NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3617 8.3044 120.3247 53.7454 33.9664 174.8009 2 E 4.4915 7.6489 114.8896 54.9967 32.2865 173.3994 3 Q 4.0771 8.4643 119.8268 56.1060 30.0406 175.7156 4 N 4.2030 7.7694 116.7818 52.9015 39.3822 174.0048 5 N 4.1805 7.6900 113.0589 52.6318 40.5009 174.4866 6 I 3.6204 7.6894 113.5751 64.8731 37.1573 177.1572 7 K 3.8586 7.9288 119.4229 59.7726 32.2531 178.1674 8 E 3.8003 8.1239 118.6217 59.6081 29.5005 178.3487 9 Q 3.4517 8.5406 118.8641 59.0930 28.6322 179.5686 10 L 4.0644 8.0198 119.7732 58.0943 41.2679 178.9726 11 I 3.6581 7.8731 119.3791 65.6455 37.0466 177.8309 12 S 3.7448 8.9178 110.9187 62.2111 61.9743 176.3067 13 F 4.3825 7.5790 121.3907 61.1567 39.3926 177.2242 14 F 4.2204 9.1430 119.7930 61.9799 39.1327 177.4529 15 N 4.4398 9.4879 115.2366 56.2073 38.7398 175.1460 16 Q 4.5962 8.5210 118.6332 56.6150 30.1862 176.1344 17 A 4.4868 7.9768 121.5056 53.3241 21.8040 180.9224 18 C 4.5351 7.3966 112.2477 57.7099 30.5373 171.8979 19 S 4.4321 8.3865 112.4589 60.0647 64.5033 177.1743 20 T 4.2346 7.5267 120.3509 61.9685 71.6425 174.9184 21 H 4.4302 8.6451 116.8415 59.1338 29.2303 177.3761 22 Q 3.8225 8.1851 119.2656 58.9982 28.3434 179.2786 23 E 3.6142 7.3461 120.9315 59.7357 29.5737 178.6934 24 R 3.2775 7.5174 117.2492 59.7168 29.9175 178.6264 25 L 3.8716 7.6390 118.8679 57.8466 41.8772 178.7386 26 D 4.5156 7.8310 117.8890 56.7759 40.6298 178.0912 27 F 4.7733 9.0317 119.4628 60.8202 38.7764 177.8192 28 I 3.9288 7.6781 112.1281 64.7010 37.7832 176.1850 29 C 4.2910 8.2832 119.9268 60.2173 31.4729 175.1345 30 S 4.2544 9.2072 115.1074 62.0723 62.1670 176.6971 31 T 4.0468 9.0807 117.2030 66.6030 68.9268 176.4218 32 R 4.6959 7.9028 119.8661 55.4220 30.1754 176.0023 33 E 4.9846 7.5984 108.4489 55.8577 32.9301 176.9743 34 S 4.2694 8.0602 114.9032 59.0662 62.6745 171.9395 35 D 4.0779 8.1899 117.3220 54.8039 46.6466 175.1843 36 T 4.1583 7.0464 111.7296 61.0908 68.4879 175.2096 37 F 3.8520 7.5702 116.8324 58.1570 36.4601 175.0788 38 S 4.1548 7.4859 111.7376 57.6494 63.1697 174.3156 39 S 4.4866 7.6611 112.0560 58.2354 63.5389 174.0570 40 V 3.5476 7.4833 121.0573 62.9993 32.1623 175.8588 41 D 4.7601 8.3567 122.2646 52.3938 38.8859 175.8503 42 V 4.3037 6.7887 116.3059 60.0424 34.2108 171.7793 43 P 4.4815 0.0000 0.0000 62.6691 32.2845 177.2504 44 L 4.1369 8.3973 120.1818 57.0699 42.2345 178.8391 45 E 3.9046 8.3625 117.9875 59.2108 29.7586 177.2588 46 P 4.7002 0.0000 0.0000 65.5982 31.8017 178.1358 47 I 3.4259 7.4819 120.0912 64.1869 37.0624 178.3802 48 K 3.9229 8.5134 119.3072 59.3453 31.6711 179.0451 49 N 4.0998 8.7671 118.4153 55.5124 38.1543 176.5667 50 I 4.3108 7.3680 110.9887 61.8475 38.2166 176.6663 51 I 3.9480 7.3739 121.9516 62.4858 38.0491 175.6730 52 E 4.5558 7.7839 118.7836 57.0203 30.1681 177.0515 53 I 4.2931 7.6157 119.7355 62.0203 40.2953 175.4957 54 T 4.5249 7.2374 108.6957 61.6459 68.7241 174.5069 55 K 4.5735 7.8380 119.2327 57.4311 32.7190 176.7422 56 D 4.9039 7.6584 117.0256 51.9005 46.2228 174.1092 57 E 3.9041 9.2926 119.6666 59.1859 29.2375 179.2346 58 N 4.1772 8.4021 118.0324 57.2607 39.3616 176.5691 59 Q 3.9843 8.0930 119.0129 58.8274 28.8612 178.3018 60 Q 3.9943 8.8964 119.1637 60.5605 28.3521 178.7262 61 I 3.7954 8.0947 121.9671 62.9282 37.1162 177.7965 62 E 3.9693 9.2332 120.3037 59.9501 29.5023 180.2558 63 I 3.7493 8.3622 119.9430 64.8901 37.2357 177.8627 64 T 4.0379 8.2086 116.8810 67.1166 68.1383 176.2221 65 K 3.9377 8.1056 119.5786 60.2757 32.3254 178.8691 66 I 3.9180 7.4669 119.5065 64.2232 37.3714 177.8448 67 A 4.9983 8.8086 123.4202 54.8680 17.8681 179.8506 68 V 3.5725 8.0233 116.8812 66.1412 31.6897 177.4567 69 N 4.1640 9.1458 118.0362 56.6513 38.4995 175.9207 70 N 4.2558 8.0735 117.8741 55.7447 39.2435 176.6251 71 I 3.6805 7.6558 119.4593 64.3325 37.9701 177.7230 72 K 3.9384 8.9661 118.3772 59.6206 31.6097 178.6987 73 T 4.2094 7.2242 113.1253 65.5512 68.6273 176.6255 74 L 3.8735 8.1635 119.5243 56.0802 41.9267 177.0450 75 S 4.6009 7.4585 115.1483 58.5237 63.1703 174.3479 76 