NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 K 4.0160 8.3149 121.7627 55.9186 33.5631 175.1025 5 F 4.8522 8.1135 124.2276 57.2892 40.7548 172.6806 6 H 5.4205 10.9062 121.6155 54.2160 31.8854 172.6310 7 I 5.1221 8.9033 124.4494 59.3397 40.6461 174.2310 8 L 5.0079 8.8357 128.7294 53.3532 44.3078 174.5087 9 L 5.1490 9.3379 129.2515 53.6997 43.9137 174.7938 10 L 5.3689 9.3010 126.6638 53.0031 44.9329 175.0870 11 N 5.3273 9.2146 121.3094 51.6775 41.3940 175.1304 12 G 4.1081 8.9274 115.7298 44.1283 0.0000 171.3060 13 P 4.3535 0.0000 0.0000 64.0007 32.0006 177.2793 14 N 4.4873 9.5298 116.9230 53.7506 37.7962 176.4170 15 L 4.1279 7.4225 117.6506 56.8892 41.8937 178.9049 16 N 4.4172 8.0700 115.2799 55.3616 37.5016 175.8444 17 L 4.1845 7.9603 118.0377 55.2927 42.1622 176.7253 18 L 4.0578 7.6117 120.3087 56.7638 41.8476 178.2809 19 G 4.0592 9.1021 111.4921 45.5719 0.0000 173.6016 20 T 4.1852 7.6485 108.9221 61.8306 70.0474 174.7208 21 R 4.1052 7.8721 122.3155 55.6139 30.8724 175.8742 22 E 3.7239 8.7870 128.5584 56.2247 27.9766 173.8441 23 P 4.5906 0.0000 0.0000 65.1416 31.3958 178.1471 24 E 4.1984 7.8459 115.9948 58.2226 29.5448 178.0214 25 K 4.0402 7.4938 118.9530 58.2595 33.2315 176.9468 26 Y 4.6104 7.7931 113.9340 56.3025 38.9190 175.7788 27 G 4.2297 7.4940 109.0410 44.8624 0.0000 174.2663 28 Y 4.4241 8.5031 117.5472 58.0742 38.9629 176.5614 29 T 4.2250 7.9823 117.8291 63.7666 69.3433 174.4118 30 T 4.9538 8.3920 118.1391 59.1790 72.3124 175.7109 31 L 3.8329 8.2522 122.5346 58.2379 42.0802 178.7374 32 A 3.9312 7.9899 120.2191 55.3243 18.2098 179.3459 33 E 3.8665 8.1304 116.9036 59.5071 29.4572 179.6004 34 I 3.5317 7.5020 119.5405 64.3091 37.1162 178.7239 35 V 3.3677 7.7517 119.1203 65.8427 31.3885 178.2208 36 S 4.2139 8.1185 114.9474 61.9282 62.7527 176.8065 37 Q 3.9754 8.1221 120.7076 58.8577 28.3511 178.6375 38 L 4.0326 8.1491 121.4861 57.7494 42.0062 178.9154 39 E 3.9586 8.2762 118.9625 59.3320 29.4087 179.1940 40 I 3.6721 7.6354 119.6938 64.3288 36.6469 178.2349 41 Q 3.9130 8.0961 120.1053 59.2041 28.8765 178.1944 42 A 4.0394 8.3320 122.1098 55.3573 18.5269 179.6010 43 Q 4.0814 8.4227 116.8151 59.0919 28.5427 179.3492 44 G 3.7017 7.9578 105.8392 47.3331 0.0000 174.6277 45 M 4.3624 7.4777 117.9581 54.1459 32.8215 175.2111 46 D 4.3222 7.7963 116.6193 55.4899 39.8438 173.5262 47 V 4.5686 8.0796 117.7077 61.0529 33.9817 175.4084 48 A 4.3730 8.9950 130.3361 51.1190 19.4174 175.6217 49 L 5.0570 8.4456 124.1727 54.4639 43.7089 175.8534 50 S 5.0237 9.0849 121.7661 57.1147 66.5569 172.4674 51 H 5.5537 8.5794 120.0833 54.7948 33.2792 172.2991 52 L 4.4424 8.5165 124.9984 53.7179 45.7280 173.9614 53 Q 5.1528 8.4557 126.9708 54.5615 31.3265 174.2656 54 S 4.6990 8.6932 119.1325 57.4365 65.5809 173.7024 55 N 4.4967 8.9882 121.1442 53.4608 39.2396 174.7684 56 A 4.6633 8.0326 123.4338 50.3455 20.4051 177.1471 57 E 3.7605 9.1995 124.5149 60.0166 29.4531 178.7354 58 H 4.1628 8.1585 114.1103 58.6005 28.5100 177.2764 59 A 3.9205 7.5274 123.1350 54.7562 18.1773 179.6510 60 L 3.9226 7.7628 117.1064 57.9467 41.7339 179.5157 61 I 3.5736 7.6691 119.6926 64.4488 36.9645 178.1819 62 D 4.2404 8.2803 119.9725 57.3818 40.7473 178.7074 63 S 4.0817 8.1003 113.5241 61.5107 62.1094 176.3686 64 I 3.6979 7.5137 121.1908 64.7152 37.0903 177.7637 65 H 4.3896 8.3888 117.3056 59.1426 28.3637 177.8931 66 Q 4.1215 8.3724 118.3214 58.2660 28.7824 178.0719 67 A 4.4669 7.7926 122.6793 52.4135 18.3514 177.3554 68 R 3.9760 7.1175 118.1923 58.0652 30.3212 176.7653 69 G 4.0766 