NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 E 4.1699 8.2876 120.2263 59.6197 30.7204 175.9692 4 E 3.4319 7.6932 114.8983 54.9102 29.3930 176.9755 5 K 3.9483 7.4466 119.9428 60.9124 33.9344 180.1202 6 K 4.1180 8.1376 118.8556 59.2479 32.8513 178.9563 7 R 3.7543 7.7382 120.3261 59.5964 29.7727 178.0421 8 R 3.9321 8.1607 117.2549 59.3690 29.8212 178.6060 9 A 3.9927 8.2161 119.5361 54.6103 18.7035 179.3104 10 A 4.0917 7.8713 119.4875 55.5050 18.5359 179.6967 11 T 3.7674 7.9351 107.4244 65.2481 68.6705 175.8389 12 A 4.0170 7.7064 124.3244 54.7775 18.1391 179.7644 13 R 3.9310 7.8200 115.8182 59.5987 29.9979 179.0867 14 R 3.8978 8.1144 117.1680 59.6826 30.0568 178.8632 15 Q 4.3232 8.1577 117.2575 59.3816 28.7705 178.0170 16 H 4.1023 8.8149 119.6652 59.5832 29.6757 177.1475 17 L 3.9246 8.6538 120.8442 57.6429 41.4872 179.2185 18 K 3.8434 8.8965 119.5511 59.8966 32.0697 179.3226 19 S 4.0853 8.6165 112.9317 60.9931 62.1905 175.8887 20 A 4.0140 7.6868 123.2501 54.9208 18.0650 179.3655 21 M 3.9758 8.2998 118.1654 58.2923 32.1772 178.4446 22 L 3.9111 8.2225 119.2479 58.2774 42.0989 179.3477 23 Q 3.9546 8.1449 119.0628 59.3548 28.7564 178.6823 24 L 4.0021 7.7343 120.3946 58.5072 42.1829 178.0083 25 A 3.8927 8.5271 120.5831 55.3982 18.0193 179.5389 26 V 3.5162 8.0999 115.7086 65.4740 31.1281 178.7282 27 T 3.8844 7.6189 112.1310 63.8931 67.1316 175.4699 28 E 4.2492 7.8858 120.9211 58.3264 29.9114 177.8808 29 I 3.6629 8.2400 119.5597 64.1703 38.0478 177.6669 30 E 4.0994 8.0126 118.0678 58.7386 29.4283 179.1773 31 K 3.9178 7.4106 120.2200 59.5010 32.1633 178.5817 32 E 3.8912 8.2385 119.2356 59.3705 29.4532 178.4743 33 A 3.9735 7.9399 120.0531 55.2671 18.4017 179.4440 34 A 3.8752 8.2579 118.2547 55.1754 18.3585 179.3722 35 A 3.9080 7.9924 118.3229 55.4686 18.6822 179.1164 36 K 3.8317 8.5145 118.0786 60.0059 32.1661 177.9333 37 E 3.8901 8.1867 119.0368 59.5613 29.4991 178.9686 38 V 3.6009 7.8821 117.9877 66.3769 31.4213 177.7342 39 E 4.0156 8.2217 117.9833 59.4126 29.3281 179.3017 40 K 3.9489 7.9419 119.0848 59.5942 32.3288 178.4604 41 Q 4.2231 8.3089 117.6832 57.9668 28.7849 178.1600 42 N 4.3663 8.0336 117.7201 56.1637 38.7629 176.3952 43 Y 4.0952 8.2999 121.2186 61.1260 38.7632 178.5653 44 L 4.1060 8.3013 119.0801 57.4157 41.4169 179.2062 45 A 3.9962 7.6382 120.7444 54.8180 18.3371 178.5959 46 E 4.2607 7.6121 113.3747 58.3272 30.7571 177.6197 47 H 4.3310 7.7078 114.9822 56.4884 30.1434 175.6194 48 S 4.7001 7.0793 110.3932 57.3047 64.5633 173.3745 49 P 4.4049 0.0000 0.0000 61.1632 32.2137 173.9735 50 P 4.1322 0.0000 0.0000 61.8367 30.5441 175.7530 51 L 3.9211 8.3306 124.6764 55.5627 42.3235 177.1996 52 S 4.3995 8.2022 118.0902 55.4856 63.1592 172.4976 53 L 3.9380 8.5085 126.3026 55.3199 40.4933 177.2826 54 P 4.6680 0.0000 0.0000 62.0743 33.0820 176.5901 55 G 4.0836 8.7698 111.5723 46.9709 0.0000 173.5975 56 S 4.6564 9.2339 114.6572 58.8411 68.3689 176.0715 57 M 4.2629 8.4899 120.1130 55.3258 30.4812 177.7868 58 Q 4.0711 9.4662 120.7584 58.9221 29.6482 175.1247 59 E 4.0558 8.2376 118.1238 59.6436 29.4243 178.7373 60 L 3.9245 7.9355 119.9083 57.2045 41.7062 179.6730 61 Q 3.9384 7.6671 116.1699 59.1116 28.7209 177.9019 62 E 3.8637 8.8011 120.8862 59.4412 29.6036 178.2990 63 L 3.8937 8.7262 120.4030 58.6364 42.1564 179.2875 64 S 4.1370 8.0844 114.5984 61.6402 62.8499 176.7848 65 K 3.9427 8.2536 122.3785 59.1989 31.9695 178.4058 66 K 3.8085 8.5459 120.2602 60.0454 32.0105 178.1116 67 L 3.9139 8.5098 119.1379 58.1529 41.7576 178.8349 68 H 3.9164 8.5828 117.4535 59.6811 29.8953 177.1372 69 A 4.1141 8.0762 122.1446 54.9579 18.2489 179.4238 70 K 3.8790 7.9313 118.1176 59.5762 32.1966 178.8096 71 I 3.7686 8.0923 120.5221 64.7948 37.1297 178.1189 72 D 4.5118 7.6513 118.1229 57.6386 40.5489 178.2763 73 S 4.1103 7.9579 113.7465 61.1272 62.3051 176.0966 74 V 3.6210 9.0111 121.6198 66.0119 31.3873 177.8839 75 D 4.3470 8.6224 118.0439 57.3340 41.1393 177.6193 76 E 3.9275 8.1837 119.7002 59.5657 29.4836 178.6713 77 E 3.9872 8.2362 118.2760 59.4568 29.4741 179.1908 78 R 3.8811 8.6041 119.3018 59.6118 30.0166 177.8275 79 