NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 K 4.2022 8.3149 119.9959 58.0955 33.5865 174.3107 9 L 3.7958 8.8550 124.6868 53.0174 39.6136 170.9787 10 L 4.2918 7.7188 117.8431 55.6002 43.7466 177.6877 11 L 4.4335 9.4283 125.1432 54.2392 45.5493 173.7545 12 E 5.0188 8.8843 124.5128 55.4394 32.5036 174.7351 13 C 4.7820 8.5579 118.0293 59.0178 30.8304 172.7533 14 T 5.3264 8.2324 116.4177 59.1838 68.4595 172.0142 15 E 3.1231 8.8088 135.0000 60.6044 29.9762 178.3580 16 C 3.5522 9.2426 117.5908 62.7251 29.7711 172.3053 17 K 4.3392 8.8166 126.6118 55.4403 32.2006 175.5526 18 R 4.6836 6.9653 119.3012 57.5026 32.6729 176.5399 19 R 4.0556 8.1604 116.8444 54.9840 27.5796 179.3496 20 N 3.5514 8.7466 106.9912 54.9323 38.8548 171.6616 21 Y 5.7192 8.1404 116.7902 57.7856 42.1290 174.7738 22 A 4.2628 9.3546 126.9372 52.5277 19.6373 174.2652 23 T 3.3866 8.8275 111.4292 61.6714 67.1757 170.0424 24 E 4.6456 8.8664 127.0514 55.2966 34.0943 174.1744 25 K 4.8205 8.1790 117.6723 55.8045 35.9361 176.4814 26 N 5.2471 7.7223 118.8804 52.5291 42.4596 175.7264 27 K 4.1631 8.7898 113.9668 60.2734 33.1439 181.6655 28 R 3.1525 7.4865 114.6169 57.7962 33.8517 179.5621 29 N 4.4646 8.6980 122.6679 54.4825 37.9090 177.3825 30 T 3.6001 9.6758 109.9187 62.8062 69.9329 174.8028 31 P 3.8739 0.0000 0.0000 63.5855 27.1669 174.1951 32 N 4.1213 8.2889 121.8189 53.7293 41.6493 172.8953 33 K 3.8865 9.2394 118.9704 56.2004 30.5589 176.8979 34 L 4.3998 7.7993 120.7838 55.4523 39.5186 173.5820 35 E 4.0601 9.6206 122.7625 55.7605 30.5387 175.7410 36 L 4.6776 8.2173 126.7928 55.1185 41.6229 174.7661 37 R 4.8155 8.3323 122.8673 54.0293 33.7068 175.8133 38 K 4.5172 8.5702 120.2716 56.1608 33.2102 176.0987 39 Y 4.5862 8.0830 119.2483 56.8274 42.0421 172.3071 40 C 4.3724 9.0547 127.8914 59.1777 32.4749 170.8504 41 P 4.7776 0.0000 0.0000 60.2170 33.2792 175.4023 42 W 4.8973 8.8671 130.2027 59.7097 31.1511 175.8672 43 C 4.6505 7.9348 115.6359 58.2701 26.6938 174.1268 44 R 4.0832 7.7723 116.7899 55.4055 27.8144 176.1520 45 K 3.6079 7.7239 116.7529 58.0372 28.1536 175.4012 46 H 4.2448 7.4387 110.5471 56.2962 28.8078 174.6210 47 T 4.7090 8.1637 125.5146 63.7392 69.5586 175.8169 48 V 3.7425 8.6580 124.3643 66.6133 32.1599 177.0717 49 H 4.7500 9.1421 111.6773 56.1315 29.1462 175.9692 50 R 5.4422 8.5684 121.6592 56.6628 35.2475 177.3733 51 E 4.7352 8.5792 126.4106 58.3065 32.9936 172.5912 52 V 4.4216 8.5591 131.1655 63.9252 33.6594 172.3471 *53 K 4.1330 8.2451 128.6062 54.8763 32.2491 171.8822 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 8 K 8.31 4.20 0.00 1.87 1.91 0.00 1.52 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.47 7.81 9 L 8.86 3.80 0.00 1.89 1.93 0.92 0.34 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 10 L 7.72 4.29 0.00 1.51 1.65 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 11 L 9.43 4.43 0.00 1.62 1.68 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.88 5.02 0.00 2.27 2.09 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 2.54 2.47 0.00 13 C 8.56 4.78 0.00 3.04 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 14 T 8.23 5.33 4.25 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 1.30 0.00 0.00 15 E 8.81 3.12 0.00 1.79 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 2.21 2.26 0.00 16 C 9.24 3.55 0.00 2.92 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 8.82 4.34 0.00 1.80 2.10 0.00 1.93 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.23 1.20 7.81 18 R 6.97 4.68 0.00 1.92 0.93 0.00 3.04 0.00 0.00 3.24 