9.3741 114.2787 45.2792 0.0000 173.0950 70 N 4.9802 8.2657 114.2797 52.1919 38.6344 173.8725 71 T 4.9374 7.7556 115.2798 62.2180 71.6429 173.3216 72 D 4.7971 9.3265 125.8527 56.1741 42.1241 176.4896 73 F 4.7559 7.9359 118.2469 57.0974 43.1284 172.6638 74 I 5.2095 8.2442 124.6764 59.5402 40.5281 174.3074 75 L 5.3132 9.1563 127.1131 53.1077 44.0401 175.3353 76 I 4.9809 8.8958 123.9783 59.3410 41.6263 173.5004 77 N 5.6755 9.4878 129.3142 50.7544 39.2420 173.3063 78 P 4.5448 0.0000 0.0000 62.8353 33.3779 177.9227 79 A 3.5147 7.9948 123.4102 53.0347 18.3528 180.1530 80 A 4.2165 8.3837 117.5682 56.9869 18.7078 179.7612 81 F 4.8471 7.8596 115.6391 59.9420 38.7445 177.4329 82 T 3.9600 8.0285 113.1063 65.0841 66.8502 175.0006 83 H 5.0025 8.2574 117.6113 56.2314 28.8562 175.9063 84 T 4.6732 7.9617 108.5366 60.6988 70.5730 172.9532 85 S 4.3583 8.2683 117.0206 56.7555 62.2417 174.2702 86 V 3.2511 7.6924 129.2062 65.2758 31.3298 177.3387 87 A 3.8692 7.7028 120.4295 54.8844 18.2422 179.1820 88 L 3.7568 7.8822 118.8609 58.0749 42.0979 178.9220 89 R 3.8499 7.6382 118.6782 59.8938 29.9661 178.2825 90 D 4.3346 8.3653 118.1006 56.7640 40.7343 178.7062 91 A 4.0036 8.0275 121.8576 55.1515 18.5402 179.6848 92 L 3.8726 7.8167 117.5225 57.9108 41.4407 179.7815 93 L 4.1593 8.0286 118.2038 57.7634 41.6198 179.5376 94 G 3.7050 8.1495 104.9351 47.4474 0.0000 175.4967 95 V 3.9334 7.9874 113.2554 60.6263 32.2728 176.0288 96 Q 3.5508 7.7570 116.4547 57.0320 26.6988 173.7562 97 I 4.4080 6.9380 114.2928 58.5548 39.4297 174.7336 98 P 4.4662 0.0000 0.0000 62.9394 32.5072 175.1033 99 F 5.6481 7.8010 114.6137 54.9543 41.9705 172.7898 100 I 4.8918 8.6705 119.9081 59.5974 40.2971 174.0230 101 E 5.0677 8.8733 127.7342 55.1956 31.4578 174.7204 102 I 4.9618 8.6721 127.1608 59.7738 41.0216 174.1053 103 H 4.9886 8.9958 123.2782 53.9138 32.0133 174.5274 104 L 4.0962 8.8952 123.3631 57.6058 42.4556 177.7681 105 S 4.6855 7.8953 110.9574 56.4498 65.1192 173.2722 106 N 4.5419 8.3196 119.2820 52.7735 37.7263 175.7868 107 V 3.7925 8.1081 119.4518 63.4515 31.9182 177.2215 108 H 4.1034 8.4169 115.9337 56.7950 28.8590 175.6173 109 A 4.6136 7.9051 121.8751 51.8284 19.3468 177.6185 110 R 4.7622 7.2462 117.0348 55.9675 31.9998 175.4078 111 E 3.9908 8.2810 120.9868 56.7717 30.3101 176.1066 112 P 4.2565 0.0000 0.0000 65.7030 31.1962 178.9841 113 F 4.3718 8.0770 112.8579 59.6915 37.4884 176.8066 114 R 3.7881 7.1544 116.4180 57.5043 29.9736 177.7058 115 H 4.2417 8.0825 116.4084 57.2656 28.8012 175.0375 116 H 4.5151 7.6616 121.7180 55.3816 30.5137 173.9078 117 S 4.7336 7.7039 119.5734 57.1407 65.2381 172.9887 118 Y 4.5988 8.8384 124.0938 58.3129 38.2773 176.0309 119 L 4.8596 8.2542 121.0374 55.6822 43.8979 178.9113 120 S 4.2915 8.2270 113.2496 61.2434 62.9464 175.9857 121 D 4.4588 8.1534 119.1719 54.8316 39.4143 176.5453 122 I 4.2507 7.5703 111.2672 60.2854 38.5279 175.8125 123 A 2.6476 7.1800 123.6427 51.4204 18.8364 177.7187 124 V 3.6291 7.9224 121.8104 65.9967 32.2560 175.9189 125 G 4.1240 7.3907 104.7723 45.7139 0.0000 171.9242 126 V 5.1474 8.2100 118.5955 61.1422 34.7730 174.4009 127 I 4.7667 8.9155 128.0864 59.6076 40.1593 174.2935 128 C 5.6216 7.9957 120.6563 56.5166 32.6296 174.6173 129 G 3.9392 9.2622 108.4677 45.8328 0.0000 173.7149 130 L 4.5313 7.7992 117.5312 53.6040 42.7766 178.5345 131 G 3.8460 8.1264 108.6344 45.7460 0.0000 174.8035 132 A 4.2548 8.5884 119.1068 55.3751 18.2320 179.4662 133 D 4.1067 8.2632 117.2846 57.3872 40.7398 178.8747 134 G 3.7484 8.1556 106.2191 48.2181 