NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.5829 8.1744 110.9451 61.7774 70.5694 172.5856 2 V 4.4274 8.6390 130.8649 62.4666 35.7490 174.6608 3 L 3.5701 10.6507 111.6280 57.3578 42.0733 177.3769 4 H 4.4671 10.4920 120.1458 55.6141 31.0263 174.2090 5 V 2.8889 8.7920 114.4120 64.4808 31.8069 177.3760 6 Q 3.1891 8.6863 114.6015 57.7561 30.3308 179.3501 7 E 3.9873 7.9035 118.2596 59.8482 31.0887 179.9387 8 I 3.6862 8.3592 119.8206 64.2742 37.5145 178.5588 9 R 3.9198 8.7183 120.9709 59.3252 30.1638 177.3766 10 D 4.4409 8.2226 117.2338 57.6177 40.7690 175.8090 11 M 4.1774 7.8698 121.8585 55.3771 31.0449 176.2043 12 T 3.8129 7.8195 115.0037 58.9351 72.3791 170.8429 13 P 4.1173 0.0000 0.0000 66.3613 30.5606 177.4785 14 A 4.2077 8.1188 121.8818 53.8225 18.5900 179.2720 15 E 3.8950 8.2972 116.6363 59.5798 29.6063 179.3411 16 R 4.6101 8.2040 119.5693 60.1136 29.7203 178.0034 17 E 3.8499 8.6224 117.5993 59.5328 29.3875 179.1174 18 A 3.9577 8.6700 120.2097 55.7148 18.5854 179.1559 19 E 4.6379 8.4182 118.2064 58.7808 29.6939 178.6216 20 L 3.9200 8.2178 120.1921 59.7678 42.0764 178.6674 21 D 4.1751 8.4106 116.5812 57.1719 40.6082 178.7398 22 D 4.3959 8.7859 119.1474 58.0591 41.1461 179.3279 23 L 4.3722 8.1484 120.7911 57.9403 41.5828 179.1596 24 K 3.8233 8.5509 119.3629 60.1131 31.9291 178.7559 25 T 3.8214 8.3081 115.2724 66.6916 68.5933 175.9454 26 E 3.9512 8.6301 119.4650 59.5737 29.5684 179.1095 27 L 3.9680 8.1625 120.2635 57.1746 41.4435 178.9471 28 L 3.9199 8.0670 119.6129 59.3623 42.1786 178.2960 29 N 3.8920 8.6312 113.9376 56.5331 38.3984 177.0129 30 A 3.9054 8.6531 121.6159 55.6997 18.8525 179.3905 31 R 3.6598 8.2085 116.1421 59.6662 30.1624 178.9405 *33 V 3.9473 7.5114 116.1620 63.0588 32.8505 176.7442 34 Q 3.9681 7.7368 118.4083 58.2483 28.0849 178.5937 35 A 3.9313 8.3256 123.8439 56.3496 18.8448 178.7346 36 A 3.8803 8.4409 117.1539 54.8275 18.2403 180.0635 37 G 4.1493 8.3232 105.3899 47.2486 0.0000 174.9918 38 G 3.8732 8.2880 107.9772 44.4888 0.0000 174.2445 39 A 3.9876 7.0959 121.6725 54.6231 19.4153 181.4616 40 P 4.6276 0.0000 0.0000 61.6737 32.0307 174.4222 41 E 4.5815 8.2527 120.5275 55.0915 33.6367 173.0139 42 N 4.0150 8.6654 118.1573 53.9683 38.3965 172.5934 43 P 4.6561 0.0000 0.0000 60.4970 30.8460 176.4137 44 G 3.9197 8.3945 111.9467 48.3625 0.0000 171.6187 45 R 3.8663 8.6420 119.6675 59.0796 29.6816 178.9544 46 I 3.5033 8.0319 118.1914 64.0573 37.4390 177.7157 47 K 3.8517 8.1514 118.8931 59.8693 31.9285 178.2459 48 E 3.8522 8.5345 119.0912 59.6823 29.4108 178.7872 49 L 3.9140 8.2707 118.6163 58.1557 41.7851 179.3621 50 R 3.8623 8.1092 118.1357 59.7100 29.8543 178.1479 51 K 3.8131 8.3122 117.5441 59.8501 32.0938 178.7871 52 A 3.9247 8.2709 120.7814 55.5500 18.1992 179.3756 53 I 3.5931 8.1180 117.5256 65.0804 37.2229 177.7974 54 A 3.9004 8.1100 120.5265 55.8668 18.0218 179.6017 55 R 4.3063 8.5541 115.8994 59.3433 30.3402 179.5193 56 I 3.5642 7.8640 119.0873 65.0964 36.9833 177.3980 57 K 3.7188 8.9796 118.1778 60.7872 31.8318 180.0025 58 T 3.5032 8.6947 113.0509 65.9016 68.6546 175.5469 59 I 3.6150 8.5323 120.5692 65.4469 38.4523 177.8031 60 Q 3.7747 8.5290 118.7224 59.7698 28.8420 179.1354 61 G 3.8512 8.9581 104.7835 48.3642 0.0000 174.7874 62 E 4.0288 8.5160 121.8542 58.8827 29.9172 179.0793 63 E 4.0327 8.2484 119.0027 59.9806 30.6185 177.2985 64 G 3.8672 9.5060 107.4489 46.0379 0.0000 173.2631 65 D 5.4590 7.7710 120.7606 54.3774 42.7321 172.9202 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 1 T 8.17 4.58 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 1.25 0.00 0.00 2 V 8.64 4.43 2.11 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 0.79 0.00 0.00 0.95 0.00 0.00 3 L 10.65 3.57 0.00 1.70 1.69 0.93 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 4 H 10.49 4.47 0.00 3.47 3.57 0.00 5.84 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.79 2.89 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 0.78 0.00 0.00 0.90 0.00 0.00 6 Q 8.69 3.19 0.00 2.18 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.49 6.42 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 7 E 7.90 3.99 0.00 1.98 1.93 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 0.00 2.39 2.35 0.00 8 I 8.36 3.69 1.97 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.77 0.91 0.00 0.00 9 R 8.72 3.92 0.00 1.72 2.14 0.00 3.27 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 10 D 8.22 4.44 0.00 2.88 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.87 4.18 0.00 2.01 2.23 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.79 0.00 12 T 7.82 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 1.27 0.00 0.00 13 P 0.00 4.12 0.00 2.28 