NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2870 8.2649 123.5800 52.1996 19.7445 176.8435 2 V 3.8169 8.2880 115.3152 61.8679 32.2049 175.2138 3 C 5.1764 7.5153 116.6299 53.8739 39.9738 171.5275 4 P 4.5808 0.0000 0.0000 62.4857 31.7415 176.0111 5 T 4.3745 8.0640 109.3023 62.1280 70.4240 175.3615 6 G 4.0221 8.3031 107.6654 44.3121 0.0000 175.0965 7 L 3.7984 8.7378 122.6630 57.6501 42.5997 177.5938 8 F 5.0160 7.7937 116.9089 56.5802 37.6797 175.6860 9 S 5.3860 7.6737 111.9159 57.4873 64.7887 175.2660 10 N 5.0657 8.0868 119.5593 50.7801 40.8460 172.1106 11 P 5.0052 0.0000 0.0000 62.8192 32.1425 175.7282 12 L 5.0827 9.5186 123.0908 53.2853 47.0484 174.8141 13 C 5.3024 9.3900 118.9360 55.9458 37.8590 172.3442 14 C 5.5391 8.9049 121.8159 54.8794 42.4662 175.2502 15 A 4.1099 8.7037 125.4604 54.9152 18.6033 177.8706 16 T 4.6734 7.9601 104.0037 59.9817 73.1262 172.8057 17 N 5.1331 8.6433 120.7545 52.0331 41.6257 172.9292 18 V 4.1232 8.8630 128.0833 62.0338 33.0253 176.1212 19 L 3.6333 9.0855 125.9252 55.2228 39.0290 174.0226 20 D 4.8078 8.2921 114.1807 54.2842 38.4930 174.2562 21 L 4.8931 8.1672 118.5800 54.1899 45.1388 176.4674 22 I 5.0018 7.7208 119.0751 59.3316 41.2926 174.5122 23 G 4.3317 9.1763 114.5398 44.9903 0.0000 172.6354 24 V 4.7098 8.1418 123.3974 61.5867 34.6468 174.1702 25 D 4.5219 8.6909 126.6511 55.3438 38.2630 171.2126 26 C 5.3353 8.7891 117.6554 55.2863 40.9648 173.9998 27 K 5.1039 9.0321 123.7969 54.4941 34.6513 176.0025 28 T 4.4294 8.4409 113.8019 60.7617 69.6753 172.6942 29 P 4.4906 0.0000 0.0000 63.4962 31.8517 176.4452 30 T 4.4078 8.6258 110.7067 61.5388 69.4425 174.1378 31 I 4.5730 7.0288 114.2416 58.4159 40.7336 174.9086 32 A 4.0122 8.3967 123.7728 52.4287 18.7269 177.5140 33 V 4.3055 8.0816 114.1032 59.8992 33.1983 175.5474 34 D 4.6896 8.6995 124.8574 55.3719 42.1449 177.0514 35 T 4.8718 7.4651 108.0262 58.7704 73.1806 174.7377 36 G 3.7490 8.7539 108.0609 48.0782 0.0000 175.7497 37 A 4.0347 8.0047 122.6281 55.0214 18.3993 179.6804 38 I 3.7338 7.9014 118.3636 64.3065 37.1826 178.3403 39 F 4.4839 8.5046 121.6410 61.5913 39.2321 177.1376 40 Q 3.7896 8.4455 117.5656 59.0278 28.5701 178.8685 41 A 4.0064 8.1368 121.6978 55.2014 18.4923 179.2153 42 H 4.1136 8.6675 117.1512 59.7757 30.0373 176.9604 43 C 4.3804 8.4152 118.1205 59.9320 41.0891 175.9479 44 A 3.8639 8.1818 122.6918 55.0696 17.7164 179.7414 45 S 4.2005 8.0448 111.6976 60.4558 63.0019 175.7926 46 K 4.5348 7.1916 119.6751 55.2439 32.4335 176.1468 47 G 3.9626 8.0321 106.0146 46.6977 0.0000 173.7674 48 S 4.8818 8.0884 113.7952 56.4295 67.4664 173.3682 49 K 4.6123 8.9350 120.2606 54.0089 34.8273 174.4802 50 P 4.4089 0.0000 0.0000 62.3627 32.1136 174.9703 51 L 5.2575 8.9578 124.5311 52.8830 46.0349 175.0896 52 C 5.4535 9.4643 119.3168 55.8559 36.6219 172.5653 53 C 5.8060 9.2534 121.1399 54.9967 43.7933 175.4760 54 V 4.2363 8.8033 112.2840 62.6053 31.4071 176.6115 55 A 4.7027 7.7715 121.9481 50.0146 22.0403 173.8714 56 P 4.6568 0.0000 0.0000 62.7135 32.0609 175.9030 57 V 4.3101 7.3314 111.7453 59.2437 33.8791 175.1341 58 A 4.3715 8.2362 123.1811 52.9506 18.7912 176.3688 59 D 4.5045 8.6849 119.2166 53.3677 45.1131 176.1448 60 Q 4.0850 8.8606 123.8065 58.9221 30.0602 175.8092 61 A 5.2242 7.6379 117.5911 50.8812 22.2162 175.3693 62 L 4.8194 8.9848 121.0574 52.6074 47.0798 175.5360 63 L 4.6705 8.5622 124.2117 55.7031 43.0518 176.4344 64 C 5.6768 9.2154 122.5853 55.8486 40.8011 173.1953 65 Q 4.6900 8.8254 119.2179 53.3506 32.0862 175.5727 66 K 4.3181 8.5354 121.1021 56.6647 33.2946 176.5230 67 A 4.3173 8.5455 124.6643 52.0127 19.4630 177.3795 68 I 3.5677 8.4093 114.4519 62.3435 38.0740 176.3873 69 G 3.9104 8.9048 110.2673 46.1157 0.0000 173.6645 70 T 4.1317 7.4839 115.0494 61.4412 68.7625 173.8206 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 8.26 4.29 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 2 V 8.29 3.82 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.37 0.00 0.00 3 C 7.52 5.18 0.00 3.02 3.20 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 0.00 0.00 0.00 0.00 4 P 0.00 4.58 0.00 2.28 2.24 0.00 3.91 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.03 0.00 5 T 8.06 4.37 4.25 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 1.22 0.00 0.00 6 G 8.30 4.02 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 0.00 0.00 0.00 7 L 8.74 3.80 0.00 1.49 1.26 0.64 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 8 F 7.79 5.02 0.00 3.10 3.11 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 9 S 7.67 5.39 0.00 3.86 4.10 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 10 N 8.09 5.07 0.00 2.87 2.76 0.00 0.00 6.72 9.12 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 11 P 0.00 5.01 0.00 1.45 1.30 0.00 3.64 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.71 0.00 12 L 9.52 5.08 0.00 1.64 1.61 1.07 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 13 C 9.39 5.30 0.00 2.88 3.03 