0.0000 175.3141 135 Y 4.0211 8.1224 118.8021 60.6569 37.8675 177.9072 136 N 4.4834 7.8984 118.8030 56.2869 39.0550 176.7685 137 F 4.4877 7.9183 119.1477 60.5594 38.9664 177.5364 138 A 4.0349 8.2479 120.4897 55.0419 18.1607 179.4645 139 L 3.8668 8.1293 118.8507 58.2866 42.1121 179.1381 140 Q 3.9585 8.2668 117.7831 58.9965 28.6799 178.7241 141 A 3.8916 8.3750 121.8364 54.9771 18.2967 179.5251 142 A 2.8094 7.7301 119.1289 54.9510 18.3112 180.0121 143 V 3.2548 7.5820 116.6963 66.1010 31.3411 177.8355 144 N 4.2472 8.1144 115.5323 56.2364 38.6335 177.0424 145 R 3.9546 7.8905 119.8760 59.5897 30.0406 178.5912 146 L 3.7734 7.5136 117.3657 57.7910 41.4794 179.4850 147 S 4.4955 7.9318 113.9515 60.7280 62.7934 176.5808 148 K 4.1261 7.8795 121.5493 59.2126 32.0123 177.0305 149 S 4.3816 7.8970 116.5341 58.4737 63.3658 173.7851 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 4 K 8.31 4.02 0.00 1.67 1.74 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 1.48 7.81 5 F 8.11 4.85 0.00 3.15 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 6 H 10.91 5.42 0.00 3.23 3.28 0.00 5.75 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.90 5.12 1.96 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.94 1.10 0.00 0.00 8 L 8.84 5.01 0.00 1.83 1.58 1.01 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 9 L 9.34 5.15 0.00 1.87 1.76 1.29 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 10 L 9.30 5.37 0.00 1.57 1.54 0.89 0.46 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 11 N 9.21 5.33 0.00 2.70 2.76 0.00 0.00 6.55 8.13 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 12 G 8.93 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 13 P 0.00 4.35 0.00 1.92 1.76 0.00 3.45 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.44 0.00 14 N 9.53 4.49 0.00 2.86 2.99 0.00 0.00 7.03 6.28 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 15 L 7.42 4.13 0.00 1.84 1.74 0.98 0.54 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 16 N 8.07 4.42 0.00 2.82 3.14 0.00 0.00 6.10 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 17 L 7.96 4.18 0.00 1.79 1.71 0.89 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.61 4.06 0.00 1.84 1.80 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.10 4.06 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 0.00 0.00 0.00 20 T 7.65 4.19 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 1.23 0.00 0.00 21 R 7.87 4.11 0.00 1.75 1.84 0.00 3.24 0.00 0.00 2.81 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 22 E 8.79 3.72 0.00 2.21 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 2.18 2.35 0.00 23 P 0.00 4.59 0.00 0.49 1.96 0.00 3.79 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 24 E 7.85 4.20 0.00 2.21 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 0.00 2.22 2.30 0.00 25 K 7.49 4.04 0.00 1.53 1.46 0.00 1.55 0.00 0.00 1.06 0.00 0.00 2.91 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.30 1.06 7.81 26 Y 7.79 4.61 0.00 3.09 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 27 G 7.49 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 0.00 0.00 0.00 0.00 28 Y 8.50 4.42 0.00 2.95 3.02 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 29 T 7.98 4.22 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 1.20 0.00 0.00 30 T 8.39 4.95 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 1.28 0.00 0.00 31 L 8.25 3.83 0.00 1.91 1.67 0.82 0.94 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 32 A 7.99 3.93 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 