NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2166 8.1727 121.7853 55.8106 33.7347 176.0934 3 V 3.3308 8.3913 121.3148 65.8237 31.2030 176.3402 4 A 3.9713 8.2198 120.2421 55.1704 18.5583 178.6385 5 E 3.8324 8.0069 117.0216 59.5961 29.9618 178.9818 6 L 3.9861 7.7400 118.4600 57.5424 41.6750 179.3893 7 A 3.9123 8.3480 121.2881 55.1922 18.2156 179.2664 8 N 4.2540 8.3217 115.3068 56.5739 38.7258 177.0228 9 A 3.9850 7.7789 121.8284 54.8251 18.8673 179.5487 10 V 3.6048 7.6901 116.7824 66.1765 31.4531 178.5946 11 V 3.8219 7.5349 116.5043 65.2922 31.4639 176.8397 12 S 4.3027 7.7166 113.7437 59.3970 63.1343 174.6777 13 N 4.6692 7.6569 119.8881 51.2179 37.9692 174.0494 14 A 3.9637 8.3074 128.4503 55.2306 18.7173 178.7593 15 D 4.2995 8.0630 116.4452 57.6667 40.9642 178.9429 16 Q 4.0509 8.2694 118.4995 58.7555 28.7161 178.8011 17 K 3.8892 8.1628 119.6385 59.4676 31.9970 178.9361 18 D 4.3992 8.1740 119.1575 57.5037 40.6702 179.0788 19 L 4.0160 7.5255 118.0636 57.6314 41.5792 179.4686 20 L 3.7200 7.7504 118.9371 57.8612 41.5417 179.8938 21 R 4.0775 8.0785 118.0011 59.3617 29.8873 178.8700 22 M 4.0952 8.3940 118.5072 58.6851 32.2446 178.4957 23 S 4.2448 8.7415 114.8414 61.0004 63.2954 176.2210 24 W 4.4824 8.9586 132.7306 60.2971 30.2059 178.0602 25 G 3.6525 7.9972 105.0603 47.7502 0.0000 175.5050 26 V 3.7013 7.3547 119.8726 65.6407 31.4021 178.2637 27 L 3.7630 7.8643 118.2059 57.3524 41.5005 178.0524 28 S 3.8444 7.2970 110.9434 58.0401 63.3798 175.1836 29 V 3.5030 7.1376 121.8287 65.5243 31.3504 175.8020 30 D 4.6178 7.4294 119.3885 51.6202 42.2147 175.3719 31 M 3.8738 8.1456 126.0595 57.8559 32.1641 177.8432 32 E 4.0048 8.0898 119.0652 59.2953 30.1041 178.9866 33 G 3.7736 8.0046 106.6071 47.6661 0.0000 175.7400 34 T 3.9836 8.3297 118.8648 65.9551 68.4589 177.2350 35 G 3.5087 8.1268 107.8290 47.8456 0.0000 175.7938 36 L 4.0057 8.0756 122.0170 57.6380 41.6007 179.3375 37 M 4.0436 7.8166 117.6989 58.1514 32.1089 178.0923 38 L 3.8533 7.8161 120.8510 58.1917 42.1414 178.8874 39 M 3.5209 7.8427 118.2883 57.9864 31.8002 178.5821 40 A 4.1146 7.8003 120.7517 55.4199 18.5969 179.5271 41 N 4.2345 8.1020 114.9925 56.0759 38.4679 177.5234 42 L 3.7801 7.7779 121.9011 58.1881 41.9522 179.0638 43 F 4.4969 7.5824 116.6339 60.5824 38.8405 177.5648 44 K 4.1950 8.1632 117.5781 59.7247 31.9394 179.2728 45 T 4.2993 7.8112 115.1780 64.9470 69.6510 175.0796 46 S 4.6652 8.3440 117.6359 54.8423 63.1177 172.4659 47 P 4.4562 0.0000 0.0000 65.2145 31.3925 177.8254 48 S 4.1627 8.2339 112.7569 61.4096 62.7903 175.9533 49 A 4.1655 8.3283 124.7316 55.1663 17.9004 179.1705 50 K 3.9420 8.2073 117.4322 60.1035 32.1004 179.0243 51 G 3.6420 8.1864 105.2568 47.7524 0.0000 175.8678 52 K 4.0684 8.1786 119.7433 58.2278 32.1625 178.3535 53 F 4.8039 7.8164 116.9458 57.3086 39.4629 177.4716 54 A 4.0531 8.0214 124.1710 54.8276 17.7380 180.3635 55 R 3.8569 8.0755 116.9429 59.6941 30.0660 177.8493 56 L 4.1919 7.9201 115.7575 56.1655 43.0318 177.8572 57 G 3.9585 7.5268 105.4847 45.3275 0.0000 176.7972 58 D 4.5163 8.5459 122.9943 51.9999 39.3130 175.9737 59 V 3.4843 7.6522 124.2981 64.6291 31.8849 177.5152 60 S 4.3656 7.7403 111.9047 59.2571 63.7972 174.8462 61 A 4.0745 8.2140 124.8841 52.8682 19.3493 178.6544 62 G 3.7421 7.5277 104.0581 46.0050 0.0000 177.3427 63 K 3.9070 8.8375 124.4121 58.7927 32.1014 177.2431 64 D 4.4055 7.7508 117.0743 56.2032 41.2304 176.4234 65 N 4.5988 8.4268 119.0372 52.7254 39.3399 175.5604 66 S 4.1727 8.6024 124.5180 61.0826 63.4215 176.3950 67 K 3.9855 8.1172 121.9944 59.2981 31.7823 178.7963 68 L 4.0240 8.2385 120.6837 57.9438 42.0172 178.9553 69 R 3.9735 8.3144 119.1097 59.4692 