NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.3218 8.2027 119.6870 55.5436 31.2577 176.8618 4 L 3.8008 7.8880 120.0544 57.7482 41.9694 176.9983 5 N 4.3124 8.5350 117.8833 56.1493 38.8998 176.6683 6 A 3.9761 7.9305 121.9321 54.8501 18.4481 179.2804 7 L 3.8722 8.0107 118.9868 58.0941 42.1105 178.7772 8 L 3.8978 8.1620 120.3000 58.2754 41.9294 178.8391 9 A 3.9731 8.2570 120.8177 55.2035 18.2187 179.5935 10 S 4.0125 8.2468 111.6428 61.5190 62.4860 176.3414 11 L 3.9794 8.1621 121.8957 57.8192 41.2941 179.4066 12 E 3.9554 8.5834 118.6555 59.2729 29.4320 179.2425 13 A 3.9641 8.2209 120.9880 55.1208 18.4400 179.2428 14 E 3.8676 8.3986 118.0492 59.4590 29.6749 178.5152 15 N 4.2937 8.5916 117.4956 56.5437 39.0252 176.7158 16 K 3.9832 8.3975 123.5701 60.1856 32.2113 179.4355 17 Q 4.0237 8.1700 120.9258 60.2745 27.9921 180.4407 18 L 4.1927 8.3671 121.6748 57.5325 41.6352 179.7455 19 K 3.9748 8.3140 118.3667 59.4450 31.8792 179.2737 20 A 4.0342 8.0283 121.0638 54.8287 18.2145 179.6232 21 K 3.8663 8.3323 118.6825 59.5211 32.2362 179.1617 22 V 3.5839 8.2011 119.0278 66.1104 31.4110 177.8636 23 E 3.9772 8.1231 118.2730 59.2484 29.2938 178.9571 24 E 3.8912 8.3949 119.4534 59.4769 29.7052 179.0035 25 L 4.0411 8.2897 119.3400 57.4193 41.6152 179.2816 26 L 3.9465 8.3827 119.4032 58.0183 41.4164 179.5308 27 A 4.0226 7.7660 119.0112 54.9800 18.5356 179.2979 28 K 4.0340 8.1600 118.3293 59.5623 32.0404 179.2476 29 V 3.7027 7.9913 118.2605 65.8197 31.5345 177.8044 30 G 3.7526 7.8540 103.5969 46.3767 0.0000 173.8335 31 E 4.3154 8.0402 125.5770 56.6310 29.7516 176.1527 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 3 Q 8.20 4.32 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.86 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 4 L 7.89 3.80 0.00 1.76 1.66 0.92 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 5 N 8.54 4.31 0.00 2.77 2.85 0.00 0.00 7.02 7.61 0.00 0.00 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 A 7.93 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.01 3.87 0.00 1.79 1.84 0.92 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 8 L 8.16 3.90 0.00 1.78 1.85 0.97 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.26 3.97 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 S 8.25 4.01 0.00 4.01 4.01 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 0.00 0.00 0.00 11 L 8.16 3.98 0.00 1.92 1.70 0.92 1.12 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 12 E 8.58 3.96 0.00 2.17 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 2.41 0.00 13 A 8.22 3.96 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 14 E 8.40 3.87 0.00 2.16 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 2.31 2.32 0.00 15 N 8.59 4.29 0.00 2.86 3.06 0.00 0.00 6.89 6.67 0.00 0.00 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 K 8.40 3.98 0.00 1.94 1.96 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.45 7.81 17 Q 8.17 4.02 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 18 L 8.37 4.19 0.00 1.78 1.74 0.92 0.83 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 19 K 8.31 3.97 0.00 1.94 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.57 7.81 20 A 8.03 4.03 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.33 3.87 0.00 1.92 1.97 0.00 1.53 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.49 7.81 22 V 8.20 3.58 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 0.99 0.00 0.00 0.96 0.00 0.00 23 E 8.12 3.98 0.00 2.23 1.98 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 2.55 2.46 0.00 24 E 8.39 3.89 0.00 2.02 2.10 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 2.31 2.35 0.00 25 L 8.29 4.04 0.00 1.71 1.70 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.38 3.95 0.00 1.82 1.73 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 27 A 7.77 4.02 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.03 0.00 1.89 1.97 0.00 1.53 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.48 7.81 29 V 7.99 3.70 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 0.87 0.00 0.00 0.98 0.00 0.00 30 G 7.85 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 0.00 0.00 0.00 31 E 8.04 4.32 0.00 2.14 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 2.51 2.46 0.00