S 4.3573 8.0747 120.0648 59.2432 70.0800 177.5325 77 V 2.5478 7.9679 115.9984 64.8124 29.4992 174.6136 78 G 3.6993 7.6581 110.6092 45.8452 0.0000 168.6644 79 A 4.4200 8.5688 118.0202 54.0129 20.7721 178.8835 80 T 4.3040 7.6165 108.7647 61.7154 67.3135 174.1891 81 G 4.0070 7.5591 109.2296 44.6217 0.0000 172.7077 82 Q 4.2660 7.8400 115.9338 56.7553 32.8494 174.9054 83 Y 4.7687 6.9261 115.1394 57.0474 39.4434 176.9659 84 M 4.2071 8.7796 122.5634 57.9140 32.7523 178.5771 85 A 4.2638 8.5908 121.9204 55.4222 18.6249 179.2265 86 S 4.1698 7.6018 109.1052 61.2535 62.7153 174.2581 87 F 4.6498 8.1942 123.2460 57.0012 38.6595 174.4808 88 F 4.7786 8.1177 121.3124 58.7623 47.8977 176.9961 89 S 4.3183 8.6020 114.1720 61.5971 61.6950 175.0654 90 T 3.8477 7.4684 109.6842 63.1117 69.1300 174.2240 91 N 4.6693 7.8317 125.0805 51.1216 39.7436 176.1679 92 S 4.2251 8.4780 122.6255 61.1275 63.3194 176.1253 93 E 3.9353 8.1194 121.2186 59.0590 29.1435 177.8871 94 P 3.6637 0.0000 0.0000 65.7965 31.7747 178.0591 95 A 4.6341 7.7611 121.0506 55.3328 18.0495 178.8487 96 I 3.4457 8.3999 119.7719 63.1111 36.9468 178.0599 97 I 3.4711 7.2800 121.8472 64.7840 37.3939 178.1936 98 F 4.8285 8.1609 118.4996 61.0059 38.8926 176.9256 99 C 3.9878 8.2181 118.3239 62.8884 31.2164 175.9280 100 V 3.7668 7.9133 119.5369 66.3587 31.1013 177.6108 101 I 3.6267 8.1859 119.5281 65.3917 36.9690 177.2791 102 Y 4.3553 8.9056 115.4831 61.7585 37.5087 178.6979 103 F 3.8508 8.9858 122.7031 61.7805 40.0681 177.4868 104 L 4.2597 8.2830 117.9810 58.7658 41.4864 179.2031 105 Y 4.3387 7.9967 115.8569 61.8267 37.6762 178.8530 106 H 4.2944 8.6525 116.1623 57.9018 28.7137 176.8136 107 F 4.9454 7.9601 117.6917 55.5647 40.5661 176.0359 108 G 3.9762 8.0305 107.1823 47.0016 0.0000 172.3082 109 F 4.7704 7.8764 116.4977 59.2359 41.7448 177.0960 110 L 4.1258 7.7822 118.3991 54.8218 41.9206 176.6360 111 K 4.6467 7.8581 119.2767 55.0098 35.2134 176.1285 112 D 4.1809 8.1063 116.5388 53.6674 42.2148 175.2512 113 N 4.3822 8.9353 125.5116 54.0290 38.3215 174.9416 114 N 4.8869 8.1566 132.4690 52.9449 41.1596 174.9417 115 K 4.0654 8.0900 125.5003 56.1500 33.4761 176.0551 116 K 3.9239 8.3836 121.8886 54.7450 31.5685 174.7850 117 Q 4.0072 8.4991 116.9436 56.8856 28.9189 175.9640 118 I 4.4477 7.7424 122.2715 59.3445 40.0923 174.1505 119 I 3.4256 7.7179 116.6498 63.7576 36.7651 177.7316 120 K 3.5917 6.6991 119.2744 60.1001 31.8338 178.6767 121 K 3.8284 7.5111 119.0781 59.5289 32.5804 178.1436 122 A 4.1181 8.2969 121.4314 55.2308 18.4066 178.8686 123 Y 4.3337 8.8311 114.7275 61.6081 37.9752 179.1861 124 E 4.1892 8.3313 119.5596 59.5038 29.7815 178.5974 125 T 3.8713 8.4176 113.5470 64.7200 66.6158 175.5480 126 I 3.9950 7.6796 120.6654 63.6012 37.7575 177.4664 127 A 4.3459 8.4435 120.8345 55.3494 18.3009 178.5588 128 D 4.4897 8.4104 116.4090 56.8542 41.6263 177.8758 129 N 4.2777 8.0690 116.3624 56.8009 38.8005 177.1940 130 I 4.0339 9.2486 119.7310 63.9155 37.6162 176.9258 131 A 4.1457 8.5107 119.8863 52.9596 18.1102 178.1353 132 D 4.1079 8.4762 117.2793 55.7754 41.5422 176.8004 133 Y 4.5508 7.3049 116.0066 58.0127 39.0464 176.3099 134 L 2.8320 7.3795 119.1434 55.1370 41.7124 175.8763 135 N 4.6830 8.2702 124.3470 55.4277 41.9508 173.5973 136 E 3.7911 7.6863 112.6633 56.8724 29.0223 173.8128 137 N 4.5571 7.7934 118.5715 53.4753 39.7446 174.7747 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 M 8.30 4.36 0.00 2.01 2.18 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 E 7.65 4.49 0.00 1.93 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.38 0.00 3 Q 8.46 4.08 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 4 N 7.77 4.20 0.00 2.75 2.76 0.00 0.00 6.19 7.94 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 5 N 7.69 4.18 0.00 2.84 2.86 0.00 0.00 5.87 7.66 0.00 0.00 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 I 7.69 3.62 1.85 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 1.52 0.95 0.91 0.00 0.00 7 K 7.93 3.86 0.00 1.91 1.91 0.00 1.42 0.00 0.00 1.48 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.46 