Y 3.9158 8.4859 119.4227 60.8641 38.8922 177.4712 80 D 4.4845 8.8153 120.1166 57.9008 41.0103 179.1301 81 T 3.8131 8.1217 116.0333 66.7898 68.4348 176.0118 82 E 3.8375 8.2375 121.2015 59.5453 29.4620 179.1658 83 V 3.4296 7.6652 118.1686 65.7059 31.5609 178.1570 84 K 4.1269 8.0747 118.0779 58.5685 31.8009 179.2426 85 L 3.8596 7.8005 121.1729 58.1582 42.1091 178.4208 86 Q 3.9096 8.1119 118.3681 59.0704 28.6357 179.1725 87 K 3.8154 8.3113 120.5234 60.0156 32.1704 178.6633 88 T 3.8217 7.7767 115.5072 66.8871 68.2272 176.4418 89 I 3.6793 8.0280 120.6120 64.4626 37.3913 178.0923 90 K 4.0286 8.1153 120.1374 59.6362 32.0601 178.2403 91 E 3.9336 8.4611 120.1102 59.2815 29.4310 178.4896 92 L 4.2535 8.1337 118.7532 57.6640 40.6379 178.9765 93 E 3.9846 7.8496 119.5466 59.5214 29.6479 178.4067 94 D 4.5283 8.0543 118.4241 57.5187 40.8415 178.8003 95 L 4.0383 7.7569 119.0493 57.4134 41.3734 178.6065 96 S 4.6265 8.1610 110.7498 59.0145 62.3912 173.8999 97 Q 4.5645 7.6384 120.2558 58.4070 30.1534 177.0390 98 K 3.8666 7.9711 118.5743 58.4284 32.2012 176.8190 99 L 4.3898 8.1157 119.4539 57.2620 43.2126 177.2157 100 F 5.2598 8.5436 121.7291 60.5780 40.3123 175.1342 101 D 4.4551 8.0553 118.5503 51.2343 38.2625 175.3701 102 L 4.3557 6.9479 118.4684 56.3887 47.0460 174.0028 103 R 4.5303 8.2483 115.2873 58.6141 35.2632 174.9456 104 G 3.3326 7.4557 107.5624 44.2598 0.0000 172.3038 105 K 4.7300 8.4528 126.1366 56.0209 32.8918 176.7017 106 F 5.0964 7.7853 120.0725 54.3237 40.8197 175.0047 107 K 4.0406 8.6054 120.3772 57.3189 32.9302 177.1759 108 R 3.7801 8.4320 118.1463 56.9329 25.8021 174.9719 109 P 4.4520 0.0000 0.0000 61.4806 32.6052 176.6709 110 P 4.5971 0.0000 0.0000 65.7210 31.5295 177.7351 111 L 3.9335 8.0234 117.9070 55.5641 41.8554 176.3071 112 R 3.2698 7.1389 112.5806 56.9209 27.3273 175.6987 113 R 4.2270 8.2134 122.8513 54.9541 29.6001 175.7872 114 V 4.3667 8.0792 124.7612 59.7735 33.6309 175.8915 115 R 4.4547 8.2389 122.5770 54.4176 31.9299 175.6899 116 M 4.2679 8.1885 116.6920 54.8812 32.0494 177.1739 117 S 4.3120 8.4130 115.9963 58.2687 65.3820 175.3070 118 A 3.9464 8.4804 124.8421 55.3791 18.1852 179.6585 119 D 4.4692 8.1288 115.9735 57.1638 41.1887 178.3259 120 A 3.9108 8.0821 121.5941 55.3323 18.5560 179.0566 121 M 3.8746 8.1343 116.7844 58.8277 32.2663 178.3609 122 L 3.8691 8.3057 119.2247 57.6999 41.7758 179.4145 123 R 3.8137 7.8060 118.1867 59.5418 29.8636 178.0713 124 A 3.9674 8.3837 119.5754 55.3148 18.3518 178.9850 125 L 4.2811 7.8714 115.4464 55.9415 42.2491 178.1467 126 L 4.6360 7.8874 116.1052 51.2231 43.1878 179.0423 127 G 3.8827 8.8150 108.6552 46.2371 0.0000 174.8768 128 S 4.1497 9.3184 114.9275 61.4798 63.1999 176.3301 129 K 4.3128 7.6048 126.0255 54.8115 30.2548 175.6355 130 H 4.8990 7.7882 121.1568 53.7279 30.3372 172.5637 131 K 4.2390 7.7307 123.9149 53.3929 31.2162 174.4089 132 V 4.1517 7.1592 119.2243 61.4124 32.6763 174.8662 133 N 4.6993 8.4378 131.6537 51.4425 36.1625 175.8237 134 M 4.0025 7.7386 114.6621 57.4296 31.8686 174.5727 135 D 4.8598 8.2090 120.5140 53.4642 46.5515 174.4329 136 L 4.2298 7.8934 123.4477 54.7491 46.8376 173.1871 137 R 3.7271 7.7497 117.6133 56.1253 29.7303 176.1122 138 A 4.2873 8.2595 126.3097 51.5033 19.5825 175.4570 139 N 4.8781 8.3935 115.9221 51.9997 41.2455 173.3350 140 L 4.7622 7.9525 126.5553 53.2697 45.1541 175.5007 141 K 4.5371 8.0421 122.5968 54.7701 33.6097 173.9586 142 Q 4.0507 9.2548 126.8559 56.9360 27.7549 175.8896 143 V 3.9655 8.9598 115.8520 62.8698 31.6726 173.9218 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 3 E 8.29 4.17 0.00 2.01 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 2.30 2.25 0.00 4 E 7.69 3.43 0.00 2.34 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 2.30 2.42 0.00 5 K 7.45 3.95 0.00 1.93 2.00 0.00 1.62 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.53 7.81 6 K 8.14 4.12 0.00 1.97 2.10 0.00 1.56 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.49 1.43 7.81 7 R 7.74 3.75 0.00 1.87 2.08 0.00 3.11 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 8 R 8.16 3.93 0.00 1.93 1.98 0.00 3.23 