NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3248 8.2649 123.5799 51.8339 20.5225 177.2778 2 V 3.9016 7.8792 110.7073 63.2442 32.4431 175.3762 3 C 4.9992 7.5516 115.6182 54.1725 38.8887 171.6965 4 P 4.5735 0.0000 0.0000 62.2991 31.8616 175.8288 5 T 4.4283 8.0658 109.4190 62.0553 70.3874 175.6452 6 G 3.9455 8.3984 107.7729 44.8897 0.0000 174.6713 7 L 3.8461 8.6214 121.1702 58.0274 42.6069 178.2807 8 F 5.1393 7.7395 116.7007 56.5595 37.7902 176.1225 9 S 5.1818 7.7148 112.4772 57.9332 64.5287 174.0259 10 N 5.0635 7.9966 120.1301 50.7062 40.6169 172.1905 11 P 5.0017 0.0000 0.0000 62.7451 32.2410 175.6857 12 L 5.0554 9.5187 122.9246 53.2192 46.8205 174.5306 13 C 5.3759 9.2583 118.5979 55.7522 41.7722 172.6369 14 C 5.7725 9.3972 121.0249 53.9763 43.2872 175.2271 15 A 4.0921 8.6751 123.8186 55.0706 18.5402 178.2375 16 T 4.6080 7.6977 103.4243 60.2926 72.6594 172.6742 17 N 5.0549 8.6868 122.3845 52.2160 40.3837 173.9812 18 V 3.9868 9.0120 128.1987 61.7816 33.0458 175.9276 19 L 3.7586 9.2249 127.9678 56.0397 39.1108 174.3077 20 D 4.4950 8.4792 113.2835 55.3195 38.7815 174.1761 21 L 4.6817 8.3789 118.1746 55.8780 45.3329 176.5488 22 I 4.8739 7.6866 119.2190 59.2233 40.3980 174.8809 23 G 4.0767 9.1691 115.6840 45.7772 0.0000 172.4047 24 V 4.5309 8.7993 126.0037 61.9347 33.4667 174.5093 25 D 4.9504 8.4326 126.2914 54.2982 39.6464 171.0380 26 C 5.1095 8.7243 118.9474 55.6336 42.1467 174.0599 27 K 5.1975 9.1026 121.6916 54.4908 36.3428 175.9064 28 T 4.4427 8.4877 112.3880 60.8957 69.6709 172.6341 29 P 4.6214 0.0000 0.0000 63.2437 32.0419 176.2555 30 T 4.4913 8.8191 111.7067 61.2475 69.2100 173.9713 31 I 4.6071 7.0640 113.7411 58.7115 40.8031 174.6513 32 A 3.9514 8.4118 124.2437 52.2017 18.7019 177.6390 33 V 4.2544 7.9616 115.8041 59.6800 32.6714 175.6653 34 D 4.5072 8.6674 126.1512 56.4301 41.3465 177.1572 35 T 4.8865 7.5361 107.9663 58.7658 73.3120 174.8224 36 G 3.8139 8.9316 108.9296 47.4506 0.0000 175.7785 37 A 4.0403 7.9995 122.6344 54.8474 18.3820 179.6112 38 I 3.6721 7.6276 118.4015 64.4475 37.2099 178.3246 39 F 4.4287 8.4496 121.5057 61.4618 39.1537 176.6652 40 Q 3.7626 8.4357 119.2203 59.3218 28.8072 178.3476 41 A 3.9852 8.2085 121.6669 55.3362 18.2627 179.1306 42 H 4.1097 8.6129 116.8918 59.7277 30.0457 176.8817 43 C 4.2187 8.4376 118.1344 60.0504 38.8746 176.0266 44 A 3.9534 8.3673 122.8722 54.9890 17.7160 179.4360 45 S 4.2701 7.8871 111.2689 60.1883 63.3119 175.6139 46 K 4.4132 7.3144 120.3909 55.6775 32.3060 176.7665 47 G 3.8549 8.2242 107.4755 45.8183 0.0000 172.9775 48 S 4.8590 8.0058 114.6003 56.6539 67.5255 173.1884 49 K 4.6931 8.8593 119.1269 54.0747 35.6854 174.3036 50 P 4.4975 0.0000 0.0000 62.3619 32.0070 175.4259 51 L 4.8438 8.9560 122.7915 53.1735 46.8073 174.4694 52 C 5.3871 9.1269 119.3075 55.8742 36.5290 172.5484 53 C 5.7531 9.3857 120.7353 55.0895 44.2041 175.2598 54 V 4.1113 9.0139 112.0869 62.6015 31.4414 176.8277 55 A 4.7768 7.8465 122.0083 49.9571 22.0632 173.4259 56 P 4.9300 0.0000 0.0000 62.8493 32.1543 175.7685 57 V 4.5122 7.4734 109.7243 59.9646 35.5696 175.3789 58 A 4.4048 8.3546 123.2045 52.8381 19.0273 176.5828 59 D 4.6090 8.6941 118.7006 53.3254 44.6280 176.4831 60 Q 4.0827 8.9638 123.6572 58.6834 30.1954 175.4858 61 A 4.7747 8.4796 120.1650 51.2823 20.8825 175.2117 62 L 4.7850 8.8107 123.5885 53.5600 45.6886 175.2796 63 L 4.7079 8.4449 126.7775 55.6180 43.1270 176.3807 64 C 5.4018 9.1749 122.7612 55.8312 44.1477 172.9105 65 Q 4.3500 8.5300 120.5082 53.6065 32.2465 174.1146 66 K 4.1498 8.6550 124.2355 57.3736 33.0265 176.1531 67 A 4.3518 8.4483 125.8830 51.5453 19.2153 177.4392 68 I 3.7839 8.6277 116.3763 61.6918 38.6137 175.9836 69 G 4.3064 8.5168 109.2819 47.1393 0.0000 173.4619 70 T 4.1480 7.2079 110.7870 61.3604 68.8186 174.0760 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 4.32 1.30 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 0.00 0.00 0.00 2 V 7.88 3.90 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 0.63 0.00 0.00 0.62 0.00 0.00 3 C 7.55 5.00 0.00 3.04 3.27 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 0.00 4 P 0.00 4.57 0.00 2.28 2.25 0.00 3.94 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 2.33 2.06 0.00 5 T 8.07 4.43 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 8.40 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 7 L 8.62 3.85 0.00 1.46 1.15 0.71 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 8 F 7.74 5.14 0.00 3.13 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 9 S 7.71 5.18 0.00 3.98 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 10 N 8.00 5.06 0.00 2.82 2.78 0.00 0.00 6.66 9.20 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 11 P 0.00 5.00 0.00 1.30 1.31 0.00 3.63 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 1.79 1.71 0.00 12 L 9.52 5.06 0.00 1.64 1.71 1.04 0.90 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 13 C 9.26 5.38 0.00 2.89 3.01 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 