7.81 8 E 8.12 3.80 0.00 2.00 1.94 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 2.31 2.29 0.00 9 Q 8.54 3.45 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.66 0.00 0.00 0.00 0.00 0.00 2.21 2.37 0.00 10 L 8.02 4.06 0.00 1.72 1.72 0.89 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.87 3.66 1.92 0.00 0.00 0.77 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 0.64 0.91 0.00 0.00 12 S 8.92 3.74 0.00 3.83 3.38 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 13 F 7.58 4.38 0.00 3.25 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 14 F 9.14 4.22 0.00 3.24 3.32 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 15 N 9.49 4.44 0.00 3.07 2.91 0.00 0.00 7.34 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 16 Q 8.52 4.60 0.00 2.31 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.57 0.00 0.00 0.00 0.00 0.00 2.39 2.62 0.00 17 A 7.98 4.49 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 18 C 7.40 4.54 0.00 3.06 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 19 S 8.39 4.43 0.00 3.98 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 20 T 7.53 4.23 4.20 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 1.19 0.00 0.00 21 H 8.65 4.43 0.00 3.17 3.33 0.00 5.66 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 22 Q 8.19 3.82 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 23 E 7.35 3.61 0.00 2.14 1.12 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 2.41 2.56 0.00 24 R 7.52 3.28 0.00 1.67 1.71 0.00 3.17 0.00 0.00 3.10 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.49 0.00 25 L 7.64 3.87 0.00 1.64 1.64 0.96 0.88 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 26 D 7.83 4.52 0.00 2.90 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 27 F 9.03 4.77 0.00 3.26 3.28 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 0.00 28 I 7.68 3.93 2.03 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.55 0.69 0.00 0.00 29 C 8.28 4.29 0.00 3.00 2.95 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 30 S 9.21 4.25 0.00 4.07 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 31 T 9.08 4.05 4.46 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 1.07 0.00 0.00 32 R 7.90 4.70 0.00 1.88 1.97 0.00 3.54 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.88 0.00 33 E 7.60 4.98 0.00 1.99 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 0.00 2.20 2.35 0.00 34 S 8.06 4.27 0.00 3.82 2.89 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 35 D 8.19 4.08 0.00 2.42 2.36 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.05 4.16 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 1.08 0.00 0.00 37 F 7.57 3.85 0.00 3.01 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 38 S 7.49 4.15 0.00 3.59 3.65 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 0.00 0.00 0.00 0.00 39 S 7.66 4.49 0.00 3.93 3.84 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.48 3.55 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 0.61 0.00 0.00 0.97 0.00 0.00 41 D 8.36 4.76 0.00 2.78 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 42 V 6.79 4.30 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 0.85 0.00 0.00 0.92 0.00 0.00 43 P 0.00 4.48 0.00 2.24 2.21 0.00 3.63 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 2.07 1.99 0.00 44 L 8.40 4.14 0.00 1.72 1.75 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.36 3.90 0.00 1.92 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 0.00 2.31 2.36 0.00 46 P 0.00 4.70 0.00 2.32 2.37 0.00 3.98 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.03 0.00 47 I 7.48 3.43 2.02 0.00 0.00 1.00 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 1.50 1.21 0.00 0.00 48 K 8.51 3.92 0.00 2.02 1.78 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.46 7.81 49 N 8.77 4.10 0.00 1.84 1.42 0.00 0.00 5.96 6.