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 9 A 8.22 3.99 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 7.87 4.09 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.94 3.77 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 1.21 0.00 0.00 12 A 7.71 4.02 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 R 7.82 3.93 0.00 2.12 2.00 0.00 3.36 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 14 R 8.11 3.90 0.00 2.03 2.01 0.00 3.13 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.76 0.00 15 Q 8.16 4.32 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.71 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 16 H 8.81 4.10 0.00 3.27 3.52 0.00 5.78 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 17 L 8.65 3.92 0.00 1.89 1.69 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 18 K 8.90 3.84 0.00 1.79 1.87 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.68 7.81 19 S 8.62 4.09 0.00 3.82 3.95 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 20 A 7.69 4.01 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 21 M 8.30 3.98 0.00 2.04 2.30 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 2.83 2.57 0.00 22 L 8.22 3.91 0.00 1.65 1.73 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.14 3.95 0.00 2.31 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 24 L 7.73 4.00 0.00 1.95 1.79 0.92 1.53 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 25 A 8.53 3.89 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 26 V 8.10 3.52 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 0.93 0.00 0.00 27 T 7.62 3.88 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 28 E 7.89 4.25 0.00 2.25 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 2.27 2.35 0.00 29 I 8.24 3.66 2.09 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 1.58 1.18 0.98 0.00 0.00 30 E 8.01 4.10 0.00 2.18 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 0.00 2.49 2.34 0.00 31 K 7.41 3.92 0.00 2.13 1.89 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.71 7.81 32 E 8.24 3.89 0.00 2.05 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 2.31 2.34 0.00 33 A 7.94 3.97 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 34 A 8.26 3.88 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 35 A 7.99 3.91 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 36 K 8.51 3.83 0.00 2.10 1.98 0.00 1.55 0.00 0.00 1.56 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.51 7.81 37 E 8.19 3.89 0.00 2.13 2.17 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 2.32 2.40 0.00 38 V 7.88 3.60 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.03 0.00 0.00 39 E 8.22 4.02 0.00 2.21 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 2.35 2.62 0.00 40 K 7.94 3.95 0.00 1.81 2.02 0.00 1.70 0.00 0.00 2.03 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.52 7.81 41 Q 8.31 4.22 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.61 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 42 N 8.03 4.37 0.00 2.98 2.88 0.00 0.00 6.43 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 43 Y 8.30 4.10 0.00 3.11 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 44 L 8.30 4.11 0.00 1.85 1.78 0.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 45 A 7.64 4.00 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 46 E 7.61 4.26 0.00 1.95 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 2.28 2.04 0.00 47 H 7.71 4.33 0.00 2.85 3.21 0.00 5.69 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 S 7.08 4.70 0.00 3.72 3.72 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 49 P 0.00 4.40 0.00 2.06 1.94 0.00 3.75 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.19 0.00 50 P 0.00 4.13 0.00 2.03 2.08 0.00 3.69 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 51 L 8.33 3.92 0.00 1.60 1.59 0.92 0.90 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 52 S 8.20 4.40 0.00 3.80 3.71 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 53 L 8.51 3.94 0.00 1.79 1.71 0.92 0.72 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 54 P 0.00 4.67 0.00 2.06 2.08 0.00 3.69 