NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.3046 8.2229 123.5824 52.2549 19.4876 178.4786 1 N 4.7580 9.2104 114.4843 50.9533 38.7004 175.4510 2 Q 4.5438 8.6516 124.2374 55.6458 31.2131 174.5684 3 A 4.7450 8.5619 128.0006 51.2569 21.0158 176.0704 4 S 5.1830 8.8181 116.8913 56.2874 67.2217 173.5540 5 V 4.2776 8.5594 122.2429 62.9132 32.3910 175.0240 6 V 4.9214 8.7832 127.4538 60.5396 35.1464 174.3132 7 A 4.4312 9.0206 129.6505 52.5236 18.5922 177.6012 8 N 4.6708 9.2060 122.5246 55.3628 39.6345 174.4028 9 Q 4.6397 7.6426 114.2952 54.7567 32.0111 173.8884 10 L 4.2122 8.4822 122.2703 55.4943 42.9842 175.9382 11 I 4.4707 8.6497 128.0121 58.9606 38.5755 173.7080 12 P 4.6756 0.0000 0.0000 62.1577 32.1880 176.1821 13 I 3.6949 8.3610 121.3823 61.8214 38.7884 174.8245 14 N 4.7780 8.1805 121.8089 53.8252 36.6155 174.4895 15 T 4.7533 7.5266 111.9416 61.2406 72.6360 174.0652 16 A 4.4330 8.6880 128.0036 51.8930 19.1972 177.2523 17 L 4.2595 9.1679 124.1316 55.1107 43.0220 176.5368 18 T 4.9196 8.2834 111.8992 59.5035 72.2643 174.8906 19 L 4.0536 8.5608 121.5672 57.9339 41.8306 180.1414 20 V 3.7689 7.6982 110.4516 63.8846 31.8004 176.8128 21 M 4.2932 8.1328 118.8256 56.4874 32.2401 175.3517 22 M 5.3163 7.8166 118.6706 53.3591 35.2304 174.9762 23 R 4.7453 8.9744 119.4335 54.3381 33.6744 173.8685 24 S 5.2173 8.4604 113.1267 56.5648 64.5260 172.6312 25 E 4.6829 8.9200 126.5024 54.6871 33.5951 174.2252 26 V 4.1781 8.4177 126.2109 62.6310 31.6902 175.3169 27 V 4.6147 8.2642 120.0728 59.7374 35.5485 175.2351 28 T 4.6042 8.0993 116.9601 60.8617 71.4216 172.7378 29 P 4.4418 0.0000 0.0000 62.2852 32.0889 175.9346 30 V 3.8510 8.1920 119.2253 62.7788 32.7208 175.9225 31 G 4.3053 8.4635 115.7718 45.5853 0.0000 173.2474 32 I 3.8819 8.5891 124.6425 60.7136 38.2265 174.3092 33 P 4.6635 0.0000 0.0000 62.9746 31.9131 177.4087 34 A 3.9574 9.1904 126.2372 55.1056 18.0232 179.8334 35 E 4.0683 8.1864 114.7414 59.0505 29.9451 177.9095 36 D 4.7105 8.3042 119.1045 54.4446 40.8107 177.8027 37 I 3.6955 7.5029 122.1966 64.1299 37.2150 175.9134 38 P 4.3837 0.0000 0.0000 66.0195 30.7939 178.3034 39 R 3.9191 7.9495 117.0540 59.1161 30.3307 178.0338 40 L 4.2196 8.0573 118.2898 55.7521 41.5829 177.3727 41 V 3.8275 6.8078 119.2191 64.3568 31.6464 176.2845 42 S 4.0470 9.0258 120.8636 58.6860 62.7009 170.1493 43 M 4.4660 7.9918 121.2903 55.5906 33.5419 175.0367 44 Q 5.2229 8.4106 118.1201 53.5657 32.4117 175.3829 45 V 4.6395 8.2263 115.1695 60.5515 33.3799 176.1436 46 N 5.0270 9.1922 121.0854 53.1056 38.4080 174.4106 47 R 4.7034 7.5867 114.3678 54.6168 32.6296 174.6210 48 A 4.2572 8.6302 122.6610 52.2428 19.4268 177.1639 49 V 4.2065 8.9030 122.5476 60.3109 33.5208 173.4097 50 P 4.5982 0.0000 0.0000 62.2528 32.6297 175.9105 51 L 3.9638 8.4487 123.6635 57.1653 42.2103 177.6652 52 G 3.9712 8.9062 113.9540 45.4049 0.0000 173.4730 53 T 4.2671 7.5060 116.8052 63.2555 69.9657 174.2009 54 T 4.5251 8.3520 122.5398 63.1702 69.5208 174.3579 55 L 4.1198 8.7351 127.5429 55.0036 42.7458 176.4892 56 M 4.7199 8.4538 123.2739 52.7271 34.2867 175.0504 57 P 3.9850 0.0000 0.0000 65.8858 31.5933 178.4565 58 D 4.4862 7.9471 115.3311 55.7102 39.7661 176.9771 59 M 4.3956 8.1153 118.9022 55.6954 32.6233 175.6572 60 V 4.6691 7.2820 119.6461 60.3118 33.1511 174.8853 61 K 4.1932 8.9768 128.3132 57.9611 32.0889 177.6144 62 G 3.9523 9.0102 112.2472 45.3017 0.0000 172.5595 63 Y 4.1048 7.7398 121.2310 57.0147 39.3433 174.6944 64 A 4.2441 7.3769 128.5549 50.2179 22.0858 175.6132 65 A 3.8514 8.2426 124.8284 52.3325 18.5268 177.0873 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 0 A 8.22 4.30 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 1 N 9.21 4.76 0.00 2.84 2.70 0.00 0.00 6.47 6.57 0.00 0.00 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 Q 8.65 4.54 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.72 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 3 A 8.56 4.74 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 4 S 8.82 5.18 0.00 3.72 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 5 V 8.56 4.28 2.02 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 0.86 0.00 0.00 0.91 0.00 0.00 6 V 8.78 4.92 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 1.08 0.00 0.00 0.97 0.00 0.00 7 A 9.02 4.43 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 8 N 9.21 4.67 0.00 2.71 2.91 0.00 0.00 7.06 6.68 0.00 0.00 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 7.64 4.64 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.69 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 10 L 8.48 4.21 0.00 1.67 1.62 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.65 4.47 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 1.27 0.66 0.90 0.00 0.00 12 P 0.00 4.68 0.00 2.07 2.05 0.00 3.77 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 1.98 1.96 