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 I 7.37 4.31 2.07 0.00 0.00 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 1.90 0.69 1.26 0.00 0.00 51 I 7.37 3.95 1.78 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 0.91 0.91 -0.20 0.00 0.00 52 E 7.78 4.56 0.00 1.97 1.90 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 2.24 2.32 0.00 53 I 7.62 4.29 1.90 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.77 0.93 0.00 0.00 54 T 7.24 4.52 4.20 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 1.15 0.00 0.00 55 K 7.84 4.57 0.00 1.75 1.86 0.00 1.75 0.00 0.00 1.80 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.45 7.81 56 D 7.66 4.90 0.00 2.62 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 E 9.29 3.90 0.00 2.01 1.83 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 2.41 2.43 0.00 58 N 8.40 4.18 0.00 2.73 2.90 0.00 0.00 6.85 7.75 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 59 Q 8.09 3.98 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 60 Q 8.90 3.99 0.00 2.34 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.81 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 61 I 8.09 3.80 2.02 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 1.53 1.24 0.92 0.00 0.00 62 E 9.23 3.97 0.00 2.20 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 0.00 2.36 2.41 0.00 63 I 8.36 3.75 2.02 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.05 0.88 0.00 0.00 64 T 8.21 4.04 4.56 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 1.22 0.00 0.00 65 K 8.11 3.94 0.00 1.96 2.10 0.00 1.37 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.63 1.67 7.81 66 I 7.47 3.92 2.13 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 1.52 0.59 1.10 0.00 0.00 67 A 8.81 5.00 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 68 V 8.02 3.57 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 0.96 0.00 0.00 0.96 0.00 0.00 69 N 9.15 4.16 0.00 2.98 3.21 0.00 0.00 7.00 6.70 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 70 N 8.07 4.26 0.00 1.53 2.57 0.00 0.00 6.27 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 I 7.66 3.68 2.03 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.13 1.00 0.00 0.00 72 K 8.97 3.94 0.00 1.78 1.90 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.66 7.81 73 T 7.22 4.21 4.51 0.00 0.00 0.00 0.00 0.00 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 74 L 8.16 3.87 0.00 1.75 1.69 1.07 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 75 S 7.46 4.60 0.00 3.98 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 S 8.07 4.36 0.00 3.67 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 V 7.97 2.55 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 0.50 0.00 0.00 0.60 0.00 0.00 78 G 7.66 3.70 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 0.00 0.00 0.00 79 A 8.57 4.42 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 80 T 7.62 4.30 4.20 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 1.17 0.00 0.00 81 G 7.56 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 0.00 0.00 0.00 82 Q 7.84 4.27 0.00 1.47 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.57 0.00 0.00 0.00 0.00 0.00 2.01 2.18 0.00 83 Y 6.93 4.77 0.00 2.71 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 M 8.78 4.21 0.00 2.32 2.31 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.59 0.00 85 A 8.59 4.26 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 7.60 4.17 0.00 3.86 4.19 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 0.00 0.00 0.00 0.00 87 F 8.19 4.65 0.00 2.74 2.81 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 88 F 8.12 4.78 0.00 3.23 2.93 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 89 S 8.60 4.32 0.00 3.89 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 90 T 7.47 3.85 4.19 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 0.00 0.00 0.00 1.25 0.00 0.00 91 N 7.83 4.67 0.00 2.73 2.71 0.00 0.00 6.91 7.32 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 92 S 8.48 4.23 0.00 3.85 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 93 E 8.12 3.94 0.00 1.93 1.94 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 2.34 2.36 0.00 94 P 0.00 3.66 0.00 2.23 2.09 0.00 3.66 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 