30.1905 178.6568 70 G 3.7026 8.3990 105.8462 48.1109 0.0000 175.0493 71 H 4.1776 8.4596 120.6663 59.2182 29.8174 177.6344 72 S 4.1008 8.4270 117.2398 61.5375 62.4519 176.8100 73 I 3.7857 7.9135 122.5978 64.7644 36.9789 178.6709 74 T 4.0421 7.9587 116.4610 66.2499 68.0858 176.2708 75 L 3.8283 8.1839 122.8996 58.7318 42.0318 179.1726 76 M 4.1613 7.8265 118.1098 58.6237 31.8610 178.3041 77 Y 4.0993 7.9916 116.2286 60.2764 37.9967 178.0604 78 A 3.6989 7.7866 121.9809 54.8954 18.2455 179.6023 79 L 3.8238 7.5556 117.3054 57.3790 41.6060 179.2335 80 Q 3.4716 7.8119 119.7587 59.0065 28.7365 177.9112 81 N 4.2731 7.8882 116.6198 56.8928 39.4019 176.3676 82 F 4.7034 7.6660 118.9684 60.7414 39.0569 177.9062 83 V 3.4626 7.8480 117.9450 66.0602 31.1165 177.7438 84 D 4.4988 8.3186 117.0385 56.2989 40.9502 177.4700 85 A 4.4520 7.6811 119.9247 52.4208 18.6422 178.5273 86 L 4.1408 7.8528 117.7434 56.3310 41.4520 177.7737 87 D 4.7667 7.7877 116.9861 53.9464 41.6338 176.1049 88 D 4.5650 8.0660 119.2418 51.5681 43.7841 175.5220 89 V 3.5867 8.4451 127.4724 66.2939 31.6535 177.5692 90 E 3.9440 8.1939 117.6769 59.3155 29.4119 179.1675 91 R 3.8896 8.0498 118.2929 59.3154 30.1981 178.1646 92 L 4.0101 8.0212 120.1982 57.9788 42.0903 178.8113 93 K 3.9090 8.2644 119.9960 59.6564 32.1606 178.5543 94 C 4.2032 8.0679 114.3125 61.0793 29.7257 176.0703 95 V 3.7030 7.9114 114.7428 63.4683 31.1024 178.6288 96 V 3.8413 8.1978 118.7552 66.2617 31.4736 177.9028 97 E 3.9385 8.3078 118.2701 59.0991 28.9975 179.2606 98 K 3.7942 7.9418 119.6621 59.7084 32.1645 178.9551 99 F 4.8208 8.3535 118.6568 59.4526 38.8172 177.7813 100 A 3.9741 8.4302 121.2964 55.0007 18.0987 179.5244 101 V 3.5258 7.6141 116.3346 66.4711 31.1852 177.7867 102 N 4.3156 7.9263 115.7459 56.9514 38.4088 177.0592 103 H 4.3647 8.0838 117.1923 58.4742 28.8958 177.8200 104 I 3.7146 8.3057 122.0968 64.6493 36.7784 177.9801 105 N 4.4076 8.2167 116.0527 56.2155 38.4032 176.6011 106 R 4.3136 7.3491 115.3243 54.7191 31.4127 176.5376 107 Q 3.3806 8.0425 117.2559 56.9928 26.6484 174.2094 108 I 4.4448 7.9410 117.2148 59.9525 39.0506 177.4783 109 S 4.6540 8.8429 120.9173 56.5766 66.1403 174.9670 110 A 4.0158 8.4447 122.7724 55.8646 17.7294 179.6200 111 D 4.4265 8.0461 115.1020 57.3956 41.2433 178.4139 112 E 4.1640 7.8903 119.1336 59.2891 29.3812 179.0696 113 F 4.2134 8.7338 121.1376 61.0688 39.4869 177.2471 114 G 3.8412 8.4150 105.0190 47.0242 0.0000 174.9173 115 E 4.1727 8.0716 120.5926 58.3601 29.3652 178.4964 116 I 3.7589 7.4629 118.8381 63.2590 37.9593 177.7113 117 V 3.6999 7.6858 119.3071 65.7961 31.2679 178.0801 118 G 3.5428 7.6459 105.8512 47.3099 0.0000 173.5854 119 P 4.1185 0.0000 0.0000 65.1923 31.3970 178.3376 120 L 3.8137 7.9742 118.7849 57.9419 42.0828 178.8731 121 R 3.9784 8.1173 118.7914 59.4947 30.0583 178.3396 122 Q 3.8055 7.9573 119.2894 59.4719 29.0752 178.2315 123 T 3.8193 7.8754 116.7493 66.6235 68.4062 176.6524 124 L 4.0991 8.0383 120.9224 57.5289 41.4864 179.7123 125 K 3.6652 7.7220 117.9868 59.2955 31.7131 179.2862 126 A 3.9507 7.8067 119.8326 54.7235 18.3437 179.0984 127 R 4.2735 7.7609 114.7879 57.9807 31.1795 178.3156 128 M 4.3511 8.8017 118.7132 54.2324 32.5227 178.3074 129 G 3.8739 8.5442 107.0863 46.4176 0.0000 177.3406 130 N 4.3589 9.2548 122.2072 55.7103 38.3245 174.7523 131 Y 4.4433 8.1476 114.6631 57.5492 38.0055 175.5513 132 F 4.4151 7.9771 122.5642 58.4836 40.3396 174.2692 133 D 4.1382 6.5547 124.2176 51.5006 44.2219 175.8189 134 E 3.8912 8.4427 126.6396 59.2743 29.6547 178.5755 135 D 4.3975 7.9202 118.5936 57.3863 40.8559 178.6106 136 T 3.9498 7.7366 116.3606 66.4863 68.3537 176.9033 137 V 3.8313 