NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4447 8.1076 122.4434 51.9183 19.9571 175.2802 3 Q 4.6378 8.2840 118.2128 54.1223 32.3386 169.4971 4 V 4.4399 7.3498 112.3215 60.2557 37.1549 174.3025 5 S 5.0352 8.6884 115.3020 57.1804 64.2203 174.0534 6 R 4.7694 8.7925 128.6522 56.6224 30.3733 176.9817 7 Q 4.3972 8.4961 116.4468 55.7514 28.6115 171.5859 *25 N 5.4022 8.2903 115.4829 54.4250 39.9672 173.6487 26 Y 5.1102 8.1324 119.7547 55.6332 41.6622 173.9692 27 F 4.9449 8.8429 116.3636 56.1685 40.2565 175.2390 28 N 4.1596 7.5690 112.4579 52.7537 39.1828 174.0260 29 I 3.9761 7.1052 119.4258 59.4139 39.7482 174.9733 30 N 4.6779 7.9462 117.6481 51.9082 39.0427 175.9530 31 Y 3.8000 8.5863 121.0973 59.2692 38.4505 175.6472 32 F 4.8472 7.4262 118.5440 55.5598 40.8877 175.9422 33 K 4.2072 8.8841 124.5861 57.8250 32.8093 176.3245 34 D 4.9396 7.9501 118.3781 52.1652 42.8120 176.7415 35 A 3.9582 8.9108 126.1774 55.5010 18.5429 179.0344 36 A 4.1370 8.0025 118.0307 55.1332 18.7428 179.5171 37 S 3.8691 7.7572 111.6106 61.6222 63.0776 175.2443 38 N 4.6418 7.6222 116.6879 52.4951 38.9089 176.0368 39 G 3.8838 8.3856 108.9471 45.2443 0.0000 172.8831 40 A 4.1035 8.3139 121.8376 51.9198 18.8227 177.9613 41 S 4.3714 8.4333 117.8638 58.5136 63.7004 173.5549 42 K 4.5647 8.1430 121.2219 55.1640 34.0872 177.1048 43 L 4.3731 8.1296 118.5725 55.4315 42.5277 176.7172 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 2 A 8.11 4.44 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 3 Q 8.28 4.64 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.23 6.68 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 4 V 7.35 4.44 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.62 0.00 0.00 5 S 8.69 5.04 0.00 3.86 3.74 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 6 R 8.79 4.77 0.00 1.98 1.94 0.00 3.25 0.00 0.00 3.25 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.49 0.00 7 Q 8.50 4.40 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.53 0.00 0.00 0.00 0.00 0.00 2.24 1.94 0.00 *25 N 8.29 5.40 0.00 2.66 2.85 0.00 0.00 7.06 7.46 0.00 0.00 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 Y 8.13 5.11 0.00 3.07 3.04 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 0.00 0.00 0.00 27 F 8.84 4.94 0.00 2.98 2.95 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 0.00 0.00 0.00 28 N 7.57 4.16 0.00 2.78 3.17 0.00 0.00 6.85 9.16 0.00 0.00 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 I 7.11 3.98 1.51 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 -0.24 0.66 0.00 0.00 30 N 7.95 4.68 0.00 2.78 3.08 0.00 0.00 6.83 7.48 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 31 Y 8.59 3.80 0.00 2.55 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.43 4.85 0.00 3.11 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.88 4.21 0.00 1.76 1.92 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.48 7.81 34 D 7.95 4.94 0.00 2.81 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.91 3.96 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 36 A 8.00 4.14 1.28 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 37 S 7.76 3.87 0.00 4.16 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.62 4.64 0.00 2.83 2.79 0.00 0.00 6.96 7.54 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 39 G 8.39 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.31 4.10 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.43 4.37 0.00 3.88 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 42 K 8.14 4.56 0.00 1.76 1.80 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.48 7.81 43 L 8.13 4.37 0.00 1.56 1.50 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.