0.00 0.00 0.00 14 C 9.40 5.77 0.00 2.78 3.10 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 15 A 8.68 4.09 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 16 T 7.70 4.61 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 1.20 0.00 0.00 17 N 8.69 5.05 0.00 2.69 2.73 0.00 0.00 6.95 7.65 0.00 0.00 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 9.01 3.99 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.93 0.00 0.00 19 L 9.22 3.76 0.00 1.82 1.72 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.48 4.49 0.00 2.80 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 21 L 8.38 4.68 0.00 1.68 1.65 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.69 4.87 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.01 0.96 0.00 0.00 23 G 9.17 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 24 V 8.80 4.53 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 1.00 0.00 0.00 0.93 0.00 0.00 25 D 8.43 4.95 0.00 2.99 2.60 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 26 C 8.72 5.11 0.00 3.04 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 27 K 9.10 5.20 0.00 1.64 1.66 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.37 7.81 28 T 8.49 4.44 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 1.23 0.00 0.00 29 P 0.00 4.62 0.00 2.05 2.11 0.00 3.66 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.26 0.00 30 T 8.82 4.49 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 1.25 0.00 0.00 31 I 7.06 4.61 1.80 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 0.82 0.54 0.89 0.00 0.00 32 A 8.41 3.95 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 33 V 7.96 4.25 2.03 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 0.89 0.00 0.00 0.40 0.00 0.00 34 D 8.67 4.51 0.00 2.66 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 35 T 7.54 4.89 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 8.93 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 37 A 8.00 4.04 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 38 I 7.63 3.67 2.06 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 1.43 0.68 0.94 0.00 0.00 39 F 8.45 4.43 0.00 3.09 3.21 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 0.00 0.00 0.00 40 Q 8.44 3.76 0.00 2.09 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.52 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 41 A 8.21 3.99 1.38 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 0.00 0.00 0.00 42 H 8.61 4.11 0.00 3.38 3.60 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 8.44 4.22 0.00 2.91 3.13 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 0.00 44 A 8.37 3.95 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 4.27 0.00 4.05 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 7.31 4.41 0.00 1.92 1.85 0.00 1.72 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.49 7.81 47 G 8.22 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 0.00 0.00 0.00 48 S 8.01 4.86 0.00 3.81 3.94 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 49 K 8.86 4.69 0.00 1.66 1.55 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.27 1.29 7.81 50 P 0.00 4.50 0.00 0.49 0.70 0.00 3.50 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 51 L 8.96 4.84 0.00 1.57 1.49 0.89 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 52 C 9.13 5.39 0.00 2.84 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 53 C 9.39 5.75 0.00 2.88 3.13 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 0.00 54 V 9.01 4.11 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 1.02 0.00 0.00 1.02 0.00 0.00 55 A 7.85 4.78 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 56 P 0.00 4.93 0.00 2.18 2.34 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.97 0.00 57 V 7.47 4.51 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 0.75 0.00 0.00 0.94 0.00 0.00 58 A 8.35 4.40 1.27 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 0.00 0.00 0.00 59 D 8.69 4.61 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 8.96 4.08 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.57 0.00 0.00 0.00 0.00 0.00 2.46 2.32 0.00 61 A 8.48 4.77 1.21 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 0.00 0.00 0.00 0.00 0.00 62 L 8.81 4.79 0.00 1.78 1.54 1.05 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.44 4.71 0.00 1.90 1.63 1.18 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 64 C 9.17 5.40 0.00 2.78 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 8.53 4.35 0.00 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 66 K 8.65 4.15 0.00 1.71 1.74 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.35 1.42 7.81 67 A 8.45 4.35 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 68 I 8.63 3.78 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.82 0.92 0.00 0.00 69 G 8.52 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 70 T 7.21 4.15 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 1.26 0.00 0.00