NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8977 8.3544 109.7374 44.8477 0.0000 172.9541 2 S 3.9258 8.5657 120.4017 56.5980 62.8525 173.0677 3 S 4.1875 8.8047 123.0549 62.8384 64.2527 173.2259 4 G 3.5591 7.5353 112.8398 44.6046 0.0000 173.3036 5 S 4.7945 7.5537 114.3584 56.4082 66.9711 172.5796 6 S 4.7064 8.7707 114.7786 56.5623 65.7852 173.4598 7 G 4.1340 7.7370 118.0018 46.3472 0.0000 172.5974 8 Q 4.6275 7.2950 117.5494 54.6565 33.0989 173.7855 9 L 4.7079 8.2092 117.4615 54.8498 44.2937 178.3916 10 S 4.1672 8.2421 114.7489 61.5116 62.4116 176.3144 11 S 4.2236 8.1764 115.5918 60.8778 62.7846 175.3329 12 E 4.4598 8.2374 121.5653 57.6517 30.3905 178.1894 13 I 3.7488 7.5783 119.6201 64.4656 37.0046 177.9951 14 E 4.0629 8.0776 118.2862 59.5841 29.1263 179.3885 15 R 4.1426 7.8530 117.5906 59.0389 30.0796 178.8393 16 L 4.2672 8.1665 118.9458 57.8789 41.5682 179.3333 17 M 4.3918 7.9932 119.8638 57.8302 31.6475 178.5139 18 S 4.0745 7.5553 111.7371 61.6580 62.6668 176.1854 19 Q 3.9701 7.8786 118.5969 57.1072 28.4682 177.1791 20 G 3.9541 7.5138 106.6852 45.0875 0.0000 173.3646 21 Y 4.4273 7.3759 119.0341 57.4575 38.6438 175.7048 22 S 4.4518 8.8681 118.8903 57.9244 64.5830 174.3808 23 Y 4.0916 8.6533 125.7512 60.9761 38.4808 178.4714 24 Q 3.8948 8.1788 118.2348 59.0664 28.9364 178.2343 25 D 4.3220 8.1018 119.2619 57.4648 40.9026 178.7622 26 I 3.5743 7.7605 120.0223 64.4906 37.0482 178.3969 27 Q 3.7540 7.6144 118.4794 58.9994 28.5060 178.8054 28 K 3.7366 8.3457 119.4992 59.7115 32.0156 179.1939 29 A 3.8679 7.9248 120.5662 55.0406 18.3280 179.5605 30 L 3.8538 7.7121 117.5456 57.9127 41.2186 179.8181 31 V 3.5514 7.9174 118.2388 66.3794 31.2371 178.2291 32 I 3.8360 7.3539 117.2962 63.8138 37.1400 177.3962 33 A 4.1181 8.3082 119.9049 51.6317 18.8345 176.5892 34 H 4.0738 8.4154 112.9573 57.4244 26.4527 175.0210 35 N 4.0922 8.7013 111.5076 54.1889 37.1207 175.3253 36 N 4.5374 7.6328 118.0676 52.8217 39.1474 175.2246 37 I 3.6391 8.2429 129.1564 63.9910 38.2061 177.3826 38 E 3.9168 8.1581 118.9810 59.6281 29.5512 178.7550 39 M 3.9812 8.7036 118.2900 58.6487 32.3248 178.0761 40 A 3.9394 8.1679 120.9883 55.0738 18.4736 179.7315 41 K 3.8273 8.4180 117.4177 59.5995 31.9648 179.2401 42 N 4.3110 8.2520 116.7044 56.3184 38.4585 177.2222 43 I 3.7870 7.5723 120.7642 64.6227 37.2843 178.2770 44 L 3.7321 7.4808 118.9449 57.8667 41.1586 179.6824 45 R 4.1660 8.0529 116.7904 58.2516 30.0907 177.0971 46 E 4.5803 7.9841 115.3869 55.9511 31.1799 175.9786 47 F 4.5778 8.1334 115.3734 59.0574 41.1822 176.3947 48 S 4.4087 8.2026 111.9306 59.1282 62.5010 173.8231 49 G 4.0428 7.7604 108.5613 43.7337 0.0000 171.1422 50 P 4.3849 0.0000 0.0000 62.2160 30.8111 176.0378 51 S 4.1689 8.8010 119.2134 60.5625 62.5648 174.4023 52 S 4.7535 8.7753 113.2567 56.2296 66.2737 174.1054 53 G 3.4265 8.8071 110.2314 45.4603 0.0000 173.1003 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 3.90 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 2 S 8.57 3.93 0.00 3.92 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.80 4.19 0.00 4.02 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 4 G 7.54 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.55 4.79 0.00 3.81 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.77 4.71 0.00 3.91 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 7 G 7.74 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.29 4.63 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 9 L 8.21 4.71 0.00 1.66 1.58 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.24 4.17 0.00 4.09 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 4.22 0.00 4.03 4.03 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.24 4.46 