33 E 8.13 3.87 0.00 2.18 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 2.31 2.33 0.00 34 I 7.50 3.53 1.71 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.65 0.14 0.00 0.00 35 V 7.75 3.37 1.93 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 0.88 0.00 0.00 0.54 0.00 0.00 36 S 8.12 4.21 0.00 3.86 3.86 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 37 Q 8.12 3.98 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 38 L 8.15 4.03 0.00 1.80 1.60 1.05 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.28 3.96 0.00 2.18 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 2.32 2.47 0.00 40 I 7.64 3.67 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.69 0.90 0.00 0.00 41 Q 8.10 3.91 0.00 2.12 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 42 A 8.33 4.04 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 43 Q 8.42 4.08 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 44 G 7.96 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 45 M 7.48 4.36 0.00 2.04 2.22 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.55 0.00 46 D 7.80 4.32 0.00 2.82 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.08 4.57 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 0.92 0.00 0.00 1.04 0.00 0.00 48 A 9.00 4.37 1.09 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 0.00 0.00 0.00 0.00 0.00 0.00 49 L 8.45 5.06 0.00 1.67 1.59 1.05 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 50 S 9.08 5.02 0.00 3.82 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 51 H 8.58 5.55 0.00 3.08 3.11 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.52 4.44 0.00 1.72 1.38 0.88 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 53 Q 8.46 5.15 0.00 2.11 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.48 0.00 0.00 0.00 0.00 0.00 2.42 2.28 0.00 54 S 8.69 4.70 0.00 3.87 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.99 4.50 0.00 2.76 2.84 0.00 0.00 6.83 7.35 0.00 0.00 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 A 8.03 4.66 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 57 E 9.20 3.76 0.00 1.37 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 2.11 1.75 0.00 58 H 8.16 4.16 0.00 3.34 3.51 0.00 5.51 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 7.53 3.92 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 60 L 7.76 3.92 0.00 1.84 1.72 1.15 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 61 I 7.67 3.57 1.89 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.73 0.67 0.00 0.00 62 D 8.28 4.24 0.00 2.79 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 63 S 8.10 4.08 0.00 3.96 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 64 I 7.51 3.70 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 1.45 0.69 0.88 0.00 0.00 65 H 8.39 4.39 0.00 3.29 3.33 0.00 5.64 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 66 Q 8.37 4.12 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.02 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 67 A 7.79 4.47 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.12 3.98 0.00 1.83 1.93 0.00 3.26 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 69 G 9.37 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 70 N 8.27 4.98 0.00 2.90 2.98 0.00 0.00 6.57 7.35 0.00 0.00 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 T 7.76 4.94 4.39 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 1.38 0.00 0.00 72 D 9.33 4.80 0.00 2.74 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 73 F 7.94 4.76 