NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.0941 8.1233 122.3699 51.4503 20.8212 175.2606 2 W 5.0779 9.0875 119.1686 53.8490 33.0083 172.9668 3 K 4.8811 9.6010 124.6025 54.7450 34.7236 174.7625 4 V 4.7725 8.5012 127.1121 61.9823 33.2950 175.0309 5 S 4.8408 9.1502 121.6271 56.7420 67.3582 173.0246 6 V 4.7937 8.3222 122.7895 60.8613 33.7259 174.3652 7 D 4.4585 9.2733 128.9604 54.3995 41.1708 176.9754 8 Q 4.0618 8.8529 126.3597 58.7667 29.0124 177.7194 9 D 4.5583 8.2695 116.6951 56.0883 41.2935 177.2245 10 T 4.3183 7.7999 114.3015 64.6719 70.0478 175.0182 11 C 4.0311 8.0414 121.4170 59.9608 31.7487 173.1150 12 I 4.2466 8.3573 118.6257 59.9891 36.8914 175.4038 13 G 4.2269 8.2325 108.2257 46.7107 0.0000 175.7576 14 C 4.0085 8.1030 115.6219 58.5763 30.2661 174.5292 15 A 3.6359 7.6781 122.4461 52.9328 16.8287 178.9251 16 I 3.6432 7.2626 119.8216 65.1619 36.9932 178.1710 17 C 3.7562 7.7640 114.3918 61.2243 29.1368 175.6695 18 A 4.0769 7.7427 121.8704 54.5815 18.0558 179.1015 19 S 4.1604 7.9814 111.0362 61.6305 62.6240 175.9632 20 L 4.1641 7.9159 121.7847 57.1630 43.4101 176.3340 21 C 5.0072 8.4529 117.9529 54.3119 43.5012 172.4685 22 P 4.2196 0.0000 0.0000 64.9859 31.6647 178.2246 23 D 4.4917 8.0754 117.9127 56.0603 41.4478 176.7389 24 V 4.0279 8.0091 118.8581 63.1621 33.7686 175.4777 25 F 5.5525 8.1626 117.0132 55.5211 41.8202 174.7414 26 E 4.8912 9.2228 119.2731 54.8652 33.4296 174.3540 27 M 4.9199 8.6860 120.3449 54.9545 33.4866 175.7943 28 N 4.9665 8.9889 120.4534 51.0819 39.9711 175.0287 29 D 4.4582 8.5691 116.5963 56.5608 40.8456 176.9852 30 E 4.3265 8.3582 117.4341 55.5986 30.1052 176.2894 31 G 3.8753 8.3607 107.6396 46.2469 0.0000 173.5068 32 K 4.9421 8.1181 118.2999 54.0911 35.2724 175.5761 33 A 5.0141 8.4182 123.2300 51.9873 19.8482 176.5708 34 Q 4.7201 9.1541 116.9139 54.0595 32.7224 172.2290 35 P 4.6909 0.0000 0.0000 62.7046 31.5685 176.7753 36 K 4.3559 9.0346 122.9144 57.5471 33.4282 177.2121 37 V 4.4949 7.3974 113.4237 59.7989 34.9995 175.2895 38 E 4.3343 8.7164 121.5693 57.3609 30.1497 176.7270 39 V 4.6918 7.4398 116.9039 61.1104 34.8592 173.6568 40 I 4.6690 9.2009 126.6160 59.7708 39.5021 176.1045 41 E 4.5479 8.8259 123.6328 56.9124 31.7735 176.5244 42 D 4.4877 8.1155 118.9150 54.0282 42.1190 176.1423 43 E 4.0601 9.0558 127.8717 59.4937 29.7072 178.5126 44 E 3.9692 8.6358 118.7423 59.3897 29.4906 179.3481 45 L 3.9689 8.0000 118.5505 57.7143 41.7731 178.7384 46 Y 3.6950 7.8888 119.4437 60.6518 38.6608 177.7185 47 N 3.8313 8.2286 117.9924 56.3851 38.6307 175.0225 48 C 4.2922 8.1554 115.2015 58.1282 41.0613 175.8147 49 A 4.0912 7.9816 123.6986 54.8495 17.9248 179.4925 50 K 3.6729 7.9296 118.5754 59.5449 32.1765 178.9406 51 E 3.8797 8.0838 118.6531 59.2734 29.4346 179.1599 52 A 3.8543 8.1026 120.8549 55.1943 18.1715 179.2998 53 M 3.9115 8.0650 115.9408 59.0277 32.4516 178.1602 54 E 4.0432 8.0849 116.9079 58.8860 29.6518 178.5146 55 A 4.3490 7.5957 119.3053 52.2005 19.2923 177.1004 56 C 3.9586 7.5179 119.1244 58.9080 31.7769 172.8186 57 P 4.3022 0.0000 0.0000 64.9587 31.0817 177.3018 58 V 4.2224 7.5366 109.8094 60.2584 32.5968 175.2967 59 S 3.6436 7.6315 114.5172 59.7389 60.5783 172.6876 60 A 4.4176 7.7401 120.6200 52.8295 20.3193 178.0552 61 I 5.0629 7.6410 116.4880 59.9497 38.9015 175.3204 62 T 4.8805 8.9445 115.6005 60.0462 72.7453 172.6937 63 I 5.0549 8.3597 122.3237 59.7127 40.6255 174.2619 64 E 4.7091 9.5557 128.5762 54.6526 31.5662 174.1846 65 E 4.9554 8.8526 126.6641 54.6205 32.0110 175.2792 66 A 4.2454 8.0346 125.7110 52.1626 19.0969 175.9032 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 A 8.12 4.09 1.15 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 0.00 0.00 2 W 9.09 5.08 0.00 3.39 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 3 K 9.60 4.88 0.00 1.78 1.68 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.54 7.81 4 V 8.50 4.77 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.90 0.00 0.00 5 S 9.15 4.84 0.00 3.80 3.72 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 6 V 8.32 4.79 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 0.87 0.00 0.00 1.15 0.00 0.00 7 D 9.27 4.46 0.00 2.75 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 8.85 4.06 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.88 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 9 D 8.27 4.56 0.00 2.84 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.80 4.32 4.38 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 1.22 0.00 0.00 11 C 8.04 4.03 0.00 2.99 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 I 8.36 4.25 1.86 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 1.32 0.78 0.94 0.00 0.00 13 G 8.23 4.