2.20 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 14 A 8.12 4.21 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 15 E 8.30 3.90 0.00 2.26 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 2.40 2.40 0.00 16 R 8.20 4.61 0.00 2.05 2.00 0.00 3.27 0.00 0.00 3.26 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 17 E 8.62 3.85 0.00 2.18 1.95 0.00 0.00 0.00 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 2.52 0.00 18 A 8.67 3.96 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.42 4.64 0.00 2.00 1.97 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 2.31 2.33 0.00 20 L 8.22 3.92 0.00 1.85 1.71 0.92 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.41 4.18 0.00 3.11 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.79 4.40 0.00 2.75 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.15 4.37 0.00 1.71 1.74 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.55 3.82 0.00 1.80 1.99 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.50 7.81 25 T 8.31 3.82 4.34 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 1.21 0.00 0.00 26 E 8.63 3.95 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 27 L 8.16 3.97 0.00 1.88 1.76 0.96 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.07 3.92 0.00 1.71 1.98 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.63 3.89 0.00 3.13 2.78 0.00 0.00 6.96 8.33 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 30 A 8.65 3.91 1.39 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 0.00 0.00 0.00 31 R 8.21 3.66 0.00 2.01 2.00 0.00 3.16 0.00 0.00 3.09 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.92 0.00 *33 V 7.51 3.95 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.93 0.00 0.00 34 Q 7.74 3.97 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.39 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 35 A 8.33 3.93 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.44 3.88 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.32 4.15 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 0.00 0.00 0.00 38 G 8.29 3.87 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 0.00 0.00 0.00 39 A 7.10 3.99 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 40 P 0.00 4.63 0.00 2.05 1.97 0.00 3.62 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 41 E 8.25 4.58 0.00 1.88 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 2.20 2.27 0.00 42 N 8.67 4.01 0.00 2.67 2.82 0.00 0.00 6.84 7.69 0.00 0.00 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 P 0.00 4.66 0.00 2.30 1.99 0.00 3.68 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.25 0.00 44 G 8.39 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.64 3.87 0.00 1.93 1.76 0.00 3.26 0.00 0.00 3.34 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 46 I 8.03 3.50 2.04 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 1.52 0.66 0.91 0.00 0.00 47 K 8.15 3.85 0.00 1.96 1.86 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.51 7.81 48 E 8.53 3.85 0.00 2.11 2.05 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 2.32 2.38 0.00 49 L 8.27 3.91 0.00 1.85 1.74 0.92 1.13 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 50 R 8.11 3.86 0.00 1.98 2.16 0.00 3.11 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 51 K 8.31 3.81 0.00 1.95 1.85 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.69 7.81 52 A 8.27 3.92 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.12 3.59 2.04 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 1.45 0.98 0.91 0.00 0.00 54 A 8.11 3.90 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 55 R 8.55 4.31 0.00 1.89 1.99 0.00 3.28 0.00 0.00 3.35 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 56 I 7.86 3.56 2.06 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 1.52 1.08 0.97 0.00 0.00 57 K 8.98 3.72 0.00 2.01 1.77 0.00 1.72 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.81 7.81 58 T 8.69 3.50 4.27 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 0.00 0.00 0.00 1.21 0.00 0.00 59 I 8.53 3.61 1.86 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 1.40 1.61 0.99 0.00 0.00 60 Q 8.53 3.77 0.00 2.14 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.40 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 61 G 8.96 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.52 4.03 0.00 2.05 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 2.59 2.51 0.00 63 E 8.25 4.03 0.00 1.93 2.20 0.00 0.00 0.00 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 2.52 0.00 64 G 9.51 3.87 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 0.00 0.00 0.00 65 D 7.77 5.46 0.00 2.87 2.66 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.