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.47 0.00 13 I 7.58 3.75 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 1.62 1.18 0.97 0.00 0.00 14 E 8.08 4.06 0.00 1.98 2.05 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 2.59 2.53 0.00 15 R 7.85 4.14 0.00 2.02 2.01 0.00 3.15 0.00 0.00 3.36 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.93 0.00 16 L 8.17 4.27 0.00 1.96 1.98 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 17 M 7.99 4.39 0.00 2.14 2.33 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.52 0.00 18 S 7.56 4.07 0.00 3.88 4.03 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.88 3.97 0.00 1.68 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 5.61 0.00 0.00 0.00 0.00 0.00 2.54 2.46 0.00 20 G 7.51 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.38 4.43 0.00 3.14 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.87 4.45 0.00 3.99 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 23 Y 8.65 4.09 0.00 3.15 3.01 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 24 Q 8.18 3.89 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.68 0.00 0.00 0.00 0.00 0.00 2.55 2.57 0.00 25 D 8.10 4.32 0.00 2.87 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 26 I 7.76 3.57 1.86 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.85 0.84 0.00 0.00 27 Q 7.61 3.75 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.58 0.00 0.00 0.00 0.00 0.00 1.71 2.03 0.00 28 K 8.35 3.74 0.00 1.81 1.81 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.55 7.81 29 A 7.92 3.87 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.71 3.85 0.00 1.82 1.69 0.86 0.81 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 31 V 7.92 3.55 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 1.01 0.00 0.00 0.95 0.00 0.00 32 I 7.35 3.84 1.79 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.71 0.83 0.00 0.00 33 A 8.31 4.12 1.36 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 0.00 0.00 34 H 8.42 4.07 0.00 3.30 3.34 0.00 5.82 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 N 8.70 4.09 0.00 2.81 2.90 0.00 0.00 6.77 7.85 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 36 N 7.63 4.54 0.00 2.72 2.81 0.00 0.00 6.84 7.91 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 37 I 8.24 3.64 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 1.64 1.22 0.91 0.00 0.00 38 E 8.16 3.92 0.00 2.19 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 2.40 2.36 0.00 39 M 8.70 3.98 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.52 0.00 40 A 8.17 3.94 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.42 3.83 0.00 1.99 1.87 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.62 7.81 42 N 8.25 4.31 0.00 2.93 2.88 0.00 0.00 7.02 6.83 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 43 I 7.57 3.79 1.95 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.87 0.72 0.00 0.00 44 L 7.48 3.73 0.00 1.19 0.13 0.46 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.05 4.17 0.00 2.01 2.13 0.00 3.26 0.00 0.00 3.25 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 46 E 7.98 4.58 0.00 1.94 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.45 0.00 47 F 8.13 4.58 0.00 3.11 3.02 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 0.00 0.00 0.00 48 S 8.20 4.41 0.00 3.90 4.05 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 49 G 7.76 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.38 0.00 2.19 2.12 0.00 3.82 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 51 S 8.80 4.17 0.00 3.80 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 52 S 8.78 4.75 0.00 3.83 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 G 8.81 3.43 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 0.00