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 C 8.10 4.01 0.00 3.08 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 A 7.68 3.64 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.26 3.64 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.59 0.82 0.00 0.00 17 C 7.76 3.76 0.00 1.40 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.74 4.08 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 19 S 7.98 4.16 0.00 3.90 4.07 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 20 L 7.92 4.16 0.00 1.69 1.77 0.89 1.17 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 21 C 8.45 5.01 0.00 3.04 3.34 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 22 P 0.00 4.22 0.00 2.24 2.28 0.00 3.84 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 23 D 8.08 4.49 0.00 2.68 2.75 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 24 V 8.01 4.03 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.86 0.00 0.00 25 F 8.16 5.55 0.00 2.92 2.91 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 0.00 0.00 0.00 0.00 26 E 9.22 4.89 0.00 2.00 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 2.37 2.30 0.00 27 M 8.69 4.92 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.50 0.00 28 N 8.99 4.97 0.00 2.88 3.09 0.00 0.00 6.91 8.05 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 29 D 8.57 4.46 0.00 2.68 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.36 4.33 0.00 2.07 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 2.26 2.35 0.00 31 G 8.36 3.88 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 0.00 0.00 0.00 32 K 8.12 4.94 0.00 1.96 1.72 0.00 1.67 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.37 7.81 33 A 8.42 5.01 1.25 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 0.00 0.00 34 Q 9.15 4.72 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.94 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 35 P 0.00 4.69 0.00 2.02 1.88 0.00 3.69 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 36 K 9.03 4.36 0.00 1.69 1.91 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.44 7.81 37 V 7.40 4.49 2.20 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 0.74 0.00 0.00 0.85 0.00 0.00 38 E 8.72 4.33 0.00 1.93 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 39 V 7.44 4.69 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 0.83 0.00 0.00 0.94 0.00 0.00 40 I 9.20 4.67 2.17 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 1.32 0.75 1.12 0.00 0.00 41 E 8.83 4.55 0.00 1.98 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 2.19 2.28 0.00 42 D 8.12 4.49 0.00 2.76 2.61 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 0.00 0.00 0.00 0.00 43 E 9.06 4.06 0.00 2.20 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 2.47 2.56 0.00 44 E 8.64 3.97 0.00 2.13 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 2.35 2.51 0.00 45 L 8.00 3.97 0.00 1.86 1.69 0.93 0.81 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 46 Y 7.89 3.69 0.00 1.99 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.23 3.83 0.00 2.78 2.73 0.00 0.00 6.86 7.21 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 48 C 8.16 4.29 0.00 3.13 3.29 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 49 A 7.98 4.09 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 50 K 7.93 3.67 0.00 0.90 1.48 0.00 1.52 0.00 0.00 1.48 0.00 0.00 2.94 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.30 1.34 7.81 51 E 8.08 3.88 0.00 2.10 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 52 A 8.10 3.85 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.06 3.91 0.00 2.14 2.20 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 2.76 2.58 0.00 54 E 8.08 4.04 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 55 A 7.60 4.35 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 56 C 7.52 3.96 0.00 2.89 2.78 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 57 P 0.00 4.30 0.00 2.19 2.14 0.00 3.69 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 58 V 7.54 4.22 2.07 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 0.75 0.00 0.00 0.96 0.00 0.00 59 S 7.63 3.64 0.00 3.95 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 A 7.74 4.42 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 61 I 7.64 5.06 1.88 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.59 1.13 0.00 0.00 62 T 8.94 4.88 4.30 0.00 0.00 0.00 0.00 0.00 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 63 I 8.36 5.05 2.04 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 1.33 0.76 1.20 0.00 0.00 64 E 9.56 4.71 0.00 2.05 1.85 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 2.24 2.26 0.00 65 E 8.85 4.96 0.00 2.07 1.74 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 1.74 1.47 0.00 66 A 8.03 4.25 1.10 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 0.00 0.00