NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7836 8.3549 109.7368 43.7863 0.0000 173.3420 2 S 3.8822 8.3397 119.1622 56.5388 61.6539 168.7977 3 H 4.6247 7.2816 119.2624 54.8600 33.7109 173.7620 4 K 4.3291 8.5907 125.9142 56.7864 33.4275 176.5330 5 K 4.3190 7.9933 116.3928 55.3539 34.8617 175.2164 6 T 4.7453 8.0584 113.1617 58.9774 73.5195 174.2357 7 D 4.3252 8.6189 120.1557 57.4744 40.6238 179.1687 8 S 4.0545 7.9680 113.1354 61.3656 62.4662 175.6342 9 E 3.9031 7.6785 121.6843 59.1538 29.3097 178.6858 10 V 3.5497 7.9345 118.4296 66.3638 31.6118 177.9296 11 Q 3.9375 8.1998 118.8778 58.7787 28.8178 178.1187 12 L 3.9971 8.1191 120.4255 57.8111 41.6934 179.0560 13 E 4.0042 8.3920 118.6893 59.8050 29.2909 179.2076 14 M 4.0140 8.2536 118.6437 58.6383 31.8735 178.6798 15 I 3.8765 7.7066 117.7606 64.3691 38.3054 177.9896 16 T 4.0442 8.1972 116.4900 66.7539 68.3079 176.6376 17 A 4.1468 8.1863 122.2621 54.4267 18.5236 179.3295 18 W 4.5370 8.7364 127.9385 60.5923 30.7136 177.9196 19 K 3.8016 8.0575 119.7787 59.4543 31.5473 178.9186 20 K 4.0214 7.8764 119.1022 59.0420 31.7928 179.1519 21 F 4.2903 7.8971 114.0509 60.2008 37.5887 177.7432 22 V 2.8404 6.8283 118.7244 64.9831 31.0047 177.4946 23 E 3.8372 7.6938 117.0852 59.3604 29.4422 178.4822 24 E 4.0741 8.0524 117.8771 59.3186 29.7749 178.5522 25 K 4.2660 8.1659 118.0523 58.1723 33.4118 177.4182 26 K 4.3030 7.7477 123.6001 53.5195 31.6285 173.8294 27 K 4.2157 7.7382 121.1824 55.2325 33.1142 175.2542 28 K 4.1368 8.2560 126.4624 56.4828 32.4229 175.7985 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 G 8.35 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 0.00 0.00 0.00 2 S 8.34 3.88 0.00 4.15 3.98 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.28 4.62 0.00 3.08 3.10 0.00 5.73 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 4 K 8.59 4.33 0.00 1.92 1.81 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.47 7.81 5 K 7.99 4.32 0.00 1.83 1.79 0.00 1.52 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.29 1.39 7.81 6 T 8.06 4.75 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 7 D 8.62 4.33 0.00 2.70 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 7.97 4.05 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 9 E 7.68 3.90 0.00 2.01 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 2.31 2.36 0.00 10 V 7.93 3.55 2.22 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 1.08 0.00 0.00 0.97 0.00 0.00 11 Q 8.20 3.94 0.00 2.27 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.55 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 12 L 8.12 4.00 0.00 1.92 1.71 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.39 4.00 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 14 M 8.25 4.01 0.00 1.97 2.21 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.52 0.00 15 I 7.71 3.88 2.03 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.89 1.05 0.00 0.00 16 T 8.20 4.04 4.31 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 1.24 0.00 0.00 17 A 8.19 4.15 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 18 W 8.74 4.54 0.00 3.57 3.49 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 0.00 0.00 0.00 0.00 19 K 8.06 3.80 0.00 1.82 1.90 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.37 7.81 20 K 7.88 4.02 0.00 2.03 1.89 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.63 7.81 21 F 7.90 4.29 0.00 3.28 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 V 6.83 2.84 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 0.77 0.00 0.00 -0.19 0.00 0.00 23 E 7.69 3.84 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 24 E 8.05 4.07 0.00 2.03 2.24 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 2.37 2.42 0.00 25 K 8.17 4.27 0.00 2.03 1.87 0.00 2.03 0.00 0.00 1.80 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.52 7.81 26 K 7.75 4.30 0.00 1.65 1.71 0.00 1.83 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.28 1.29 7.81 27 K 7.74 4.22 0.00 1.74 1.70 0.00 1.77 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.30 1.32 7.81 28 K 8.26 4.14 0.00 1.67 1.56 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.40 7.81