NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3823 8.2493 123.5862 52.7248 20.0085 177.1265 3 T 4.2185 7.9258 111.7857 62.1036 70.7950 173.2295 4 L 4.4217 7.5981 124.5213 53.4125 41.5107 176.3186 5 R 4.8516 8.1933 118.3568 53.7496 32.4844 175.7554 6 S 5.0006 8.6665 114.4536 59.3678 63.8362 172.9549 7 F 4.8294 8.4201 114.4440 56.0181 41.5183 173.0853 8 V 3.9264 8.3937 120.5445 62.5307 31.2083 175.5471 9 L 3.9575 8.6300 131.3934 56.7879 42.4597 176.9241 10 V 4.1117 7.3295 118.5102 60.9314 33.1653 173.4989 11 D 4.9603 8.5449 127.6416 53.0301 41.0823 176.0418 12 N 4.6802 9.1144 131.1018 52.3046 38.0515 175.7077 13 G 3.9623 8.8903 109.7962 45.3611 0.0000 174.3569 14 G 4.1107 7.8330 107.0716 45.4948 0.0000 173.2117 15 T 4.0368 7.5179 110.1775 62.9177 68.8855 175.7912 16 G 4.0653 8.2631 109.8695 44.8691 0.0000 173.4815 17 N 4.4540 8.0156 117.9335 53.2360 39.4592 175.3798 18 V 3.9235 8.4763 124.1199 61.8738 32.4844 174.7306 19 T 4.8247 8.1896 124.8358 62.0770 70.6189 174.8233 20 V 4.5578 8.2428 123.2360 60.0522 34.7278 174.9158 21 V 5.0087 8.9533 116.6537 58.6708 35.4229 173.3044 22 P 4.2929 0.0000 0.0000 62.9543 31.1538 176.5961 23 V 4.4741 8.6062 122.0352 63.0928 34.0204 174.9688 24 S 4.5669 7.6573 112.6915 57.1805 66.1771 174.5879 25 N 5.3280 8.2490 116.5358 52.2132 38.9619 174.0916 26 A 4.3604 7.8869 121.4604 52.5951 20.2597 177.5157 27 N 4.0834 9.6384 117.1638 54.3488 36.2904 175.0822 28 G 3.7963 8.4402 102.1618 46.1887 0.0000 174.1450 29 V 4.5106 7.5965 120.1866 60.6095 33.4881 174.6742 30 A 4.5701 8.8621 131.0869 51.6245 20.0428 175.7800 31 E 5.1810 8.4842 121.6325 54.6174 32.9496 174.6535 32 W 5.3744 10.0872 127.3295 55.7514 32.2432 175.3077 33 L 5.3638 9.2531 120.9606 53.2969 45.9807 176.5236 34 S 4.6815 8.7054 117.7235 57.8893 64.6920 174.6384 35 N 4.6310 8.4997 119.3464 52.0672 36.9714 172.9129 36 N 4.9559 7.6790 119.2694 51.1670 43.4330 174.3925 37 S 4.3655 8.3374 113.6486 58.0645 63.7439 175.4564 38 R 4.0160 8.6796 121.4343 59.4964 29.8890 178.3695 39 S 4.3183 7.9964 110.7760 60.5649 63.1334 174.6729 40 Q 4.3905 8.5083 119.2040 55.4858 30.2337 174.3647 41 A 4.6572 7.8446 118.9294 50.8850 20.6530 177.7833 42 Y 4.1420 9.3350 118.7533 58.1431 39.3282 175.2066 43 R 5.2479 8.9017 122.4706 54.8233 34.3709 173.8794 44 V 5.2032 8.9531 124.3452 61.5459 35.3543 174.1445 45 T 5.6258 9.2236 115.9323 60.4524 72.6304 172.4493 46 A 5.9400 9.4861 123.3583 51.1045 23.2946 175.2758 47 S 5.0621 8.6801 112.9826 57.2697 66.8201 172.4281 48 Y 5.1262 8.6169 122.3179 56.2050 40.9513 174.3779 49 R 4.6172 8.4523 124.3148 54.0930 35.2039 174.5192 50 A 4.3700 8.2301 121.8380 51.8352 19.4996 177.1592 51 S 4.2234 8.4197 114.4461 57.7290 65.7731 175.5001 52 G 3.9168 8.8040 117.0469 45.0773 0.0000 172.5032 53 A 4.5686 8.3867 120.9167 52.2429 19.4973 177.7623 54 D 4.6901 7.5405 115.5769 53.0243 40.8181 174.7687 55 K 5.1131 8.0775 116.8227 56.1452 37.3972 175.1315 56 R 4.9293 8.9004 119.0925 54.5652 35.1487 174.6130 57 K 5.0944 8.8464 121.7573 55.3885 35.7153 174.5147 58 Y 5.2040 9.3698 125.6357 57.1462 40.5144 174.9509 59 T 5.1583 9.2146 119.2519 62.1068 72.4584 172.9310 60 I 5.2515 9.0106 127.4928 59.4056 40.9186 174.9694 61 K 5.1450 9.3514 125.0026 54.5490 36.3753 174.9663 62 L 5.2001 9.1435 125.6545 53.2803 45.7524 174.8998 63 E 4.7446 9.2311 124.6938 54.5797 32.9248 175.0024 64 V 4.1670 8.4409 126.2361 60.3782 33.3056 173.2515 65 P 4.5927 0.0000 0.0000 61.8972 33.3242 175.9530 66 K 3.6895 7.6639 122.6859 54.3234 32.5719 174.6866 67 I 4.0555 7.7337 127.8063 61.2476 37.5275 175.7595 68 V 4.4711 8.5722 119.6322 60.2069 36.9366 174.5275 69 T 4.7844 8.2640 118.4500 61.9478 69.6662 174.4315 