NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3165 8.1233 122.3760 51.5356 20.8550 175.2033 2 W 5.2095 9.4250 118.7273 53.9380 33.2814 172.8918 3 K 4.8994 9.4544 125.5849 55.4351 33.8036 174.9261 4 V 5.0190 8.8655 127.8308 61.4667 33.2715 175.0128 5 S 4.8823 9.4536 123.0386 56.7851 67.5282 172.9088 6 V 4.7565 8.3473 122.2220 61.0228 33.9475 174.5275 7 D 4.4923 9.2018 128.6234 53.9224 40.9811 176.6395 8 Q 4.0532 8.8580 126.5630 59.2241 28.8650 178.3144 9 D 4.4978 8.2397 118.7222 56.8207 40.9313 178.0882 10 T 4.2630 7.8481 114.7962 64.0808 69.4294 175.0734 11 C 3.9623 7.5940 121.0319 60.0527 31.7885 173.1508 12 I 4.2117 8.3709 118.6965 60.2306 37.6016 175.7640 13 G 3.9307 8.1660 107.9401 46.6338 0.0000 174.9825 14 C 4.0494 7.9908 116.1751 58.7067 30.2342 174.7664 15 A 3.9642 8.1925 121.5084 52.9976 16.0568 179.0031 16 I 3.7067 7.2614 120.6305 65.2054 36.9688 178.2732 17 C 3.9585 7.8586 114.6751 61.2244 29.2534 175.7063 18 A 4.3386 7.8530 121.9025 54.6172 18.0675 179.2216 19 S 4.1799 7.8675 111.3207 61.5294 62.6077 176.1354 20 L 4.2274 8.0200 120.6664 56.7279 43.0482 176.9440 21 C 5.0108 8.5084 118.5438 53.8751 43.2243 172.4095 22 P 4.6488 0.0000 0.0000 64.1621 31.5838 178.3985 23 D 4.4441 8.0716 118.4691 56.3985 41.2206 176.8148 24 V 3.9907 7.6032 117.8710 62.8698 34.2484 175.3780 25 F 5.5633 8.5244 119.0662 55.5107 42.0356 174.6917 26 E 4.9318 9.1128 119.4428 55.0267 33.4234 174.0088 27 M 4.8939 8.6571 120.8022 54.5445 33.7283 176.0367 28 N 4.8176 8.9881 121.3010 51.2678 39.6844 175.5010 29 D 4.4264 8.5222 116.9309 57.0378 40.8259 177.3290 30 E 4.2326 8.4458 116.9738 56.0238 29.6585 176.8632 31 G 3.8835 8.3659 107.7784 45.9644 0.0000 173.3911 32 K 4.4958 7.9204 117.4507 53.8498 34.9927 175.3408 33 A 4.9752 8.2525 122.6578 52.0761 19.6148 176.8530 34 Q 4.7120 9.0475 117.2150 53.8704 32.6624 172.4174 35 P 4.6743 0.0000 0.0000 62.9743 31.3400 176.7874 36 K 4.1572 9.2973 125.0850 58.1295 33.0029 177.6577 37 V 4.2903 7.3785 113.0559 59.0698 33.4964 175.0540 38 E 4.1631 8.8765 124.3815 58.4578 30.8146 176.9944 39 V 4.9299 7.7236 119.1729 60.8053 34.1824 174.7267 40 I 4.4828 9.0375 129.1839 60.2705 38.6847 176.4865 41 E 4.0737 9.1862 126.6058 58.5653 30.3011 176.2973 42 D 5.3186 7.7923 116.1118 51.8240 45.7344 176.6475 43 E 4.0876 8.7512 118.9932 59.6731 29.3664 179.3848 44 E 3.9486 8.2044 118.1702 59.5701 29.6090 179.0945 45 L 3.9560 7.8957 119.6930 58.0085 42.2199 177.9787 46 Y 3.6664 7.8242 119.5034 60.8092 38.4545 178.0437 47 N 4.1709 8.4946 117.5798 56.2517 38.6886 176.4974 48 C 4.1597 8.1672 119.5914 59.7709 43.3243 175.6549 49 A 4.2032 7.9611 122.6817 54.8766 17.8927 179.7141 50 K 3.6374 8.0524 117.8439 59.8915 32.6074 179.0207 51 E 3.7963 7.8611 120.3547 58.9321 29.3970 178.7159 52 A 3.8796 7.5948 119.4499 55.3016 18.2305 179.2032 53 M 3.8180 7.8923 115.8552 58.9312 32.3578 178.0808 54 E 4.0513 8.1906 117.5697 58.9718 29.6996 178.6675 55 A 4.2199 7.5365 119.3648 52.9631 18.9456 177.2640 56 C 3.9621 7.2977 119.1587 59.0108 31.8132 172.7449 57 P 4.2920 0.0000 0.0000 65.0159 31.0816 177.5049 58 V 4.2818 7.4768 108.3282 60.1339 32.6348 175.4835 59 S 3.6081 7.6948 113.6309 59.7179 60.6879 172.8673 60 A 4.3626 7.6919 120.2553 52.9227 20.2047 178.0715 61 I 4.9629 7.5771 116.5391 59.7103 39.0976 175.2588 62 T 4.6861 9.0858 116.9987 59.9490 71.7033 173.1905 63 I 5.1750 8.5635 124.9341 59.6684 39.9127 173.9744 64 E 4.7482 9.0717 126.2427 53.9714 31.8691 174.6215 65 E 4.1564 9.3671 125.2386 57.1262 29.8844 176.4154 66 A 4.0431 8.3376 129.2432 52.8754 20.0784 175.8184 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 4.32 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 2 W 9.42 5.21 0.00 3.39 3.05 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 3 K 9.45 4.90 0.00 1.91 1.75 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.48 7.81 4 V 8.87 5.02 2.21 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 0.87 0.00 0.00 0.95 0.00 0.00 5 S 9.45 4.88 0.00 3.78 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 8.35 4.76 2.15 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 0.84 0.00 0.00 1.10 0.00 0.00 7 D 9.20 4.49 0.00 2.75 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 8.86 4.05 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 9 D 8.24 4.50 0.00 2.81 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 7.85 4.26 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 1.22 0.00 0.00 11 C 7.59 3.96 0.00 3.02 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.37 4.21 1.85 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 0.97 0.00 0.00 13 G 8.17 3.93 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 0.00 0.00 0.00 14 C 7.99 4.05 0.00 3.09 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 