7.7419 119.5787 65.9517 31.6855 177.7025 138 A 4.0167 8.2218 120.3338 55.0681 18.1353 179.3403 139 A 3.8656 8.0953 119.1731 55.2567 18.4209 179.8738 140 W 3.9398 8.2490 117.1009 59.8624 29.1165 178.5794 141 A 4.1121 8.6460 121.1175 55.3083 17.5556 179.8925 142 S 4.0547 8.0002 112.8887 61.5391 63.1730 176.3770 143 L 3.9433 7.6539 122.7325 58.1672 41.8886 179.0760 144 V 3.7702 8.1330 118.0700 66.1529 31.4032 177.8130 145 A 4.3555 7.9784 121.5260 54.2218 17.9154 179.7522 146 V 3.5047 7.5165 116.6560 65.9139 31.7963 178.1070 147 V 3.5889 7.5312 117.6912 65.8422 30.9988 177.7500 148 Q 3.8677 8.1185 117.5978 58.9563 28.3640 178.7087 149 A 4.1010 7.8473 120.7463 54.0792 18.3933 178.6052 150 S 4.5877 7.5196 110.2169 58.1144 63.7371 174.2129 151 L 4.1741 7.7822 128.0164 55.2260 41.5064 176.3485 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 K 8.17 4.22 0.00 1.83 1.74 0.00 1.58 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.48 7.81 3 V 8.39 3.33 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 1.04 0.00 0.00 0.90 0.00 0.00 4 A 8.22 3.97 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 5 E 8.01 3.83 0.00 2.03 2.11 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 2.36 2.38 0.00 6 L 7.74 3.99 0.00 1.67 1.65 0.97 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 7 A 8.35 3.91 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 8 N 8.32 4.25 0.00 3.17 2.80 0.00 0.00 7.14 7.07 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 9 A 7.78 3.98 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 10 V 7.69 3.60 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 0.87 0.00 0.00 0.88 0.00 0.00 11 V 7.53 3.82 2.13 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 1.06 0.00 0.00 0.94 0.00 0.00 12 S 7.72 4.30 0.00 3.89 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 13 N 7.66 4.67 0.00 2.86 2.65 0.00 0.00 6.93 7.19 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 14 A 8.31 3.96 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 15 D 8.06 4.30 0.00 2.84 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 16 Q 8.27 4.05 0.00 2.31 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 17 K 8.16 3.89 0.00 1.92 1.81 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.64 7.81 18 D 8.17 4.40 0.00 2.85 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 19 L 7.53 4.02 0.00 1.87 1.70 0.90 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.75 3.72 0.00 1.62 1.27 0.54 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.08 4.08 0.00 2.00 2.04 0.00 3.13 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 22 M 8.39 4.10 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.57 0.00 23 S 8.74 4.24 0.00 4.32 4.32 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 24 W 8.96 4.48 0.00 3.82 3.40 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 25 G 8.00 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 0.00 0.00 0.00 26 V 7.35 3.70 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 0.99 0.00 0.00 0.96 0.00 0.00 27 L 7.86 3.76 0.00 1.31 1.35 0.89 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 28 S 7.30 3.84 0.00 3.46 2.63 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 0.00 0.00 0.00 29 V 7.14 3.50 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 0.67 0.00 0.00 0.92 0.00 0.00 30 D 7.43 4.62 0.00 2.69 2.39 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 31 M 8.15 3.87 0.00 1.85 2.01 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.50 0.00 32 E 8.09 4.00 0.00 2.04 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 2.37 2.38 0.00 33 G 8.00 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.33 