0.00 13 I 8.36 3.69 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 1.34 0.81 0.91 0.00 0.00 14 N 8.18 4.78 0.00 2.86 2.86 0.00 0.00 6.74 8.77 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 15 T 7.53 4.75 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 16 A 8.69 4.43 1.23 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 17 L 9.17 4.26 0.00 1.74 1.60 0.99 0.32 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 18 T 8.28 4.92 4.24 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 1.21 0.00 0.00 19 L 8.56 4.05 0.00 1.73 1.76 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.70 3.77 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 0.70 0.00 0.00 0.99 0.00 0.00 21 M 8.13 4.29 0.00 2.09 2.21 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 2.60 2.50 0.00 22 M 7.82 5.32 0.00 1.80 1.92 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 23 R 8.97 4.75 0.00 1.82 2.01 0.00 2.71 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.52 0.00 24 S 8.46 5.22 0.00 3.86 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 25 E 8.92 4.68 0.00 2.04 1.69 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 2.20 2.25 0.00 26 V 8.42 4.18 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 0.83 0.00 0.00 0.93 0.00 0.00 27 V 8.26 4.61 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 0.80 0.00 0.00 0.92 0.00 0.00 28 T 8.10 4.60 4.24 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 1.21 0.00 0.00 29 P 0.00 4.44 0.00 2.17 2.06 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 30 V 8.19 3.85 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 0.80 0.00 0.00 0.93 0.00 0.00 31 G 8.46 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.59 3.88 1.75 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.53 0.72 0.00 0.00 33 P 0.00 4.66 0.00 2.10 2.01 0.00 3.83 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.14 0.00 34 A 9.19 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.19 4.07 0.00 2.15 2.12 0.00 0.00 0.00 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 2.43 0.00 36 D 8.30 4.71 0.00 2.92 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 I 7.50 3.70 1.88 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 1.57 0.60 0.91 0.00 0.00 38 P 0.00 4.38 0.00 2.27 2.32 0.00 3.77 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 2.09 2.04 0.00 39 R 7.95 3.92 0.00 1.86 2.28 0.00 3.49 0.00 0.00 3.46 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 40 L 8.06 4.22 0.00 1.96 1.71 0.85 0.77 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 41 V 6.81 3.83 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 0.78 0.00 0.00 1.02 0.00 0.00 42 S 9.03 4.05 0.00 4.17 4.11 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 43 M 7.99 4.47 0.00 2.05 2.20 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.56 0.00 44 Q 8.41 5.22 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.96 0.00 0.00 0.00 0.00 0.00 2.39 2.20 0.00 45 V 8.23 4.64 2.18 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 0.96 0.00 0.00 0.95 0.00 0.00 46 N 9.19 5.03 0.00 2.82 3.05 0.00 0.00 6.53 7.31 0.00 0.00 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 R 7.59 4.70 0.00 1.78 1.88 0.00 3.03 0.00 0.00 3.22 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 48 A 8.63 4.26 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 49 V 8.90 4.21 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 1.03 0.00 0.00 0.91 0.00 0.00 50 P 0.00 4.60 0.00 2.10 1.96 0.00 3.66 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 51 L 8.45 3.96 0.00 1.57 1.59 0.96 1.09 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 52 G 8.91 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 53 T 7.51 4.27 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 54 T 8.35 4.53 4.22 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 1.24 0.00 0.00 55 L 8.74 4.12 0.00 1.58 1.48 0.88 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 56 M 8.45 4.72 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.61 0.00 57 P 0.00 3.98 0.00 2.24 2.37 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.09 0.00 58 D 7.95 4.49 0.00 2.80 2.82 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 0.00 0.00 0.00 59 M 8.12 4.40 0.00 2.09 2.20 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 2.58 2.41 0.00 60 V 7.28 4.67 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.82 0.00 0.00 61 K 8.98 4.19 0.00 1.82 1.77 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.09 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.40 7.81 62 G 9.01 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 63 Y 7.74 4.10 0.00 2.96 2.98 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 64 A 7.38 4.24 1.04 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 65 A 8.24 3.85 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