8.19 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 16 I 7.26 3.71 1.80 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.66 0.85 0.00 0.00 17 C 7.86 3.96 0.00 2.16 2.70 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 0.00 0.00 0.00 18 A 7.85 4.34 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 7.87 4.18 0.00 3.88 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 20 L 8.02 4.23 0.00 1.62 1.70 0.87 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 21 C 8.51 5.01 0.00 3.07 3.15 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 22 P 0.00 4.65 0.00 2.23 2.33 0.00 3.54 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 23 D 8.07 4.44 0.00 2.66 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 24 V 7.60 3.99 1.56 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 0.04 0.00 0.00 0.75 0.00 0.00 25 F 8.52 5.56 0.00 3.13 2.89 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 26 E 9.11 4.93 0.00 2.01 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 2.35 2.30 0.00 27 M 8.66 4.89 0.00 1.93 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 2.56 2.49 0.00 28 N 8.99 4.82 0.00 2.91 3.13 0.00 0.00 6.78 7.90 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 29 D 8.52 4.43 0.00 2.67 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 30 E 8.45 4.23 0.00 2.08 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 2.31 2.29 0.00 31 G 8.37 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 7.92 4.50 0.00 1.90 1.69 0.00 1.67 0.00 0.00 1.96 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.39 7.81 33 A 8.25 4.98 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 9.05 4.71 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.94 0.00 0.00 0.00 0.00 0.00 2.45 2.37 0.00 35 P 0.00 4.67 0.00 1.93 2.01 0.00 3.72 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 36 K 9.30 4.16 0.00 1.65 1.81 0.00 1.72 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.54 7.81 37 V 7.38 4.29 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 0.76 0.00 0.00 0.79 0.00 0.00 38 E 8.88 4.16 0.00 2.10 2.21 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 2.36 2.37 0.00 39 V 7.72 4.93 2.11 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 0.92 0.00 0.00 0.96 0.00 0.00 40 I 9.04 4.48 2.18 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.46 1.07 0.00 0.00 41 E 9.19 4.07 0.00 2.03 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 2.32 2.29 0.00 42 D 7.79 5.32 0.00 2.73 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 43 E 8.75 4.09 0.00 2.13 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 0.00 2.48 2.60 0.00 44 E 8.20 3.95 0.00 2.08 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 2.42 2.46 0.00 45 L 7.90 3.96 0.00 1.74 1.68 0.91 0.74 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 46 Y 7.82 3.67 0.00 2.04 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 47 N 8.49 4.17 0.00 2.89 2.81 0.00 0.00 6.73 7.25 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 48 C 8.17 4.16 0.00 2.97 3.23 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 49 A 7.96 4.20 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 50 K 8.05 3.64 0.00 1.56 1.14 0.00 1.09 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.21 1.23 7.81 51 E 7.86 3.80 0.00 1.94 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 0.00 2.26 2.29 0.00 52 A 7.59 3.88 1.24 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 0.00 0.00 0.00 53 M 7.89 3.82 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.54 0.00 54 E 8.19 4.05 0.00 1.91 1.95 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 2.30 2.40 0.00 55 A 7.54 4.22 1.28 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 0.00 0.00 56 C 7.30 3.96 0.00 2.76 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 57 P 0.00 4.29 0.00 2.04 2.08 0.00 3.60 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 1.99 2.07 0.00 58 V 7.48 4.28 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 0.73 0.00 0.00 0.92 0.00 0.00 59 S 7.69 3.61 0.00 3.97 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 60 A 7.69 4.36 1.24 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 0.00 0.00 0.00 61 I 7.58 4.96 1.75 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.46 1.00 0.00 0.00 62 T 9.09 4.69 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 1.24 0.00 0.00 63 I 8.56 5.18 1.92 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.74 0.99 0.00 0.00 64 E 9.07 4.75 0.00 2.11 2.15 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 2.49 2.30 0.00 65 E 9.37 4.16 0.00 2.10 1.93 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 1.97 1.47 0.00 66 A 8.34 4.04 1.26 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 0.00 0.00