0.00 3.04 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 74 I 8.24 5.21 1.88 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 1.25 0.66 0.91 0.00 0.00 75 L 9.16 5.31 0.00 1.72 1.70 1.05 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 76 I 8.90 4.98 1.84 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 1.19 1.89 0.95 0.00 0.00 77 N 9.49 5.68 0.00 2.66 2.99 0.00 0.00 6.83 8.12 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 78 P 0.00 4.54 0.00 2.43 2.32 0.00 3.83 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 2.12 2.10 0.00 79 A 7.99 3.51 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 0.00 0.00 0.00 0.00 0.00 80 A 8.38 4.22 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 81 F 7.86 4.85 0.00 3.26 2.94 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 82 T 8.03 3.96 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 1.02 0.00 0.00 83 H 8.26 5.00 0.00 3.40 3.51 0.00 5.61 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.96 4.67 4.36 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 1.37 0.00 0.00 85 S 8.27 4.36 0.00 3.65 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.69 3.25 1.79 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 0.88 0.00 0.00 -0.08 0.00 0.00 87 A 7.70 3.87 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 88 L 7.88 3.76 0.00 1.64 1.76 0.83 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 89 R 7.64 3.85 0.00 2.01 2.11 0.00 3.35 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 90 D 8.37 4.33 0.00 2.67 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.03 4.00 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 92 L 7.82 3.87 0.00 1.74 1.62 0.13 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 93 L 8.03 4.16 0.00 1.62 1.75 0.95 1.01 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 94 G 8.15 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 95 V 7.99 3.93 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 0.99 0.00 0.00 1.03 0.00 0.00 96 Q 7.76 3.55 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.60 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 97 I 6.94 4.41 1.84 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 1.36 0.74 0.86 0.00 0.00 98 P 0.00 4.47 0.00 1.48 2.01 0.00 3.55 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.93 0.00 99 F 7.80 5.65 0.00 3.08 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 0.00 100 I 8.67 4.89 2.09 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 1.33 1.07 1.01 0.00 0.00 101 E 8.87 5.07 0.00 2.30 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 102 I 8.67 4.96 1.44 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.65 0.24 0.00 0.00 103 H 9.00 4.99 0.00 3.00 3.22 0.00 5.62 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.90 4.10 0.00 1.65 1.77 1.02 1.08 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 0.00 105 S 7.90 4.69 0.00 3.98 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 N 8.32 4.54 0.00 2.74 2.77 0.00 0.00 6.89 7.71 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 0.00 107 V 8.11 3.79 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.79 0.00 0.00 108 H 8.42 4.10 0.00 3.24 3.25 0.00 5.66 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.91 4.61 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 0.00 110 R 7.25 4.76 0.00 1.61 1.60 0.00 3.18 0.00 0.00 3.15 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.66 0.00 111 E 8.28 3.99 0.00 1.16 1.51 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 