70 Q 4.2686 8.7694 128.6382 55.9530 30.8175 175.4754 71 V 4.6740 8.1758 116.2466 59.9229 35.2573 175.5476 72 V 4.0748 8.5085 126.9144 61.6597 31.9500 175.0290 73 N 4.5065 9.1589 127.2185 54.4418 35.0771 176.3074 74 G 3.8959 8.2839 104.7774 45.8851 0.0000 174.8647 75 V 4.0479 7.1431 120.6397 61.7927 30.9993 173.0777 76 E 4.7281 8.4481 123.3163 55.5935 30.5517 176.0787 77 L 4.8721 8.7914 125.3403 52.0456 44.7654 173.8578 78 P 4.9007 0.0000 0.0000 62.4373 32.6051 175.4435 79 V 4.5824 8.6828 117.6262 60.0555 36.6057 173.3082 80 S 4.9657 8.3630 114.5788 56.7775 64.5537 174.1172 81 A 4.2193 8.5385 126.6035 54.6709 18.9003 176.9355 82 W 4.5102 6.6523 109.7904 56.3129 30.9388 173.5049 83 K 5.2410 9.1770 118.1063 54.6808 35.6959 175.7258 84 A 5.0189 8.8932 124.0282 50.5284 21.8721 175.2321 85 Y 5.2121 8.8399 117.3703 56.1154 41.3992 174.9538 86 A 4.9421 9.0352 124.3841 50.2617 22.6522 175.0163 87 S 5.0167 8.6324 114.7474 56.8302 65.7075 173.1410 88 I 4.7412 9.3843 127.4290 59.6033 40.8069 173.8955 89 D 5.3810 8.9362 126.1484 52.3851 43.3207 175.0932 90 L 4.8258 9.2531 126.0432 53.5276 44.8480 174.9420 91 T 5.2138 8.7354 122.5654 61.8850 71.1956 173.5922 92 I 4.8352 8.8087 126.9091 58.5643 41.3019 173.5098 93 P 4.9721 0.0000 0.0000 62.7499 32.2327 177.1501 94 I 3.8731 7.7733 114.2233 62.9687 37.4049 177.1134 95 F 4.2705 7.7760 120.5597 59.2413 39.2439 175.3205 96 A 4.0749 7.7353 123.4015 52.5932 18.3420 177.8066 97 A 4.5006 9.9249 126.5627 51.1593 21.2307 177.8192 98 T 3.8260 8.4389 111.3290 65.6862 68.3878 175.6510 99 D 4.4165 8.2482 121.7682 56.8779 40.7650 178.8389 100 D 4.3276 7.9594 118.3896 57.3522 40.9187 178.6072 101 V 3.5896 8.0449 118.9483 66.4857 31.5033 177.8049 102 T 3.8321 8.2167 115.7050 66.8247 68.2535 176.2931 103 V 3.5409 7.5523 119.2511 66.2147 31.4362 177.6285 104 I 3.7978 7.4516 119.0401 64.7645 36.9357 177.6967 105 S 4.0041 8.1268 113.4308 61.7518 62.1145 176.6248 106 K 3.9223 8.5077 120.8604 59.5863 31.8020 179.2813 107 S 4.1130 8.8100 116.2738 61.7675 62.8221 176.8648 108 L 3.9963 8.2739 121.3434 57.9796 41.2368 179.3923 109 A 4.1810 7.6583 118.8945 55.1385 18.5482 179.7360 110 G 3.6195 8.6013 104.4924 47.8375 0.0000 175.3303 111 L 3.7667 7.7593 122.5871 57.7297 42.0801 178.4705 112 F 4.6380 7.6563 113.2291 56.1521 39.9051 176.1215 113 K 3.9410 7.5391 121.4470 56.3055 32.5581 176.0061 114 V 3.8759 8.2282 125.3360 63.8701 31.7938 175.0576 115 G 4.0960 8.9771 116.4774 46.2330 0.0000 174.3380 116 N 4.7266 8.1921 117.0600 51.4796 40.9270 174.1042 117 P 4.2712 0.0000 0.0000 66.2673 31.4355 178.6211 118 I 3.8534 7.8982 117.3344 64.5584 36.9847 178.0185 119 A 4.0818 8.0521 120.7184 55.5983 18.2869 178.7882 120 E 3.8590 8.5174 116.8114 59.6547 29.4946 179.1654 121 A 3.9582 8.5505 120.5422 55.5873 18.4476 179.5087 122 I 3.6804 7.8882 117.9449 64.6405 37.1163 178.4606 123 S 4.5808 8.0433 110.7701 59.4109 62.6039 174.3475 124 S 4.5996 7.2251 114.2964 58.0097 63.7138 173.8086 125 Q 3.1675 7.9074 117.1130 57.9900 26.5954 173.2481 126 S 4.6177 8.1554 110.9139 56.4823 65.3497 171.9525 127 G 3.9275 7.9741 110.7493 44.1925 0.0000 173.7499 128 F 4.6370 8.1283 119.6257 57.5581 39.0825 176.5835 129 Y 4.3352 7.7473 119.6522 60.1435 38.2230 175.4244 130 A 4.2155 7.9699 126.5468 52.3502 18.5183 176.9688 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 2 A 8.25 4.38 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 3 T 7.93 4.22 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 1.23 0.00 0.00 4 L 7.60 4.42 0.00 1.54 1.60 0.22 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 5 R 8.19 4.85 0.00 2.04 1.93 0.00 3.16 0.00 0.00 3.58 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 