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 2.03 2.09 0.00 55 G 8.77 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 56 S 9.23 4.66 0.00 3.93 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 57 M 8.49 4.26 0.00 2.26 1.87 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.59 0.00 58 Q 9.47 4.07 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 59 E 8.24 4.06 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 60 L 7.94 3.92 0.00 1.70 1.78 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 61 Q 7.67 3.94 0.00 2.32 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 62 E 8.80 3.86 0.00 2.30 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 2.31 2.38 0.00 63 L 8.73 3.89 0.00 1.80 1.73 0.92 0.98 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 64 S 8.08 4.14 0.00 4.15 3.91 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 65 K 8.25 3.94 0.00 1.80 1.96 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.43 7.81 66 K 8.55 3.81 0.00 1.86 1.99 0.00 1.59 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.55 7.81 67 L 8.51 3.91 0.00 1.83 1.69 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 68 H 8.58 3.92 0.00 3.28 3.53 0.00 5.58 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 69 A 8.08 4.11 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 70 K 7.93 3.88 0.00 2.00 1.93 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.49 7.81 71 I 8.09 3.77 2.00 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 1.51 0.47 0.87 0.00 0.00 72 D 7.65 4.51 0.00 2.92 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 73 S 7.96 4.11 0.00 3.93 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 9.01 3.62 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 0.97 0.00 0.00 1.00 0.00 0.00 75 D 8.62 4.35 0.00 2.90 2.77 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 76 E 8.18 3.93 0.00 2.23 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 0.00 2.34 2.32 0.00 77 E 8.24 3.99 0.00 2.27 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 78 R 8.60 3.88 0.00 1.99 2.16 0.00 3.11 0.00 0.00 3.12 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 79 Y 8.49 3.92 0.00 3.09 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 80 D 8.82 4.48 0.00 2.86 2.77 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 81 T 8.12 3.81 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 1.18 0.00 0.00 82 E 8.24 3.84 0.00 1.92 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 2.07 2.20 0.00 83 V 7.67 3.43 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 0.96 0.00 0.00 0.40 0.00 0.00 84 K 8.07 4.13 0.00 1.96 1.82 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.43 7.81 85 L 7.80 3.86 0.00 1.84 1.68 0.88 0.48 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 86 Q 8.11 3.91 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.52 0.00 0.00 0.00 0.00 0.00 2.33 2.59 0.00 87 K 8.31 3.82 0.00 1.90 1.95 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.49 7.81 88 T 7.78 3.82 4.35 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 0.00 0.00 0.00 1.20 0.00 0.00 89 I 8.03 3.68 1.97 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 0.55 0.90 0.00 0.00 90 K 8.12 4.03 0.00 2.01 2.05 0.00 1.53 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.49 7.81 91 E 8.46 3.93 0.00 2.05 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 0.00 2.31 2.34 0.00 92 L 8.13 4.25 0.00 1.99 1.91 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 93 E 7.85 3.98 0.00 2.16 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 2.34 2.58 0.00 94 D 8.05 4.53 0.00 2.86 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.76 4.04 0.00 1.81 1.70 0.92 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 96 S 8.16 4.63 0.00 4.10 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 7.64 4.56 0.00 2.31 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 98 K 7.97 3.87 0.00 1.79 1.84 0.00 1.81 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.48 7.81 99 L 8.12 4.39 0.00 1.60 1.16 0.70 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.54 5.26 0.00 3.40 3.30 