NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4833 8.1633 120.3263 55.0903 33.8311 176.0730 2 T 3.7161 8.4950 117.7633 65.3045 68.3668 175.3864 3 I 3.7752 8.5487 115.7866 64.0827 38.0385 177.5128 4 D 4.3583 7.9846 120.1341 56.9342 40.3908 178.4868 5 E 4.0262 8.1391 119.5912 59.2955 29.4756 179.2561 6 I 3.8025 7.5598 119.4675 64.1897 37.3255 178.3354 7 I 3.7172 8.1018 121.1271 64.5112 36.7340 178.4028 8 E 4.2769 8.2250 119.2358 58.6298 29.4446 179.0230 9 A 4.1450 7.6990 121.1499 55.1153 18.5408 179.7498 10 I 3.6627 7.9209 118.6045 64.4656 37.3099 177.8662 11 E 4.2547 8.4077 116.5104 57.4409 29.6505 177.8288 12 K 4.4586 7.4689 117.9700 56.5453 32.9517 176.9224 13 L 4.3455 7.3098 119.3470 54.4879 42.1779 177.5636 14 T 4.2681 10.7500 112.8594 61.1405 71.0096 176.0637 15 V 3.5824 8.1874 119.5569 65.9467 31.4642 177.8950 16 S 4.2265 7.9871 114.7216 61.1560 62.7369 176.2373 17 E 3.9429 8.0764 121.4727 59.2156 29.1718 178.8468 18 L 3.9080 8.2319 120.5168 58.3280 42.0278 178.9965 19 A 3.9761 7.8285 120.4804 55.0673 18.2889 179.2399 20 E 3.9052 8.1233 117.9800 58.9331 29.6753 178.8107 21 L 3.9152 8.2293 120.9038 58.0610 42.2389 178.8916 22 V 3.5942 8.0153 118.7068 65.9097 31.4679 177.8838 23 K 3.9244 8.3167 118.7054 60.0915 32.2458 179.0972 24 K 3.9824 8.1132 119.7896 58.9400 32.1050 179.2190 25 L 4.1385 8.0215 119.0983 58.0973 41.6183 179.4713 26 E 4.0433 8.2215 118.3621 59.5061 29.2866 178.6927 27 D 4.3163 8.2690 117.9633 57.4880 41.1315 178.2979 28 K 3.8255 8.5249 119.6801 58.6484 32.0904 177.7331 29 F 4.6178 7.9314 116.1066 56.0196 40.4602 175.8198 30 G 3.8992 8.0760 105.2071 46.6014 0.0000 174.4689 31 V 4.2262 8.3786 119.5013 62.2095 33.4978 176.2667 32 T 4.2570 8.2596 116.1487 60.9710 69.3000 173.9750 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 M 8.16 4.48 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.57 0.00 2 T 8.50 3.72 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 3 I 8.55 3.78 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.12 0.90 0.00 0.00 4 D 7.98 4.36 0.00 2.98 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 5 E 8.14 4.03 0.00 2.24 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 2.49 2.49 0.00 6 I 7.56 3.80 2.00 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 1.64 0.85 0.91 0.00 0.00 7 I 8.10 3.72 2.07 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.00 0.91 0.00 0.00 8 E 8.22 4.28 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.22 0.00 9 A 7.70 4.14 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 7.92 3.66 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.12 0.91 0.00 0.00 11 E 8.41 4.25 0.00 2.16 2.19 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 2.51 2.28 0.00 12 K 7.47 4.46 0.00 1.90 1.88 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.60 7.81 13 L 7.31 4.35 0.00 1.72 1.60 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 14 T 10.75 4.27 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 1.25 0.00 0.00 15 V 8.19 3.58 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 1.06 0.00 0.00 0.93 0.00 0.00 16 S 7.99 4.23 0.00 3.91 3.89 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.08 3.94 0.00 2.27 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 2.33 2.31 0.00 18 L 8.23 3.91 0.00 1.78 1.83 0.92 1.28 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 19 A 7.83 3.98 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 20 E 8.12 3.91 0.00 2.22 2.06 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 2.31 2.32 0.00 21 L 8.23 3.92 0.00 1.79 1.87 0.93 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 22 V 8.02 3.59 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.02 0.00 0.00 23 K 8.32 3.92 0.00 2.01 2.16 0.00 1.38 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.56 1.55 7.81 24 K 8.11 3.98 0.00 2.01 1.93 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.48 1.80 7.81 25 L 8.02 4.14 0.00 1.86 1.72 0.89 0.85 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 26 E 8.22 4.04 0.00 2.06 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 2.34 2.49 0.00 27 D 8.27 4.32 0.00 3.11 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 28 K 8.52 3.83 0.00 1.74 1.92 0.00 1.73 0.00 0.00 1.32 0.00 0.00 2.44 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.99 1.31 7.81 29 F 7.93 4.62 0.00 3.04 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 30 G 8.08 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.38 4.23 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 0.85 0.00 0.00 0.96 0.00 0.00 32 T 8.26 4.26 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