 K 4.1986 8.6370 121.7893 56.7846 32.0337 175.2382 16 T 4.5642 8.0187 109.5706 61.1121 71.1039 178.5537 17 L 4.8204 7.9010 121.7236 53.4170 44.1177 181.0429 18 K 4.9423 9.3303 126.5087 51.8377 36.0269 172.8668 19 G 4.0326 7.3038 109.4949 47.3732 0.0000 171.4435 20 E 5.4303 8.4622 118.4362 56.3315 34.0765 170.9465 21 T 4.7876 8.5882 114.8231 62.1284 73.6523 174.1324 22 T 5.2884 8.3267 115.3196 62.5632 73.0854 173.2609 23 T 4.7232 9.0140 115.3796 62.1196 73.5568 173.5907 24 E 4.8654 8.7208 117.7864 54.5636 31.6490 176.5698 25 A 4.7868 8.2875 128.2347 50.0174 22.3603 177.0764 26 V 3.8048 8.4917 119.7363 63.9768 32.4412 178.0563 27 D 4.8547 7.6376 118.1762 53.0765 44.8743 180.2179 28 A 4.2114 8.6587 121.3593 55.7867 18.2296 180.1460 29 A 3.9845 8.0869 121.2495 56.2253 18.5887 180.4094 30 T 3.8104 7.8996 112.2262 66.0611 68.5725 177.9267 31 A 4.2418 7.9767 126.0118 55.7482 18.4074 179.9920 32 E 4.0256 8.4657 119.2732 62.0850 29.6589 182.0618 33 K 4.3120 8.0463 126.7576 60.1820 31.7582 182.3504 34 V 3.8789 7.7118 122.7294 66.5843 31.6467 181.0797 *35 F 4.3305 8.5914 124.6663 62.1346 37.7626 180.0541 36 K 4.2393 8.6291 127.3204 60.3167 31.4517 181.6464 37 Q 4.2814 8.1759 124.7118 60.8376 28.0363 180.7632 *38 Y 4.1547 7.8938 122.7196 61.7765 36.9502 179.9453 39 A 4.2577 8.5747 125.8157 55.8056 18.3582 180.0459 40 N 4.3627 8.6621 120.4359 58.5634 37.4496 179.5356 41 D 4.7436 8.3222 125.0331 58.1790 39.8382 179.7595 42 N 5.1222 7.9942 117.6669 53.4070 37.9745 178.0369 43 G 4.0756 7.8299 109.8430 48.1514 0.0000 175.0144 44 V 4.2986 7.9855 119.5381 59.1916 33.0552 178.4868 45 D 5.0836 8.2756 123.7501 50.1780 43.9490 172.5411 46 G 4.0549 8.0915 113.1325 46.2181 0.0000 172.4075 47 E 4.6775 8.9478 122.9448 55.4635 31.9558 172.9145 *48 W 5.2507 8.7031 129.2807 55.4772 30.4957 173.8485 49 T 4.8603 9.2580 120.3219 59.7224 72.6879 171.0312 *50 Y 5.1604 8.6072 125.2736 56.2282 41.0972 175.3920 51 D 4.8923 9.0345 127.0508 51.8979 42.6357 175.4103 52 D 4.3849 8.9093 123.9506 54.9551 40.3430 175.1435 53 A 4.0708 8.2554 122.9492 55.5672 18.4847 178.7159 54 T 4.3726 7.9605 106.7655 60.1555 70.2234 177.1669 55 K 3.9176 7.5458 123.9867 57.9618 29.7166 180.2087 56 T 5.2378 8.0004 116.1242 60.6152 72.5084 176.6113 *57 F 5.2937 9.4268 129.0662 55.7625 41.3299 172.9599 58 T 5.1705 9.2610 118.8078 59.7176 72.6826 172.6570 59 V 5.5863 8.8561 126.7913 58.8643 35.7181 174.6259 60 T 4.8885 8.1898 118.0501 59.5670 69.6792 170.8798 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 7 T 8.27 4.66 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 1.21 0.00 0.00 *8 Y 9.20 4.65 0.00 1.96 2.15 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 9 K 8.98 5.15 0.00 1.41 1.65 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.82 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.25 1.22 7.81 10 L 9.04 5.26 0.00 1.26 1.52 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 11 I 9.22 4.69 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 1.09 0.62 0.91 0.00 0.00 12 L 8.80 4.77 0.00 1.32 1.57 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 13 N 9.38 5.02 0.00 2.35 2.73 0.00 0.00 6.33 7.17 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 G 8.48 4.22 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 15 K 8.64 4.20 0.00 1.79 1.73 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.00 7.81 16 T 8.02 4.56 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 1.21 0.00 0.00 17 L 7.90 4.82 0.00 1.50 1.51 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 18 K 9.33 4.94 0.00 1.47 1.54 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.73 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.24 0.98 7.81 19 G 7.30 