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 14 C 8.90 5.54 0.00 2.84 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 8.70 4.11 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 16 T 7.96 4.67 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 1.21 0.00 0.00 17 N 8.64 5.13 0.00 2.72 2.67 0.00 0.00 6.49 7.71 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 18 V 8.86 4.12 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 0.90 0.00 0.00 0.93 0.00 0.00 19 L 9.09 3.63 0.00 1.84 1.75 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.29 4.81 0.00 2.78 2.68 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 0.00 0.00 0.00 0.00 21 L 8.17 4.89 0.00 1.55 1.64 0.96 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.72 5.00 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.78 0.96 0.00 0.00 23 G 9.18 4.33 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 0.00 24 V 8.14 4.71 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 1.01 0.00 0.00 0.94 0.00 0.00 25 D 8.69 4.52 0.00 2.88 2.67 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 0.00 0.00 0.00 0.00 26 C 8.79 5.34 0.00 3.01 3.03 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 27 K 9.03 5.10 0.00 1.75 1.71 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.37 7.81 28 T 8.44 4.43 4.26 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 1.28 0.00 0.00 29 P 0.00 4.49 0.00 2.14 2.05 0.00 3.67 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.20 0.00 30 T 8.63 4.41 4.28 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 1.26 0.00 0.00 31 I 7.03 4.57 1.81 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 0.89 0.54 0.89 0.00 0.00 32 A 8.40 4.01 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 33 V 8.08 4.31 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 0.75 0.00 0.00 0.57 0.00 0.00 34 D 8.70 4.69 0.00 2.65 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 35 T 7.47 4.87 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 1.22 0.00 0.00 36 G 8.75 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 37 A 8.00 4.03 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 I 7.90 3.73 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.73 0.95 0.00 0.00 39 F 8.50 4.48 0.00 3.10 3.18 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 40 Q 8.45 3.79 0.00 2.25 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.41 0.00 41 A 8.14 4.01 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 H 8.67 4.11 0.00 3.39 3.62 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 C 8.42 4.38 0.00 2.89 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 44 A 8.18 3.86 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 45 S 8.04 4.20 0.00 4.04 4.12 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 0.00 0.00 0.00 46 K 7.19 4.53 0.00 1.86 1.82 0.00 1.84 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.50 7.81 47 G 8.03 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.09 4.88 0.00 3.82 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.94 4.61 0.00 1.54 1.60 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.45 7.81 50 P 0.00 4.41 0.00 0.53 1.09 0.00 3.44 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 51 L 8.96 5.26 0.00 1.63 1.59 0.92 0.54 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 52 C 9.46 5.45 0.00 2.89 3.39 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 53 C 9.25 5.81 0.00 2.88 3.04 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 54 V 8.80 4.24 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 0.79 0.00 0.00 0.97 0.00 0.00 55 A 7.77 4.70 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 56 P 0.00 4.66 0.00 2.18 2.36 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.96 0.00 57 V 7.33 4.31 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 0.73 0.00 0.00 0.94 0.00 0.00 58 A 8.24 4.37 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 59 D 8.68 4.50 0.00 2.74 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.86 4.08 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 61 A 7.64 5.22 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 62 L 8.98 4.82 0.00 1.60 1.56 0.96 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.56 4.67 0.00 1.86 1.67 1.09 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 64 C 9.22 5.68 0.00 2.85 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.83 4.69 0.00 1.56 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.97 0.00 0.00 0.00 0.00 0.00 1.55 1.16 0.00 66 K 8.54 4.32 0.00 1.69 1.75 0.00 1.55 0.00 0.00 1.67 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.40 7.81 67 A 8.55 4.32 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 68 I 8.41 3.57 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.67 0.93 0.00 0.00 69 G 8.90 3.91 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 0.00 0.00 0.00 70 T 7.48 4.13 4.17 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 1.19 0.00 0.00