NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2831 8.2644 123.5808 51.6420 19.9552 176.2195 2 T 3.7525 8.3214 114.0963 61.9761 67.7519 171.6075 3 L 4.7969 7.8500 126.4320 52.4853 45.8024 176.4112 4 T 4.0830 8.1787 110.5926 61.5548 70.5949 175.1236 5 A 3.9679 8.5330 123.4687 55.4309 18.3221 179.7812 6 E 3.8765 8.0313 117.0561 59.5638 29.8654 178.7554 7 Q 4.1932 7.7828 118.0115 58.9578 28.7119 178.8071 8 S 4.0860 8.4505 114.5571 61.5243 62.4263 176.1322 9 E 4.0264 8.1793 121.1820 59.2431 28.9211 179.0530 10 E 4.0224 8.0857 117.8442 59.5780 29.8813 178.9408 11 L 4.1812 8.2591 120.4271 58.5013 42.1960 178.4794 12 H 4.3285 8.5802 118.0791 58.8635 29.6589 177.3246 13 K 3.9644 8.0238 120.3965 59.7637 31.7653 178.7907 14 Y 3.9162 8.1548 116.5668 60.7288 37.8602 178.5337 15 V 3.6400 7.6737 119.0387 65.8474 31.7484 178.0526 16 I 3.6502 8.2215 119.9620 64.2842 36.8968 177.8056 17 D 4.3893 8.3091 119.1739 57.4294 41.0420 178.5863 18 G 3.6757 8.4261 106.4197 48.1879 0.0000 175.8206 19 T 3.9883 7.9082 117.7146 66.4284 68.3928 177.1572 20 R 3.9725 8.1404 120.1809 59.1249 30.0843 179.1000 21 V 3.5955 8.0248 118.2165 65.9705 31.4322 177.7581 22 F 3.8597 8.4186 120.2658 61.1402 39.2587 176.5245 23 L 4.1238 8.5893 120.5186 58.3055 41.8953 179.1375 24 G 3.6226 8.4508 105.7015 47.9558 0.0000 175.4907 25 L 3.9402 7.8199 121.7029 57.4099 41.5211 179.6278 26 A 3.9601 7.9859 120.7528 54.8126 18.1738 179.7095 27 L 3.9831 8.5311 118.0142 58.0286 41.6701 179.7777 28 V 3.6416 7.7660 117.7543 66.0402 31.3587 177.8565 29 A 4.0371 8.2120 120.4322 55.6221 18.2282 179.3816 30 H 4.1808 8.7845 115.1144 58.8338 28.7167 177.7806 31 F 4.2625 8.7399 122.7165 61.3873 39.2810 177.1059 32 L 3.9794 8.5763 118.6488 57.8865 41.0612 179.4503 33 A 4.1133 8.4819 120.9887 55.0075 18.0838 179.4057 34 F 4.2981 8.7551 118.7113 61.6804 39.5410 177.3057 35 S 3.5296 7.6972 113.2087 60.7006 62.6990 175.6540 36 A 4.4961 8.0563 120.0458 51.3109 19.6574 176.5551 37 T 4.7065 6.8307 113.0487 61.0589 72.4088 173.2836 38 P 4.3375 0.0000 0.0000 63.4425 31.6790 176.5227 39 W 4.4339 7.5334 129.0039 58.8373 30.8757 175.5290 40 L 3.3986 8.9046 123.0114 54.6136 38.8921 174.2291 41 H 4.4089 8.0687 121.7420 56.4387 29.3690 174.4845 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 4.28 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 2 T 8.32 3.75 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 3 L 7.85 4.80 0.00 1.64 1.54 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.18 4.08 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 5 A 8.53 3.97 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 6 E 8.03 3.88 0.00 2.05 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 2.39 2.41 0.00 7 Q 7.78 4.19 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 8 S 8.45 4.09 0.00 3.92 4.04 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 9 E 8.18 4.03 0.00 2.21 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 2.44 2.50 0.00 10 E 8.09 4.02 0.00 2.18 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 0.00 2.44 2.38 0.00 11 L 8.26 4.18 0.00 1.76 1.85 0.90 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.58 4.33 0.00 3.48 3.34 0.00 5.84 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.02 3.96 0.00 2.03 1.68 0.00 1.92 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.46 7.81 14 Y 8.15 3.92 0.00 3.22 3.06 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 0.00 0.00 0.00 0.00 15 V 7.67 3.64 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 1.05 0.00 0.00 1.01 0.00 0.00 16 I 8.22 3.65 1.93 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.69 0.88 0.00 0.00 17 D 8.31 4.39 0.00 2.91 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 18 G 8.43 3.68 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 0.00 0.00 0.00 19 T 7.91 3.99 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 1.21 0.00 0.00 20 R 8.14 3.97 0.00 2.05 1.98 0.00 3.23 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 21 V 8.02 3.60 2.30 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 1.02 0.00 0.00 1.03 0.00 0.00 22 F 8.42 3.86 0.00 3.35 3.25 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 23 L 8.59 4.12 0.00 1.85 1.87 0.96 1.10 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 24 G 8.45 3.62 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 0.00 0.00 0.00 25 L 7.82 3.94 0.00 1.63 1.56 0.83 0.73 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 26 A 7.99 3.96 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 27 L 8.53 3.98 0.00 1.86 1.77 0.93 0.77 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 28 V 7.77 3.64 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 1.15 0.00 0.00 0.97 0.00 0.00 29 A 8.21 4.04 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.78 4.18 0.00 3.60 3.65 0.00 5.82 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.74 4.26 0.00 3.27 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 32 L 8.58 3.98 0.00 1.97 1.76 0.99 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.48 4.11 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.76 4.30 0.00 2.71 3.24 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 35 S 7.70 3.53 0.00 3.71 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.06 4.50 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 37 T 6.83 4.71 4.68 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 1.47 0.00 0.00 38 P 0.00 4.34 0.00 2.20 2.09 0.00 3.65 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 2.12 2.07 0.00 39 W 7.53 4.43 0.00 3.35 3.26 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 40 L 8.90 3.40 0.00 1.50 1.53 -0.43 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 41 H 8.07 4.41 0.00 3.26 3.25 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00