3.98 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 1.07 0.00 0.00 35 G 8.13 3.51 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 0.00 0.00 0.00 0.00 36 L 8.08 4.01 0.00 2.02 1.70 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 37 M 7.82 4.04 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.46 0.00 38 L 7.82 3.85 0.00 1.84 1.70 0.75 0.86 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 39 M 7.84 3.52 0.00 1.91 2.13 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.68 0.00 40 A 7.80 4.11 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 41 N 8.10 4.23 0.00 2.88 2.79 0.00 0.00 6.71 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 42 L 7.78 3.78 0.00 1.47 1.28 0.84 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 43 F 7.58 4.50 0.00 3.16 2.98 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 44 K 8.16 4.19 0.00 1.72 1.87 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.70 7.81 45 T 7.81 4.30 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 1.19 0.00 0.00 46 S 8.34 4.67 0.00 3.85 3.78 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 47 P 0.00 4.46 0.00 2.19 2.15 0.00 3.64 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 48 S 8.23 4.16 0.00 4.09 4.17 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.33 4.17 1.69 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 0.00 0.00 50 K 8.21 3.94 0.00 1.91 2.22 0.00 1.33 0.00 0.00 1.20 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.50 7.81 51 G 8.19 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.18 4.07 0.00 1.84 1.48 0.00 1.61 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.58 7.81 53 F 7.82 4.80 0.00 3.12 3.08 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 54 A 8.02 4.05 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 55 R 8.08 3.86 0.00 1.80 2.04 0.00 3.27 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 56 L 7.92 4.19 0.00 1.73 1.76 1.01 0.97 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 57 G 7.53 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 58 D 8.55 4.52 0.00 2.72 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.65 3.48 1.67 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 -0.58 0.00 0.00 0.63 0.00 0.00 60 S 7.74 4.37 0.00 3.97 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 61 A 8.21 4.07 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 62 G 7.53 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.84 3.91 0.00 1.72 1.86 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.21 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.63 7.81 64 D 7.75 4.41 0.00 2.87 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 65 N 8.43 4.60 0.00 2.82 2.84 0.00 0.00 6.79 7.61 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 66 S 8.60 4.17 0.00 4.10 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 67 K 8.12 3.99 0.00 2.14 1.94 0.00 1.69 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.56 1.51 7.81 68 L 8.24 4.02 0.00 1.80 1.90 1.05 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.31 3.97 0.00 2.08 2.06 0.00 3.33 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 1.65 1.66 0.00 70 G 8.40 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 71 H 8.46 4.18 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 72 S 8.43 4.10 0.00 4.05 3.83 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 I 7.91 3.79 1.95 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 1.57 0.79 1.14 0.00 0.00 74 T 7.96 4.04 4.40 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 1.26 0.00 0.00 75 L 8.18 3.83 0.00 1.67 1.76 0.85 0.79 