2.46 2.33 0.00 112 P 0.00 4.26 0.00 2.16 2.06 0.00 3.59 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 2.11 0.00 113 F 8.08 4.37 0.00 3.19 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 0.00 114 R 7.15 3.79 0.00 1.71 1.81 0.00 2.89 0.00 0.00 3.09 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.50 0.00 115 H 8.08 4.24 0.00 3.20 3.30 0.00 5.84 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.66 4.52 0.00 3.18 3.35 0.00 5.74 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.70 4.73 0.00 3.78 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 0.00 118 Y 8.84 4.60 0.00 3.04 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 0.00 119 L 8.25 4.86 0.00 1.96 1.97 0.94 1.05 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 0.00 120 S 8.23 4.29 0.00 4.01 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 0.00 121 D 8.15 4.46 0.00 2.82 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 0.00 122 I 7.57 4.25 1.97 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.12 0.97 0.00 0.00 123 A 7.18 2.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.92 3.63 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 0.79 0.00 0.00 0.85 0.00 0.00 125 G 7.39 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 0.00 0.00 0.00 126 V 8.21 5.15 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 0.91 0.00 0.00 0.92 0.00 0.00 127 I 8.92 4.77 1.87 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.70 0.99 0.00 0.00 128 C 8.00 5.62 0.00 3.07 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 0.00 129 G 9.26 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 0.00 0.00 0.00 130 L 7.80 4.53 0.00 1.76 1.86 1.07 0.97 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 0.00 131 G 8.13 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 0.00 132 A 8.59 4.25 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 0.00 133 D 8.26 4.11 0.00 2.78 1.93 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 0.00 134 G 8.16 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 0.00 0.00 0.00 135 Y 8.12 4.02 0.00 3.06 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 0.00 136 N 7.90 4.48 0.00 2.60 2.58 0.00 0.00 7.70 7.71 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 0.00 137 F 7.92 4.49 0.00 3.10 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 0.00 138 A 8.25 4.03 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 0.00 139 L 8.13 3.87 0.00 1.82 1.86 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 140 Q 8.27 3.96 0.00 2.38 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.42 2.79 0.00 141 A 8.37 3.89 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 0.00 142 A 7.73 2.81 0.54 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 0.00 0.00 0.00 0.00 0.00 0.00 143 V 7.58 3.25 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 1.16 0.00 0.00 0.97 0.00 0.00 144 N 8.11 4.25 0.00 2.81 2.82 0.00 0.00 7.02 7.24 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 0.00 145 R 7.89 3.95 0.00 1.78 1.91 0.00 3.26 0.00 0.00 3.41 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 146 L 7.51 3.77 0.00 0.58 0.16 0.50 1.17 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 0.00 147 S 7.93 4.50 0.00 4.03 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 0.00 148 K 7.88 4.13 0.00 1.83 1.87 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.19 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.65 7.81 149 S 7.90 4.38 0.00 4.01 3.86 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