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 0.00 101 D 8.06 4.46 0.00 2.86 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 L 6.95 4.36 0.00 1.61 1.71 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 103 R 8.25 4.53 0.00 1.91 1.87 0.00 3.33 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 104 G 7.46 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 0.00 0.00 0.00 105 K 8.45 4.73 0.00 1.89 1.79 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.39 7.81 106 F 7.79 5.10 0.00 3.21 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 0.00 107 K 8.61 4.04 0.00 1.84 1.83 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.53 7.81 108 R 8.43 3.78 0.00 2.01 2.02 0.00 3.38 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 109 P 0.00 4.45 0.00 2.04 1.73 0.00 3.48 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.52 0.00 110 P 0.00 4.60 0.00 2.21 2.24 0.00 3.89 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 2.04 2.08 0.00 111 L 8.02 3.93 0.00 1.64 1.74 0.95 0.98 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 0.00 112 R 7.14 3.27 0.00 1.95 1.91 0.00 3.30 0.00 0.00 3.13 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.67 0.00 113 R 8.21 4.23 0.00 1.73 1.83 0.00 3.14 0.00 0.00 3.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 114 V 8.08 4.37 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 0.82 0.00 0.00 0.92 0.00 0.00 115 R 8.24 4.45 0.00 1.80 1.90 0.00 3.19 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 116 M 8.19 4.27 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 117 S 8.41 4.31 0.00 4.07 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 0.00 118 A 8.48 3.95 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 0.00 119 D 8.13 4.47 0.00 2.83 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 0.00 120 A 8.08 3.91 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 M 8.13 3.87 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 122 L 8.31 3.87 0.00 1.71 1.13 0.88 0.83 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 0.00 123 R 7.81 3.81 0.00 1.95 2.08 0.00 3.14 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 124 A 8.38 3.97 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 0.00 125 L 7.87 4.28 0.00 1.69 1.71 0.90 0.71 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 0.00 126 L 7.89 4.64 0.00 1.60 1.68 0.91 0.68 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 0.00 127 G 8.82 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 0.00 0.00 0.00 128 S 9.32 4.15 0.00 3.99 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 0.00 129 K 7.60 4.31 0.00 1.73 1.79 0.00 1.62 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.50 7.81 130 H 7.79 4.90 0.00 3.04 3.14 0.00 5.95 0.00 0.00 0.00 0.00 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 K 7.73 4.24 0.00 1.72 1.68 0.00 1.85 0.00 0.00 1.61 0.00 0.00 2.69 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.32 7.81 132 V 7.16 4.15 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 0.81 0.00 0.00 0.93 0.00 0.00 133 N 8.44 4.70 0.00 2.86 2.86 0.00 0.00 6.26 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 0.00 134 M 7.74 4.00 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.78 0.00 135 D 8.21 4.86 0.00 2.76 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 0.00 136 L 7.89 4.23 0.00 1.56 1.64 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 137 R 7.75 3.73 0.00 1.96 1.95 0.00 3.38 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.80 0.00 138 A 8.26 4.29 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 0.00 139 N 8.39 4.88 0.00 2.60 2.66 0.00 0.00 6.58 7.78 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 0.00 140 L 7.95 4.76 0.00 1.56 1.47 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 141 K 8.04 4.54 0.00 1.78 1.69 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.55 7.81 142 Q 9.25 4.05 0.00 2.01 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.85 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 143 V 8.96 3.97 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 0.84 0.00 0.00 0.93 0.00 0.00