NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 P 4.3697 0.0000 0.0000 61.8089 32.6153 176.1074 8 E 3.8144 8.8008 123.6922 54.6292 30.1317 176.1437 9 T 4.0137 8.7209 114.8077 61.8227 71.3942 174.4513 10 L 3.9726 8.3848 122.9467 58.4153 42.2226 178.7012 11 E 3.9815 8.3544 117.7451 59.6899 29.4197 178.8410 12 A 4.0041 8.3280 120.6372 55.4185 18.3867 179.6817 13 R 3.8048 7.9448 116.3446 59.7702 30.2066 178.5370 14 I 3.3570 8.2639 118.6935 64.1154 37.1354 177.4480 15 N 4.3763 8.0415 117.0690 55.8374 38.1659 177.5602 16 R 4.2052 7.6519 118.4264 58.7680 30.3590 178.3420 17 A 4.0659 7.8558 119.5740 53.6101 18.3973 178.0310 18 T 4.0397 7.1349 106.0457 60.7800 69.6705 173.2404 19 N 4.4193 7.3951 123.2405 53.4007 38.9560 173.8024 20 P 4.5879 0.0000 0.0000 64.7643 31.6666 177.3014 21 L 4.2137 8.3295 118.9391 56.6912 41.8243 177.1138 22 N 4.5519 8.1551 117.4051 53.3119 38.6924 175.4607 23 K 4.1747 8.8212 123.4599 58.6197 32.5617 176.3572 24 E 4.9042 7.7979 114.1792 54.1175 32.7688 174.5532 25 L 3.8003 8.5238 119.2201 54.8745 42.1001 177.7118 26 D 4.6329 7.8412 122.2663 52.4849 41.3808 176.7549 27 W 4.1923 8.3961 126.8710 59.1171 29.4238 177.6782 28 A 4.0554 8.1600 120.5025 55.5105 17.4933 179.2890 29 S 4.4100 7.9398 111.0782 60.2754 63.5544 176.5644 30 I 3.7773 7.7517 122.8447 64.6827 36.9184 178.1681 31 N 4.6219 8.9376 117.6389 56.0680 38.6424 177.7569 32 G 3.7658 8.1957 106.8376 47.0817 0.0000 175.4939 33 F 4.1001 7.9308 122.8988 61.3614 39.3771 176.4241 34 C 3.8336 8.3778 114.2285 60.2093 36.1327 175.5973 35 E 3.9940 8.1080 119.6311 59.6546 29.1186 179.4331 36 Q 3.8598 7.7718 119.0881 58.8526 29.2831 177.8157 37 L 3.7348 7.6569 120.9965 58.5405 39.8807 178.4071 38 N 4.3687 7.3053 116.4543 54.8625 39.0238 175.6506 39 E 3.9024 7.7016 120.8441 58.9392 30.1898 176.3757 40 D 4.8085 7.5175 117.8435 52.1662 43.0046 177.2794 41 F 4.1422 8.6345 120.6024 60.6003 39.0161 176.4363 42 E 4.5789 8.1647 116.8079 56.0606 30.4005 177.7319 43 G 3.9416 7.9077 108.9042 46.8116 0.0000 174.0271 44 P 4.3913 0.0000 0.0000 64.8564 31.5085 176.8325 45 P 4.2723 0.0000 0.0000 65.4207 31.1551 178.4820 46 L 3.9129 7.8226 118.6039 58.2606 41.9980 178.6141 47 A 4.1827 8.6387 121.1721 55.8070 17.9851 179.5181 48 T 3.8991 8.0442 111.1132 64.9997 66.8868 176.7091 49 R 4.0361 8.0699 120.6661 59.5926 29.6341 178.6141 50 L 4.1889 8.4272 118.8631 57.5739 41.6885 179.3468 51 L 4.1844 8.0549 119.0154 57.1894 41.6559 179.2453 52 A 4.0429 8.0110 121.0058 55.3697 18.1703 178.9762 53 H 4.1114 7.7302 114.5613 59.6448 30.2077 177.3638 54 K 4.0516 7.8425 119.1183 59.2757 31.6251 179.3826 55 I 3.9293 7.5421 119.0508 63.6428 37.1190 177.3166 56 Q 4.3264 7.5143 116.4630 54.9193 29.0048 175.9612 57 S 4.1547 7.2922 116.2639 57.7340 62.7801 172.6918 58 P 4.3830 0.0000 0.0000 64.3215 31.7388 176.4429 59 Q 4.5180 7.9903 120.2090 54.5034 30.1985 175.9207 60 E 4.0307 8.7436 126.1438 58.9936 29.8346 178.4580 61 W 4.5577 8.2427 128.1466 60.4509 30.8624 176.8631 62 E 3.8892 8.6716 119.8661 58.7353 28.7938 178.2972 63 A 4.0935 7.9810 119.6878 55.5447 18.4708 179.8318 64 I 3.7066 8.0517 118.1010 64.7570 37.2990 178.7781 65 Q 3.6231 7.9132 118.8644 58.4899 28.2426 178.6073 66 A 3.8350 7.8465 121.9824 55.1608 18.3908 179.6849 67 L 4.0681 7.7616 117.1737 57.7850 41.6585 179.4378 68 T 3.9079 7.7820 115.9740 66.8164 68.3516 176.4621 69 V 3.5249 7.6168 119.5877 65.8909 31.5685 177.3146 70 L 4.1606 8.1074 120.3565 58.5379 41.7367 178.5055 71 E 4.2569 8.9110 118.9782 59.8308 29.6243 178.6249 72 T 4.0684 8.4087 115.9694 67.3525 68.5731 175.9853 73 C 4.3801 8.6846 118.1810 60.1399 39.8877 176.1069 74 M 4.1153 8.2020 119.8906 58.2105 31.5440 178.7038 75 K 4.2366 7.9586 118.3214 59.2752 32.4229 178.7737 76 S 4.5778 7.7082 111.6938 59.1657 64.1090 174.3275 77 C 4.3843 7.9873 119.6254 59.1166 29.2495 172.2279 78 G 4.2134 7.7578 109.1096 44.7265 0.0000 173.6575 79 K 4.0784 8.3877 118.9464 59.5489 32.3486 179.1485 80 R 3.8699 7.9469 117.7614 59.3556 30.1158 178.3162 81 F 4.1743 8.1910 119.5928 61.9732 39.3444 176.3729 82 H 3.7655 8.0247 115.4472 