2.08 1.93 0.00 95 A 7.76 4.63 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.40 3.45 1.97 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 1.43 0.54 0.55 0.00 0.00 97 I 7.28 3.47 1.47 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.22 0.69 0.00 0.00 98 F 8.16 4.83 0.00 3.44 3.33 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 99 C 8.22 3.99 0.00 3.14 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 0.00 100 V 7.91 3.77 2.27 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 0.99 0.00 0.00 0.93 0.00 0.00 101 I 8.19 3.63 2.43 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 1.92 1.17 0.89 0.00 0.00 102 Y 8.91 4.36 0.00 3.47 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 0.00 103 F 8.99 3.85 0.00 3.27 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 0.00 104 L 8.28 4.26 0.00 1.78 1.68 0.85 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 105 Y 8.00 4.34 0.00 3.14 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 0.00 106 H 8.65 4.29 0.00 2.63 3.16 0.00 5.62 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 F 7.96 4.95 0.00 3.17 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 0.00 108 G 8.03 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 0.00 0.00 0.00 109 F 7.88 4.77 0.00 3.11 2.92 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 0.00 110 L 7.78 4.13 0.00 0.77 1.13 0.26 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 111 K 7.86 4.65 0.00 1.72 1.70 0.00 1.83 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.36 7.81 112 D 8.11 4.18 0.00 2.64 2.57 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 0.00 0.00 0.00 0.00 113 N 8.94 4.38 0.00 2.74 2.78 0.00 0.00 7.09 8.01 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 0.00 114 N 8.16 4.89 0.00 3.03 2.80 0.00 0.00 7.12 7.60 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 0.00 115 K 8.09 4.07 0.00 1.68 1.73 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.47 7.81 116 K 8.38 3.92 0.00 1.92 1.86 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.28 1.40 7.81 117 Q 8.50 4.01 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.46 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 118 I 7.74 4.45 1.77 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 1.39 1.45 0.67 0.00 0.00 119 I 7.72 3.43 0.83 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.42 -0.34 0.00 0.00 120 K 6.70 3.59 0.00 1.76 1.38 0.00 1.42 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.19 1.33 7.81 121 K 7.51 3.83 0.00 1.68 2.07 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.17 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.55 7.81 122 A 8.30 4.12 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 8.83 4.33 0.00 2.88 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 0.00 124 E 8.33 4.19 0.00 2.19 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 2.42 2.55 0.00 125 T 8.42 3.87 4.49 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 126 I 7.68 3.99 2.01 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.81 0.99 0.00 0.00 127 A 8.44 4.35 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 0.00 128 D 8.41 4.49 0.00 2.92 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.07 4.28 0.00 2.98 2.96 0.00 0.00 6.82 8.41 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 0.00 130 I 9.25 4.03 2.02 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.61 0.93 0.00 0.00 131 A 8.51 4.15 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 0.00 132 D 8.48 4.11 0.00 2.66 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Y 7.30 4.55 0.00 2.95 2.92 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 0.00 134 L 7.38 2.83 0.00 1.27 1.23 0.75 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 135 N 8.27 4.68 0.00 2.57 2.69 0.00 0.00 6.97 7.63 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 0.00 136 E 7.69 3.79 0.00 1.97 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 2.22 2.25 0.00 137 N 7.79 4.56 0.00 2.62 2.58 0.00 0.00 7.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00