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 76 M 7.83 4.16 0.00 1.95 2.22 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.82 0.00 77 Y 7.99 4.10 0.00 3.03 3.08 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 78 A 7.79 3.70 0.63 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 0.00 0.00 0.00 0.00 0.00 79 L 7.56 3.82 0.00 1.62 1.40 0.88 1.63 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 80 Q 7.81 3.47 0.00 2.34 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.78 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 81 N 7.89 4.27 0.00 2.95 2.95 0.00 0.00 7.31 6.55 0.00 0.00 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 F 7.67 4.70 0.00 3.17 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 83 V 7.85 3.46 1.72 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 0.92 0.00 0.00 0.37 0.00 0.00 84 D 8.32 4.50 0.00 2.89 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 85 A 7.68 4.45 1.48 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 0.00 0.00 86 L 7.85 4.14 0.00 1.67 1.66 0.78 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 87 D 7.79 4.77 0.00 2.64 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 88 D 8.07 4.56 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 89 V 8.45 3.59 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 1.14 0.00 0.00 0.91 0.00 0.00 90 E 8.19 3.94 0.00 2.20 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 2.39 2.30 0.00 91 R 8.05 3.89 0.00 2.07 2.09 0.00 3.20 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 92 L 8.02 4.01 0.00 1.94 1.63 0.83 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 93 K 8.26 3.91 0.00 2.01 1.78 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.42 7.81 94 C 8.07 4.20 0.00 3.22 3.16 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 95 V 7.91 3.70 2.19 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 0.93 0.00 0.00 1.35 0.00 0.00 96 V 8.20 3.84 2.31 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 1.09 0.00 0.00 0.78 0.00 0.00 97 E 8.31 3.94 0.00 2.04 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 2.31 2.40 0.00 98 K 7.94 3.79 0.00 1.71 1.80 0.00 1.33 0.00 0.00 1.47 0.00 0.00 2.85 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.94 0.62 7.81 99 F 8.35 4.82 0.00 3.42 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 0.00 100 A 8.43 3.97 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 0.00 101 V 7.61 3.53 2.26 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 1.11 0.00 0.00 0.98 0.00 0.00 102 N 7.93 4.32 0.00 3.09 2.90 0.00 0.00 7.11 7.92 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 0.00 103 H 8.08 4.36 0.00 3.40 3.47 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 I 8.31 3.71 2.04 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.72 0.92 0.00 0.00 105 N 8.22 4.41 0.00 2.90 2.90 0.00 0.00 7.10 7.87 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 0.00 106 R 7.35 4.31 0.00 1.79 1.89 0.00 3.45 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.74 0.00 107 Q 8.04 3.38 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.53 6.63 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 108 I 7.94 4.44 2.12 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 1.49 0.93 1.11 0.00 0.00 109 S 8.84 4.65 0.00 4.08 4.03 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 0.00 0.00 0.00 110 A 8.44 4.02 1.36 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 0.00 0.00 111 D 8.05 4.43 0.00 2.68 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 0.00 112 E 7.89 4.16 0.00 2.07 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 2.37 2.36 0.00 113 F 8.73 4.21 0.00 3.25 