59.3117 28.3008 177.2950 83 D 4.4800 7.9120 119.3721 56.8780 40.7790 178.3940 84 E 3.9853 7.4966 118.8183 59.0806 29.6273 178.9865 85 V 3.2134 7.1555 118.4015 65.4084 31.2088 177.4271 86 G 3.8879 7.6059 103.3301 44.2218 0.0000 173.1874 87 K 4.3769 7.0798 120.2470 54.1162 34.1567 178.0552 88 F 4.4915 8.1993 121.1174 60.6205 38.5159 177.6628 89 R 3.9423 8.2183 117.4848 59.5468 30.1059 177.4403 90 F 4.5037 8.1316 119.0619 60.7866 39.8357 177.4403 91 L 4.0745 8.2725 118.7051 57.7752 41.3826 179.1294 92 N 4.2611 8.3072 116.5287 56.4610 38.2573 176.9659 93 E 3.8375 7.3782 117.7731 59.5999 29.6172 179.2819 94 L 4.0605 7.4016 118.2769 57.5911 41.8495 179.1551 95 I 3.7022 7.8286 119.8469 64.4407 36.9660 178.5668 96 K 3.8637 7.9002 119.2147 59.3754 31.6408 179.5434 97 V 3.6890 7.6491 118.6201 65.2696 31.2465 177.7613 98 V 4.0827 7.6153 109.4876 61.7249 32.6190 175.9696 99 S 4.5340 8.1160 118.1112 56.7429 63.4676 173.2582 100 P 4.1448 0.0000 0.0000 65.8579 31.2048 177.5215 101 K 3.9168 8.2488 117.2416 59.4373 33.2185 176.4202 102 Y 4.6302 7.3334 113.2253 57.9399 36.3305 178.1582 103 L 4.2802 8.8785 134.7433 56.7025 41.8586 178.5456 104 G 4.0451 8.5859 108.6262 48.8716 0.0000 175.0277 105 S 4.4086 7.8849 114.8216 59.9224 63.1834 175.0126 106 R 4.6495 7.8592 115.6673 55.9614 29.6919 175.1463 107 T 4.5718 7.7672 114.8530 62.4294 70.4481 175.5385 108 S 4.2970 8.4911 120.8543 58.6678 64.9247 175.3873 109 E 3.9367 8.7621 122.7850 59.2899 29.1890 179.2173 110 K 3.7804 8.1765 119.4077 59.9826 32.1012 178.6648 111 V 3.6271 7.5147 117.3911 65.8716 31.4467 178.2068 112 K 4.0331 7.8817 118.4810 59.4068 31.9276 179.1278 113 N 4.3323 8.7223 117.2179 56.0205 38.4599 177.1702 114 K 3.8520 8.2255 121.1050 59.7794 32.2160 178.7898 115 I 3.6992 7.8547 119.8329 64.4576 37.0261 178.5097 116 L 4.1030 7.9716 119.8648 57.5504 41.4260 179.1864 117 E 3.9465 8.1871 119.3753 59.1819 29.6419 178.7335 118 L 3.2336 7.6363 118.9009 57.5227 41.3606 179.2424 119 L 3.8882 7.4594 117.6794 58.0944 41.9523 178.8920 120 Y 3.2940 7.8849 119.1148 60.4420 38.5634 178.0598 121 S 3.8766 7.9041 115.1583 61.3427 62.8837 176.4560 122 W 3.9565 7.8893 122.2632 59.1006 28.5069 178.3777 123 T 3.9004 7.3308 109.2542 63.7995 68.3993 176.7635 124 V 3.7904 7.0821 120.0574 65.3835 32.0022 177.6035 125 G 3.8891 8.7896 105.0563 46.4388 0.0000 173.7892 126 L 5.1041 7.6495 121.1898 50.8182 41.4197 175.3465 127 P 4.2645 0.0000 0.0000 64.8713 32.0910 177.8145 128 E 4.2137 8.0225 117.2434 58.3841 30.6150 176.5309 129 E 4.5577 7.6257 119.8763 56.5273 27.0210 177.9607 130 V 3.7502 7.5807 115.1863 63.8494 32.0054 178.0554 131 K 4.0538 7.8765 118.1349 59.0076 31.8045 179.2562 132 I 3.8122 7.7102 119.8381 64.2506 37.0346 177.9025 133 A 4.0887 8.1466 121.1942 55.4389 18.1374 179.1567 134 E 3.9564 8.2729 116.9632 59.3165 29.7927 178.5933 135 A 4.1140 8.5302 121.1872 55.6749 18.4924 179.0844 136 Y 3.9957 8.3247 117.8485 60.8308 38.9183 177.6716 137 Q 4.0773 8.7811 121.0732 59.2632 29.1037 177.9541 138 M 3.9856 8.2283 119.2294 58.6139 32.4418 178.1847 139 L 3.8938 7.8639 119.0033 57.5755 41.9059 179.2048 140 K 3.6587 8.0781 119.8788 59.5995 31.9003 178.6142 141 K 4.0656 8.3200 117.8762 58.4775 32.2251 177.5535 142 Q 4.2789 7.6136 117.5852 56.2976 29.3580 176.0377 143 G 3.9786 7.7870 107.2433 45.8365 0.0000 174.9743 144 I 3.7753 7.3505 120.1282 64.2158 37.4489 176.2950 145 V 3.6666 7.5927 122.6028 63.2655 31.1793 175.5182 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 7 P 0.00 4.37 0.00 2.04 2.05 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.10 0.00 8 E 8.80 3.81 0.00 2.02 1.92 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 2.33 2.43 0.00 9 T 8.72 4.01 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 1.21 0.00 0.00 10 L 8.38 3.97 0.00 1.75 1.77 0.56 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.35 3.98 0.00 2.12 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 2.43 2.50 0.00 12 A 8.33 4.00 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 13 R 7.94 3.80 0.00 2.38 2.33 0.00 3.20 