NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9544 8.3393 109.7375 45.2014 0.0000 174.1184 2 E 4.0209 8.2407 117.3661 53.7097 30.5798 174.2102 3 I 4.5477 8.0437 114.6854 58.9879 40.7415 177.0470 4 K 4.3460 8.1688 122.6537 53.3219 32.2196 173.7565 5 G 4.0798 7.7341 109.0498 46.2490 0.0000 171.4600 6 R 4.3457 8.4607 127.6516 53.9452 28.8013 175.6941 7 K 4.7030 7.5874 120.3098 54.8801 35.8713 175.2497 8 T 4.5185 7.9366 117.8231 62.5442 72.9431 173.1935 9 L 4.6154 8.1339 126.5102 53.8633 44.1274 174.6769 10 A 4.7574 8.0917 126.1431 51.2574 21.8455 175.5095 11 T 3.9973 8.0251 109.5014 61.1659 68.8388 173.6213 12 P 4.2866 0.0000 0.0000 64.8956 31.7811 178.1296 13 A 3.8495 7.8701 120.9375 54.4433 18.4738 179.3337 14 V 3.5878 7.5905 117.2343 65.7020 31.3078 178.1768 15 R 3.9267 7.8752 117.8575 59.3705 30.4317 178.0834 16 R 4.0255 7.5808 115.5957 59.1143 29.1590 178.1241 17 L 3.8572 7.6660 120.7996 58.3268 41.9870 178.8749 18 A 4.2840 7.6958 121.5391 54.7862 18.1969 179.2713 19 M 4.0004 8.0482 116.7447 58.7089 32.0560 178.2535 20 E 4.0349 8.3648 118.5167 58.4117 29.8641 177.3174 21 N 4.7809 8.0149 114.5595 51.7718 38.1581 174.1914 22 N 4.3236 8.0641 113.7492 54.6243 36.2211 174.6560 23 I 4.6829 8.1583 116.8836 59.3886 41.7705 177.2159 24 K 4.3318 8.5671 124.0405 56.3291 32.6842 175.6969 25 L 4.5133 8.2548 116.4363 56.0657 43.8916 178.8018 26 S 3.8551 7.9351 111.9734 60.4656 62.6450 174.6035 27 E 4.0381 7.9390 119.9955 58.2250 29.7658 177.0706 28 V 2.0000 6.4499 117.7156 61.6165 31.9777 175.7459 29 V 3.6810 8.1024 125.1377 61.7352 31.6432 175.8395 30 G 3.8880 7.5897 112.1262 45.9604 0.0000 171.6338 31 S 4.4931 8.0229 110.9890 56.9104 64.0438 174.7530 32 G 4.1657 8.1163 106.5368 46.5769 0.0000 174.7259 33 K 4.1792 6.9532 118.2248 56.9948 33.2380 177.1749 34 D 4.7295 7.3219 118.8787 52.0487 39.2933 176.0376 35 G 4.1715 8.1562 103.5114 46.7397 0.0000 172.7858 36 R 3.9472 8.1911 121.2656 59.2806 29.8785 177.4303 37 I 4.0556 7.5208 118.9788 61.2401 35.1482 174.8767 38 L 4.6766 7.8667 125.7985 52.2203 44.6941 177.2151 39 K 3.8606 8.6273 119.1391 60.1026 31.3514 178.2712 40 E 4.1761 8.1969 117.2754 59.4403 29.3984 178.7143 41 D 4.4954 8.2442 119.8322 56.8181 41.0575 178.8514 42 I 3.7112 7.5968 119.8443 64.4390 37.3558 177.9357 43 L 4.0777 8.4562 121.4727 58.3501 41.8398 178.5173 44 N 4.5035 7.9863 115.5494 56.1413 38.6249 176.4827 45 Y 3.9265 7.7039 120.5129 60.7197 39.1634 176.9439 46 L 4.1116 8.4023 118.7862 57.9853 41.7404 179.2020 47 E 4.2764 7.5947 116.1671 57.5777 29.7218 177.2047 48 K 3.8574 7.3374 120.6811 56.2158 32.2301 176.2803 49 Q 4.0995 8.4813 126.6325 55.5459 28.9258 176.9395 50 T 4.2345 7.8759 122.7072 59.5873 65.9772 174.9173 51 L 4.2888 6.9501 123.3696 54.7988 44.2543 174.6189 52 E 4.4704 8.5336 123.6485 57.0986 28.8362 175.6815 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 8.34 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 2 E 8.24 4.02 0.00 2.17 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 2.28 2.36 0.00 3 I 8.04 4.55 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 1.48 0.73 0.92 0.00 0.00 4 K 8.17 4.35 0.00 1.82 1.82 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.28 1.33 7.81 5 G 7.73 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 6 R 8.46 4.35 0.00 1.78 1.89 0.00 3.20 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 7 K 7.59 4.70 0.00 1.62 1.60 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.47 7.81 8 T 7.94 4.52 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 1.18 0.00 0.00 9 L 8.13 4.62 0.00 1.67 1.50 0.93 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.09 4.76 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 11 T 8.03 4.00 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 12 P 0.00 4.29 0.00 2.23 2.34 0.00 