NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6122 8.2227 120.3155 52.7928 40.9433 175.9050 2 I 3.5823 8.0671 118.6673 63.5110 37.6368 176.9634 3 C 4.1789 8.4418 117.5563 60.1911 37.7422 174.8718 4 D 4.2276 8.8738 119.7062 57.3078 40.7079 178.1138 5 I 3.6348 8.1603 120.4844 64.6190 37.2139 178.1185 6 A 4.0233 8.3750 121.6583 55.3245 18.1828 179.8288 7 I 3.6695 8.0755 118.2086 64.3143 36.9752 178.4061 8 A 4.0185 8.2124 120.9758 55.4725 18.3535 179.5411 9 Q 4.0572 8.4984 115.4358 56.3838 30.1764 174.0037 10 C 4.3309 7.4458 112.3636 56.3557 35.4757 172.5539 11 S 4.7345 8.3341 114.9672 56.6110 64.0758 174.4631 12 L 3.9000 8.5463 128.8135 57.8352 41.6094 179.3869 13 T 3.9854 7.7921 115.4077 66.6633 68.5826 176.3866 14 L 4.0201 8.1981 121.9373 57.8810 42.0310 178.0380 15 C 4.1828 7.9621 116.6293 60.2480 39.8509 175.8329 16 Q 3.8203 8.0144 118.4606 58.5685 28.2475 178.1667 17 D 4.4567 8.0605 119.7527 56.1628 41.2111 176.2514 18 C 4.4513 7.5346 118.3497 55.7192 44.1398 172.4846 19 E 3.8621 8.4633 125.4522 59.3074 29.6170 178.6419 20 N 4.7699 7.6351 118.8551 50.8488 35.2863 174.6908 21 T 3.8361 7.9400 125.9418 67.4456 68.9843 173.5749 22 P 4.4584 0.0000 0.0000 65.3202 31.3687 178.3535 23 I 3.6196 7.6616 119.1274 64.3187 37.1017 178.6773 24 C 4.1903 8.4220 119.5040 59.5494 41.6843 175.1727 25 E 3.6826 8.6485 120.5355 59.3842 29.1051 179.0455 26 L 3.9222 7.9982 119.9190 58.2216 42.1239 178.8552 27 A 3.9791 8.1359 120.7526 55.0514 18.2079 179.6690 28 V 3.4493 8.0851 117.0484 66.2160 31.3635 178.3736 29 K 4.1809 7.8947 117.2064 59.5367 31.9243 179.3067 30 G 3.7610 8.3591 105.4396 47.4015 0.0000 175.4872 31 S 4.3741 7.7965 114.6665 59.8616 63.0623 173.2814 32 C 5.1650 8.0493 117.3240 54.1123 43.8356 172.3882 33 P 4.5918 0.0000 0.0000 61.4135 31.8251 174.3956 34 P 2.9700 0.0000 0.0000 61.1780 31.6838 174.4972 35 P 3.9622 0.0000 0.0000 61.8397 32.4692 175.1114 36 W 4.3957 8.3079 118.1509 55.6981 30.6231 176.6234 37 S 4.1481 8.8484 118.5547 59.1453 62.3150 171.6898 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 D 8.22 4.61 0.00 2.91 2.88 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 2 I 8.07 3.58 1.87 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 1.63 1.29 0.92 0.00 0.00 3 C 8.44 4.18 0.00 3.15 3.11 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 0.00 0.00 0.00 0.00 4 D 8.87 4.23 0.00 2.73 2.93 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 0.00 0.00 0.00 5 I 8.16 3.63 2.05 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 1.46 0.65 0.93 0.00 0.00 6 A 8.37 4.02 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 7 I 8.08 3.67 2.01 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.00 0.91 0.00 0.00 8 A 8.21 4.02 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 9 Q 8.50 4.06 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.44 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 10 C 7.45 4.33 0.00 3.48 3.28 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 11 S 8.33 4.73 0.00 3.88 3.75 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 0.00 0.00 0.00 12 L 8.55 3.90 0.00 1.58 1.56 0.37 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 13 T 7.79 3.99 4.26 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 1.22 0.00 0.00 14 L 8.20 4.02 0.00 1.67 1.66 0.94 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 15 C 7.96 4.18 0.00 3.12 3.08 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 0.00 0.00 0.00 0.00 16 Q 8.01 3.82 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 17 D 8.06 4.46 0.00 2.76 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 18 C 7.53 4.45 0.00 2.99 3.10 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 3.86 0.00 1.95 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 2.30 2.34 0.00 20 N 7.64 4.77 0.00 2.95 2.93 0.00 0.00 6.05 7.20 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 21 T 7.94 3.84 4.21 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 0.00 0.00 1.22 0.00 0.00 22 P 0.00 4.46 0.00 2.22 2.27 0.00 3.75 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.89 0.00 23 I 7.66 3.62 1.97 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.48 0.89 0.00 0.00 24 C 8.42 4.19 0.00 2.98 3.26 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 25 E 8.65 3.68 0.00 2.02 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 2.18 2.41 0.00 26 L 8.00 3.92 0.00 1.80 1.73 0.90 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.14 3.98 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 28 V 8.09 3.45 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.98 0.00 0.00 29 K 7.89 4.18 0.00 1.79 1.89 0.00 1.37 0.00 0.00 1.48 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.62 0.86 7.81 30 G 8.36 3.76 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 0.00 0.00 0.00 31 S 7.80 4.37 0.00 4.06 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 32 C 8.05 5.17 0.00 3.30 2.99 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 0.00 0.00 0.00 33 P 0.00 4.59 0.00 2.01 2.00 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.88 0.00 34 P 0.00 2.97 0.00 1.82 1.49 0.00 3.59 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.88 0.00 35 P 0.00 3.96 0.00 2.10 1.98 0.00 3.50 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.87 0.00 36 W 8.31 4.40 0.00 3.50 3.25 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 37 S 8.85 4.15 0.00 4.09 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