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.92 0.00 14 I 8.26 3.36 1.92 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.88 0.99 0.00 0.00 15 N 8.04 4.38 0.00 3.03 2.82 0.00 0.00 6.93 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 16 R 7.65 4.21 0.00 1.85 1.94 0.00 3.15 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 17 A 7.86 4.07 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 18 T 7.13 4.04 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 1.02 0.00 0.00 19 N 7.40 4.42 0.00 3.06 2.87 0.00 0.00 6.95 7.59 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 20 P 0.00 4.59 0.00 2.30 2.22 0.00 3.79 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 21 L 8.33 4.21 0.00 1.91 1.81 0.94 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 22 N 8.16 4.55 0.00 3.01 3.15 0.00 0.00 7.01 6.95 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 23 K 8.82 4.17 0.00 1.78 1.88 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.39 7.81 24 E 7.80 4.90 0.00 2.10 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 2.23 2.38 0.00 25 L 8.52 3.80 0.00 1.48 0.86 0.94 0.62 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 26 D 7.84 4.63 0.00 2.68 2.38 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 27 W 8.40 4.19 0.00 3.50 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 28 A 8.16 4.06 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 29 S 7.94 4.41 0.00 4.23 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 30 I 7.75 3.78 1.89 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.70 0.94 0.00 0.00 31 N 8.94 4.62 0.00 3.05 2.94 0.00 0.00 6.98 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 32 G 8.20 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 33 F 7.93 4.10 0.00 3.15 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 34 C 8.38 3.83 0.00 3.10 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 35 E 8.11 3.99 0.00 2.20 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 2.29 2.30 0.00 36 Q 7.77 3.86 0.00 2.22 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.28 0.00 37 L 7.66 3.73 0.00 1.54 1.31 0.51 -0.22 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 38 N 7.31 4.37 0.00 2.65 2.94 0.00 0.00 7.13 7.51 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 39 E 7.70 3.90 0.00 1.92 1.92 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 2.25 2.25 0.00 40 D 7.52 4.81 0.00 2.81 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 41 F 8.63 4.14 0.00 3.02 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 42 E 8.16 4.58 0.00 2.12 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 2.33 2.36 0.00 43 G 7.91 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 44 P 0.00 4.39 0.00 2.20 2.25 0.00 3.75 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 45 P 0.00 4.27 0.00 2.17 2.12 0.00 3.67 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 46 L 7.82 3.91 0.00 1.73 1.92 0.96 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.64 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 48 T 8.04 3.90 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 1.32 0.00 0.00 49 R 8.07 4.04 0.00 2.30 2.03 0.00 3.18 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 1.69 1.74 0.00 50 L 8.43 4.19 0.00 1.91 1.80 1.08 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.05 4.18 0.00 2.08 1.98 1.20 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.01 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 53 H 7.73 4.11 0.00 3.21 3.54 0.00 5.76 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 7.84 4.05 0.00 1.81 1.76 0.00 1.65 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 1.65 1.55 7.81 55 I 7.54 3.93 2.05 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 1.56 0.66 0.92 0.00 0.00 56 Q 7.51 4.33 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 57 S 7.29 4.15 0.00 3.83 3.79 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 0.00 0.00 0.00 0.00 58 P 0.00 4.38 0.00 2.23 2.17 0.00 3.79 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 59 Q 7.99 4.52 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.86 