6 S 8.67 5.00 0.00 3.96 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 7 F 8.42 4.83 0.00 3.03 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.39 3.93 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 0.70 0.00 0.00 0.90 0.00 0.00 9 L 8.63 3.96 0.00 1.11 1.41 0.87 0.75 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 10 V 7.33 4.11 1.85 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 0.93 0.00 0.00 0.72 0.00 0.00 11 D 8.54 4.96 0.00 2.61 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 N 9.11 4.68 0.00 2.78 2.75 0.00 0.00 6.82 8.79 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 13 G 8.89 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 14 G 7.83 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 0.00 0.00 0.00 15 T 7.52 4.04 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 1.20 0.00 0.00 16 G 8.26 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.02 4.45 0.00 2.57 2.70 0.00 0.00 6.68 7.20 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 18 V 8.48 3.92 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.53 0.00 0.00 19 T 8.19 4.82 4.15 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 0.00 0.00 0.00 1.12 0.00 0.00 20 V 8.24 4.56 1.57 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 0.03 0.00 0.00 0.89 0.00 0.00 21 V 8.95 5.01 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 0.82 0.00 0.00 0.99 0.00 0.00 22 P 0.00 4.29 0.00 1.83 1.65 0.00 3.67 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 23 V 8.61 4.47 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 0.79 0.00 0.00 1.01 0.00 0.00 24 S 7.66 4.57 0.00 3.86 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.25 5.33 0.00 2.51 2.67 0.00 0.00 7.29 7.96 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 26 A 7.89 4.36 1.25 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 0.00 0.00 27 N 9.64 4.08 0.00 2.86 2.89 0.00 0.00 6.99 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 28 G 8.44 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 0.00 0.00 0.00 29 V 7.60 4.51 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 1.00 0.00 0.00 1.02 0.00 0.00 30 A 8.86 4.57 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.48 5.18 0.00 2.06 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 32 W 10.09 5.37 0.00 3.28 2.96 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 33 L 9.25 5.36 0.00 1.55 1.53 0.95 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.71 4.68 0.00 3.93 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 35 N 8.50 4.63 0.00 2.67 2.77 0.00 0.00 6.73 7.79 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 36 N 7.68 4.96 0.00 2.71 2.67 0.00 0.00 7.24 7.57 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 37 S 8.34 4.37 0.00 3.99 3.98 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 38 R 8.68 4.02 0.00 1.82 2.07 0.00 3.39 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 39 S 8.00 4.32 0.00 3.95 3.99 0.00 0.00 0.00 0.00 0.00 0.00 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 8.51 4.39 0.00 1.88 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.23 0.00 41 A 7.84 4.66 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.34 4.14 0.00 2.86 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 8.90 5.25 0.00 1.88 1.72 0.00 3.08 0.00 0.00 3.47 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 44 V 8.95 5.20 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 0.79 0.00 0.00 0.94 0.00 0.00 45 T 9.22 5.63 4.43 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 46 A 9.49 5.94 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.68 5.06 0.00 3.