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.40 0.00 19 R 8.16 4.06 0.00 1.88 1.36 0.00 3.20 0.00 0.00 3.21 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.51 0.00 20 N 8.75 3.55 0.00 2.64 2.62 0.00 0.00 6.66 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 21 Y 8.14 5.72 0.00 3.01 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 22 A 9.35 4.26 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.83 3.39 4.25 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 1.27 0.00 0.00 24 E 8.87 4.65 0.00 1.92 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 2.10 2.32 0.00 25 K 8.18 4.82 0.00 1.57 1.62 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.70 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.38 7.81 26 N 7.72 5.25 0.00 2.61 2.75 0.00 0.00 6.83 7.49 0.00 0.00 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 K 8.79 4.16 0.00 1.88 1.72 0.00 1.70 0.00 0.00 1.89 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.35 7.81 28 R 7.49 3.15 0.00 1.88 2.14 0.00 3.21 0.00 0.00 3.22 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 29 N 8.70 4.46 0.00 2.74 2.59 0.00 0.00 7.15 7.43 0.00 0.00 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 9.68 3.60 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 P 0.00 3.87 0.00 2.11 2.24 0.00 3.79 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 1.99 2.10 0.00 32 N 8.29 4.12 0.00 2.70 2.72 0.00 0.00 7.42 6.68 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 33 K 9.24 3.89 0.00 1.86 2.06 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.41 1.20 7.81 34 L 7.80 4.40 0.00 1.70 1.98 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 35 E 9.62 4.06 0.00 2.15 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 2.29 2.28 0.00 36 L 8.22 4.68 0.00 1.66 1.65 0.93 0.64 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 37 R 8.33 4.82 0.00 1.63 1.81 0.00 3.25 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.66 0.00 38 K 8.57 4.52 0.00 1.64 1.72 0.00 1.82 0.00 0.00 0.61 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.57 1.28 7.81 39 Y 8.08 4.59 0.00 2.84 2.44 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 40 C 9.05 4.37 0.00 2.86 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.78 0.00 2.29 2.05 0.00 3.73 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.91 0.00 42 W 8.87 4.90 0.00 3.11 3.07 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 0.00 0.00 0.00 0.00 43 C 7.93 4.65 0.00 3.36 2.83 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 0.00 0.00 0.00 44 R 7.77 4.08 0.00 1.83 2.43 0.00 3.34 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.50 0.00 45 K 7.72 3.61 0.00 1.83 2.05 0.00 1.82 0.00 0.00 1.81 0.00 0.00 2.91 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.29 1.31 7.81 46 H 7.44 4.24 0.00 3.31 3.74 0.00 5.10 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 8.16 4.71 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 48 V 8.66 3.74 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 0.84 0.00 0.00 0.95 0.00 0.00 49 H 9.14 4.75 0.00 3.55 3.47 0.00 5.95 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 8.57 5.44 0.00 1.77 1.36 0.00 3.45 0.00 0.00 4.01 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 51 E 8.58 4.74 0.00 1.93 1.87 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 2.24 2.27 0.00 52 V 8.56 4.42 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 0.71 0.00 0.00 0.99 0.00 0.00 *53 K 8.25 4.13 0.00 1.56 1.61 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.