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 60 E 8.74 4.03 0.00 2.08 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 0.00 2.50 2.44 0.00 61 W 8.24 4.56 0.00 3.30 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.67 3.89 0.00 2.06 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 2.30 2.37 0.00 63 A 7.98 4.09 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 64 I 8.05 3.71 2.21 0.00 0.00 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 1.81 1.22 1.16 0.00 0.00 65 Q 7.91 3.62 0.00 1.53 1.75 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 1.16 1.16 0.00 66 A 7.85 3.84 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 67 L 7.76 4.07 0.00 1.87 1.78 0.95 1.27 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 68 T 7.78 3.91 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 69 V 7.62 3.52 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 0.77 0.00 0.00 0.70 0.00 0.00 70 L 8.11 4.16 0.00 2.02 2.16 1.02 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 71 E 8.91 4.26 0.00 2.28 2.28 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 2.49 2.54 0.00 72 T 8.41 4.07 4.52 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 1.45 0.00 0.00 73 C 8.68 4.38 0.00 3.00 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 74 M 8.20 4.12 0.00 1.91 2.55 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.81 0.00 75 K 7.96 4.24 0.00 1.96 1.94 0.00 1.95 0.00 0.00 1.84 0.00 0.00 3.16 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.57 1.59 7.81 76 S 7.71 4.58 0.00 4.02 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 77 C 7.99 4.38 0.00 3.23 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 78 G 7.76 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.39 4.08 0.00 1.81 1.78 0.00 1.72 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 1.49 1.58 7.81 80 R 7.95 3.87 0.00 1.88 1.97 0.00 3.23 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 81 F 8.19 4.17 0.00 2.96 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 82 H 8.02 3.77 0.00 3.29 3.26 0.00 5.68 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 83 D 7.91 4.48 0.00 2.81 2.64 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 84 E 7.50 3.99 0.00 1.77 1.80 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 2.29 2.40 0.00 85 V 7.16 3.21 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 0.44 0.00 0.00 -0.42 0.00 0.00 86 G 7.61 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 0.00 0.00 0.00 87 K 7.08 4.38 0.00 1.84 1.68 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.27 1.58 7.81 88 F 8.20 4.49 0.00 3.11 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 89 R 8.22 3.94 0.00 1.86 2.06 0.00 3.26 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 90 F 8.13 4.50 0.00 3.15 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 91 L 8.27 4.07 0.00 2.08 1.88 1.27 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.31 4.26 0.00 2.82 2.77 0.00 0.00 6.97 7.56 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 93 E 7.38 3.84 0.00 1.85 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 2.39 2.46 0.00 94 L 7.40 4.06 0.00 1.81 1.69 1.19 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.83 3.70 1.96 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 1.53 1.02 0.88 0.00 0.00 96 K 7.90 3.86 0.00 1.82 1.77 0.00 1.59 0.00 0.00 1.40 0.00 0.00 2.75 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.45 0.99 7.81 97 V 7.65 3.69 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 1.04 0.00 0.00 0.99 0.00 0.00 98 V 7.62 4.08 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 0.83 0.00 0.00 0.99 0.00 0.00 99 S 8.12 4.53 0.00 4.16 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 0.00 100 P 0.00 4.14 0.00 2.15 2.19 0.00 3.81 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 101 K 8.25 3.92 0.00 1.41 1.60 0.00 1.60 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.47 7.81 102 Y 7.33 4.63 0.00 3.19 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 0.00 0.00 0.00 0.00 103 L 8.88 4.28 0.00 1.78 1.73 0.94 