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.62 5.13 0.00 2.70 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.45 4.62 0.00 1.68 1.64 0.00 3.15 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 50 A 8.23 4.37 1.08 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 51 S 8.42 4.22 0.00 3.83 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 52 G 8.80 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.39 4.57 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 54 D 7.54 4.69 0.00 2.61 2.80 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 55 K 8.08 5.11 0.00 1.88 1.68 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.42 7.81 56 R 8.90 4.93 0.00 1.67 1.41 0.00 2.97 0.00 0.00 2.88 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.60 0.00 57 K 8.85 5.09 0.00 1.73 1.57 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.61 7.81 58 Y 9.37 5.20 0.00 2.98 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 T 9.21 5.16 4.34 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 1.36 0.00 0.00 60 I 9.01 5.25 1.90 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.91 0.91 0.00 0.00 61 K 9.35 5.15 0.00 1.73 1.74 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.43 7.81 62 L 9.14 5.20 0.00 1.69 1.45 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 63 E 9.23 4.74 0.00 2.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.23 0.00 64 V 8.44 4.17 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 0.91 0.00 0.00 0.99 0.00 0.00 65 P 0.00 4.59 0.00 1.75 1.71 0.00 2.36 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.55 0.00 66 K 7.66 3.69 0.00 0.79 0.74 0.00 1.11 0.00 0.00 1.18 0.00 0.00 2.92 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.54 0.90 7.81 67 I 7.73 4.06 1.76 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.41 0.84 0.00 0.00 68 V 8.57 4.47 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 0.59 0.00 0.00 0.88 0.00 0.00 69 T 8.26 4.78 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 1.23 0.00 0.00 70 Q 8.77 4.27 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 71 V 8.18 4.67 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 0.74 0.00 0.00 0.93 0.00 0.00 72 V 8.51 4.07 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 73 N 9.16 4.51 0.00 2.92 2.92 0.00 0.00 7.18 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 74 G 8.28 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.14 4.05 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 0.95 0.00 0.00 0.98 0.00 0.00 76 E 8.45 4.73 0.00 2.00 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 2.27 2.33 0.00 77 L 8.79 4.87 0.00 1.59 1.57 0.92 0.71 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 78 P 0.00 4.90 0.00 2.16 2.04 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.97 0.00 79 V 8.68 4.58 2.05 0.00 0.00 0.00 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 0.89 0.00 0.00 80 S 8.36 4.97 0.00 3.59 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.54 4.22 1.01 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 0.00 0.00 82 W 6.65 4.51 0.00 3.41 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 83 K 9.18 5.24 0.00 1.50 1.18 0.00 1.75 0.00 0.00 1.50 0.00 0.00 2.65 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.15 1.39 7.81 84 A 8.89 5.02 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 85 Y 8.84 5.21 0.00 2.80 2.91 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 86 A 9.04 4.94 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 87 S 8.63 5.02 0.00 3.90 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 88 I 9.38 4.74 1.90 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 1.24 0.57 0.97 0.00 0.00 