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 0.00 114 G 8.41 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 0.00 0.00 0.00 115 E 8.07 4.17 0.00 2.11 1.99 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 2.34 2.53 0.00 116 I 7.46 3.76 1.55 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.07 0.77 0.00 0.00 117 V 7.69 3.70 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 1.01 0.00 0.00 1.03 0.00 0.00 118 G 7.65 3.54 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 0.00 119 P 0.00 4.12 0.00 2.21 2.17 0.00 3.69 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 2.09 2.23 0.00 120 L 7.97 3.81 0.00 1.84 1.77 0.40 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 121 R 8.12 3.98 0.00 2.08 2.06 0.00 3.17 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.86 0.00 122 Q 7.96 3.81 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.57 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 123 T 7.88 3.82 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 1.10 0.00 0.00 124 L 8.04 4.10 0.00 2.08 2.07 1.07 0.80 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 0.00 125 K 7.72 3.67 0.00 1.73 1.54 0.00 1.33 0.00 0.00 1.24 0.00 0.00 2.31 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.30 0.75 7.81 126 A 7.81 3.95 1.28 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 0.00 0.00 127 R 7.76 4.27 0.00 1.80 1.95 0.00 3.23 0.00 0.00 3.14 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 128 M 8.80 4.35 0.00 2.19 2.45 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.97 0.00 129 G 8.54 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 0.00 0.00 0.00 130 N 9.25 4.36 0.00 2.68 2.58 0.00 0.00 6.73 7.46 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 0.00 131 Y 8.15 4.44 0.00 3.10 3.03 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 0.00 0.00 0.00 132 F 7.98 4.42 0.00 3.07 3.07 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 0.00 133 D 6.55 4.14 0.00 2.56 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 0.00 0.00 0.00 0.00 134 E 8.44 3.89 0.00 2.09 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 2.42 2.49 0.00 135 D 7.92 4.40 0.00 2.87 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 0.00 136 T 7.74 3.95 4.42 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 1.45 0.00 0.00 137 V 7.74 3.83 2.47 0.00 0.00 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 1.22 0.00 0.00 138 A 8.22 4.02 1.36 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 0.00 0.00 139 A 8.10 3.87 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 0.00 140 W 8.25 3.94 0.00 3.66 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 0.00 141 A 8.65 4.11 1.43 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 0.00 0.00 0.00 142 S 8.00 4.05 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 0.00 143 L 7.65 3.94 0.00 1.49 1.76 0.88 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 144 V 8.13 3.77 2.42 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 1.14 0.00 0.00 1.19 0.00 0.00 145 A 7.98 4.36 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 0.00 146 V 7.52 3.50 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 0.76 0.00 0.00 0.89 0.00 0.00 147 V 7.53 3.59 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 0.51 0.00 0.00 0.76 0.00 0.00 148 Q 8.12 3.87 0.00 2.31 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.69 2.75 0.00 149 A 7.85 4.10 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 0.00 150 S 7.52 4.59 0.00 3.98 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 0.00 151 L 7.78 4.17 0.00 1.76 1.58 0.68 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00