0.93 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 0.00 104 G 8.59 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 0.00 0.00 0.00 105 S 7.88 4.41 0.00 3.90 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 0.00 106 R 7.86 4.65 0.00 1.88 1.97 0.00 3.01 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 107 T 7.77 4.57 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 108 S 8.49 4.30 0.00 4.06 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 0.00 109 E 8.76 3.94 0.00 2.00 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 0.00 2.40 2.32 0.00 110 K 8.18 3.78 0.00 1.83 1.95 0.00 1.94 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.56 7.81 111 V 7.51 3.63 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 0.99 0.00 0.00 0.97 0.00 0.00 112 K 7.88 4.03 0.00 1.81 1.84 0.00 1.73 0.00 0.00 1.85 0.00 0.00 3.15 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.67 7.81 113 N 8.72 4.33 0.00 2.80 2.87 0.00 0.00 6.64 7.10 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 0.00 114 K 8.23 3.85 0.00 2.03 1.99 0.00 1.62 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.56 7.81 115 I 7.85 3.70 2.03 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 1.55 0.54 0.93 0.00 0.00 116 L 7.97 4.10 0.00 1.87 1.80 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.19 3.95 0.00 2.12 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 2.30 2.35 0.00 118 L 7.64 3.23 0.00 1.38 0.13 1.03 0.29 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 0.00 119 L 7.46 3.89 0.00 1.85 2.05 1.04 1.04 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 0.00 120 Y 7.88 3.29 0.00 2.91 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 0.00 121 S 7.90 3.88 0.00 4.05 4.14 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 0.00 0.00 0.00 0.00 122 W 7.89 3.96 0.00 3.40 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 0.00 123 T 7.33 3.90 4.09 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 1.12 0.00 0.00 124 V 7.08 3.79 1.82 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 0.80 0.00 0.00 0.41 0.00 0.00 125 G 8.79 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 0.00 0.00 0.00 126 L 7.65 5.10 0.00 1.73 1.46 0.48 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 127 P 0.00 4.26 0.00 2.02 2.09 0.00 3.64 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 128 E 8.02 4.21 0.00 2.04 1.96 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 2.35 2.36 0.00 129 E 7.63 4.56 0.00 2.01 1.82 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 2.22 2.25 0.00 130 V 7.58 3.75 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 1.01 0.00 0.00 0.90 0.00 0.00 131 K 7.88 4.05 0.00 1.63 0.97 0.00 1.41 0.00 0.00 0.61 0.00 0.00 2.70 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.78 1.22 7.81 132 I 7.71 3.81 2.05 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.88 1.19 0.00 0.00 133 A 8.15 4.09 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 0.00 134 E 8.27 3.96 0.00 2.44 2.32 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 2.41 2.43 0.00 135 A 8.53 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 136 Y 8.32 4.00 0.00 3.19 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 0.00 137 Q 8.78 4.08 0.00 2.28 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 138 M 8.23 3.99 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.57 0.00 139 L 7.86 3.89 0.00 1.63 1.58 0.93 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.08 3.66 0.00 1.42 1.92 0.00 1.81 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.41 1.41 7.81 141 K 8.32 4.07 0.00 1.73 1.93 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.43 7.81 142 Q 7.61 4.28 0.00 2.29 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.16 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 143 G 7.79 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 0.00 144 I 7.35 3.78 1.81 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 1.16 0.55 0.89 0.00 0.00 145 V 7.59 3.67 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 0.62 0.00 0.00 0.35 0.00 0.00