89 D 8.94 5.38 0.00 2.56 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 90 L 9.25 4.83 0.00 1.80 1.72 0.99 0.48 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 91 T 8.74 5.21 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 92 I 8.81 4.84 2.02 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.91 1.01 0.00 0.00 93 P 0.00 4.97 0.00 2.36 2.32 0.00 3.76 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.08 0.00 94 I 7.77 3.87 1.60 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 -0.36 0.70 0.00 0.00 95 F 7.78 4.27 0.00 3.15 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 96 A 7.74 4.07 1.39 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 0.00 0.00 97 A 9.92 4.50 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 98 T 8.44 3.83 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 1.23 0.00 0.00 99 D 8.25 4.42 0.00 2.72 2.80 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 0.00 100 D 7.96 4.33 0.00 2.97 2.75 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 0.00 101 V 8.04 3.59 2.25 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 1.05 0.00 0.00 1.01 0.00 0.00 102 T 8.22 3.83 4.44 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 1.20 0.00 0.00 103 V 7.55 3.54 2.20 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 1.03 0.00 0.00 0.97 0.00 0.00 104 I 7.45 3.80 2.10 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.71 0.91 0.00 0.00 105 S 8.13 4.00 0.00 3.81 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.51 3.92 0.00 1.92 1.83 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.66 7.81 107 S 8.81 4.11 0.00 3.93 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.27 4.00 0.00 1.84 1.80 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.66 4.18 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 0.00 110 G 8.60 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 0.00 111 L 7.76 3.77 0.00 1.48 1.78 0.62 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 112 F 7.66 4.64 0.00 3.13 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 0.00 113 K 7.54 3.94 0.00 2.00 1.85 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.41 7.81 114 V 8.23 3.88 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 0.86 0.00 0.00 0.96 0.00 0.00 115 G 8.98 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 0.00 0.00 0.00 116 N 8.19 4.73 0.00 2.91 2.72 0.00 0.00 6.82 8.07 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 0.00 117 P 0.00 4.27 0.00 2.17 2.22 0.00 3.60 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 2.11 2.24 0.00 118 I 7.90 3.85 1.94 0.00 0.00 0.74 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 0.57 0.94 0.00 0.00 119 A 8.05 4.08 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 120 E 8.52 3.86 0.00 2.29 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 2.37 0.00 121 A 8.55 3.96 1.11 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 0.00 0.00 122 I 7.89 3.68 2.09 0.00 0.00 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 1.65 0.86 0.96 0.00 0.00 123 S 8.04 4.58 0.00 4.03 4.01 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 0.00 124 S 7.23 4.60 0.00 3.97 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 0.00 125 Q 7.91 3.17 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 126 S 8.16 4.62 0.00 3.82 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 0.00 127 G 7.97 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 F 8.13 4.64 0.00 2.86 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 Y 7.75 4.34 0.00 3.05 2.97 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 0.00 130 A 7.97 4.22 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