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.46 5.43 0.00 1.70 1.65 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 0.00 2.12 1.87 0.00 21 T 8.59 4.79 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 1.21 0.00 0.00 22 T 8.33 5.29 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 1.21 0.00 0.00 23 T 9.01 4.72 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 1.21 0.00 0.00 24 E 8.72 4.87 0.00 1.95 1.75 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 2.13 1.84 0.00 25 A 8.29 4.79 1.19 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 0.00 0.00 0.00 26 V 8.49 3.80 2.08 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 0.74 0.00 0.00 0.93 0.00 0.00 27 D 7.64 4.85 0.00 2.62 2.48 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 28 A 8.66 4.21 1.32 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 29 A 8.09 3.98 1.32 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 30 T 7.90 3.81 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 1.21 0.00 0.00 31 A 7.98 4.24 1.33 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 32 E 8.47 4.03 0.00 1.98 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 2.25 2.22 0.00 33 K 8.05 4.31 0.00 1.72 1.85 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.37 1.33 7.81 34 V 7.71 3.88 2.08 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 0.71 0.00 0.00 0.93 0.00 0.00 *35 F 8.59 4.33 0.00 2.24 2.33 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 36 K 8.63 4.24 0.00 1.72 1.85 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.37 1.33 7.81 37 Q 8.18 4.28 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 *38 Y 7.89 4.15 0.00 2.33 2.33 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 39 A 8.57 4.26 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 40 N 8.66 4.36 0.00 2.71 2.85 0.00 0.00 7.23 7.66 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 41 D 8.32 4.74 0.00 2.77 2.62 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 42 N 7.99 5.12 0.00 2.83 2.70 0.00 0.00 7.00 6.93 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 43 G 7.83 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 44 V 7.99 4.30 2.08 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 0.73 0.00 0.00 0.93 0.00 0.00 45 D 8.28 5.08 0.00 2.63 2.40 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 46 G 8.09 4.05 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 0.00 0.00 0.00 47 E 8.95 4.68 0.00 1.62 1.83 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 2.16 2.11 0.00 *48 W 8.70 5.25 0.00 2.26 2.08 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 49 T 9.26 4.86 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 1.21 0.00 0.00 *50 Y 8.61 5.16 0.00 2.03 2.03 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 0.00 0.00 0.00 0.00 51 D 9.03 4.89 0.00 2.31 2.54 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 52 D 8.91 4.38 0.00 2.60 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 53 A 8.26 4.07 1.29 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 54 T 7.96 4.37 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 1.21 0.00 0.00 55 K 7.55 3.92 0.00 1.92 1.81 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.29 1.23 7.81 56 T 8.00 5.24 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 1.21 0.00 0.00 *57 F 9.43 5.29 0.00 1.88 2.15 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 58 T 9.26 5.17 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 1.21 0.00 0.00 59 V 8.86 5.59 2.08 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 0.79 0.00 0.00 0.93 0.00 0.00 60 T 8.19 4.89 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 1.21 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.