3.68 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 13 A 7.87 3.85 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 14 V 7.59 3.59 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 0.92 0.00 0.00 0.93 0.00 0.00 15 R 7.88 3.93 0.00 1.83 1.93 0.00 3.29 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 16 R 7.58 4.03 0.00 1.99 2.18 0.00 3.01 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 17 L 7.67 3.86 0.00 2.00 1.89 0.98 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 18 A 7.70 4.28 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 19 M 8.05 4.00 0.00 2.17 2.05 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 2.60 2.73 0.00 20 E 8.36 4.03 0.00 2.06 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 2.35 2.49 0.00 21 N 8.01 4.78 0.00 2.94 3.01 0.00 0.00 6.29 6.98 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 22 N 8.06 4.32 0.00 2.91 2.92 0.00 0.00 6.65 6.90 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 23 I 8.16 4.68 2.22 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.77 1.12 0.00 0.00 24 K 8.57 4.33 0.00 1.72 1.78 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.48 7.81 25 L 8.25 4.51 0.00 1.59 1.60 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 26 S 7.94 3.86 0.00 3.80 3.85 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 0.00 0.00 0.00 27 E 7.94 4.04 0.00 1.96 1.91 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 2.44 2.35 0.00 28 V 6.45 2.00 1.89 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 0.53 0.00 0.00 0.56 0.00 0.00 29 V 8.10 3.68 2.23 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 1.02 0.00 0.00 1.02 0.00 0.00 30 G 7.59 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 0.00 0.00 0.00 31 S 8.02 4.49 0.00 3.82 3.80 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 32 G 8.12 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 0.00 0.00 0.00 0.00 33 K 6.95 4.18 0.00 1.89 1.75 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.60 1.51 7.81 34 D 7.32 4.73 0.00 2.71 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.16 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 0.00 0.00 0.00 0.00 36 R 8.19 3.95 0.00 1.75 2.09 0.00 3.29 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 37 I 7.52 4.06 1.96 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 1.37 0.62 0.85 0.00 0.00 38 L 7.87 4.68 0.00 1.68 1.59 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.63 3.86 0.00 1.82 1.82 0.00 1.73 0.00 0.00 1.87 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.52 7.81 40 E 8.20 4.18 0.00 2.24 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 2.37 2.41 0.00 41 D 8.24 4.50 0.00 2.96 2.85 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 0.00 0.00 0.00 42 I 7.60 3.71 1.89 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 1.71 0.83 0.94 0.00 0.00 43 L 8.46 4.08 0.00 1.87 1.69 0.93 0.59 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 44 N 7.99 4.50 0.00 2.91 2.94 0.00 0.00 6.83 7.45 0.00 0.00 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 Y 7.70 3.93 0.00 3.18 3.12 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 L 8.40 4.11 0.00 1.72 1.77 1.15 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.59 4.28 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 2.33 2.45 0.00 48 K 7.34 3.86 0.00 1.76 1.71 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.34 7.81 49 Q 8.48 4.10 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.18 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 50 T 7.88 4.23 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 1.07 0.00 0.00 51 L 6.95 4.29 0.00 1.56 1.48 0.91 0.97 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 E 8.53 4.47 0.00 2.02 1.81 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 2.07 2.24 0.00