NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4507 8.3049 120.3261 54.6131 33.4424 175.0142 1 I 3.6337 8.0101 121.4688 61.6879 37.6178 174.7552 2 Q 4.7930 9.2172 123.9408 55.2066 33.3238 173.6800 3 R 4.7527 9.0400 123.8866 54.4277 33.1131 175.3901 4 T 5.0105 8.8109 118.5818 60.2712 68.2811 172.3159 5 P 4.8562 0.0000 0.0000 62.9948 32.2613 175.9257 6 K 4.5616 9.4831 123.0373 55.7282 34.0297 175.7362 7 I 5.1272 8.2764 122.9522 59.7459 40.7012 174.9699 8 Q 4.6457 9.0963 124.2062 54.3395 32.7161 174.0481 9 V 5.0620 8.7275 124.6143 61.5062 33.2757 174.0541 10 Y 5.3481 8.6899 125.1123 56.4449 41.6631 173.5951 11 S 4.9435 8.9332 114.7118 57.0589 64.6841 174.2888 12 R 4.1294 8.9854 122.4783 59.1623 30.2520 176.2783 13 H 5.0952 8.3944 113.5067 52.6380 32.0104 171.8021 14 P 4.3565 0.0000 0.0000 62.7636 31.6092 176.3878 15 A 4.2984 8.7706 125.7611 52.0665 19.0921 176.6633 16 E 4.6470 8.6049 122.2917 54.1258 32.3347 175.2892 17 N 5.2251 8.3258 120.8411 54.7054 38.9337 175.3805 18 G 3.9206 9.0805 110.2475 45.1309 0.0000 172.6400 19 K 4.5701 7.5032 118.4041 53.8953 34.5743 176.4020 20 S 4.0684 8.6446 120.4035 59.9498 63.5277 173.4375 21 N 4.9570 8.7664 121.2753 53.0275 42.7210 172.1254 22 F 5.2098 8.9520 115.7785 55.7963 43.2337 173.7770 23 L 4.1223 8.7233 125.9900 53.5047 43.2942 174.8649 24 N 5.3933 8.9699 124.3097 51.5810 42.1982 173.2545 25 C 5.2284 9.3453 121.7232 55.4395 41.3863 172.0688 26 Y 5.3281 9.5117 129.6756 56.4711 40.0956 174.4633 27 V 5.0149 8.3887 121.0215 59.8545 34.3488 175.4224 28 S 5.4018 8.2866 118.3642 57.3068 67.0764 174.3695 29 G 4.5256 8.8168 105.1792 47.2556 0.0000 173.2450 30 F 5.5379 7.3302 114.0837 54.8927 41.2403 173.8744 31 H 5.1007 8.4646 114.6657 54.9094 32.9540 172.0079 32 P 4.9987 0.0000 0.0000 62.3794 32.1042 176.2267 33 S 4.0796 8.4899 113.2892 60.7532 63.0891 174.4669 34 D 4.3907 7.9559 121.3375 54.6133 40.8069 175.2548 35 I 4.5687 8.0007 123.0692 59.6413 41.4908 173.1164 36 E 4.4855 9.2439 130.2244 54.5255 31.3360 174.6158 37 V 4.5586 8.0124 126.6164 61.0498 33.9438 174.2116 38 D 4.9474 8.9979 127.2250 52.4354 45.1869 174.5064 39 L 4.9798 8.3832 121.2663 53.2298 44.1480 175.3210 40 L 5.1876 9.1250 123.5670 52.8040 45.1841 175.6433 41 K 4.1630 8.8201 123.8851 54.4455 34.5181 175.6738 42 N 3.8860 9.8613 127.7982 54.2496 36.4864 176.0986 43 G 3.9594 8.5017 106.9743 45.1213 0.0000 173.7498 44 E 4.4119 7.5882 120.8682 54.1860 30.8724 175.1147 45 R 4.3357 8.3672 126.0223 56.2840 30.6274 176.0033 46 I 4.0512 8.5919 127.5279 61.0768 37.9322 176.0646 47 E 4.0560 8.8961 125.3471 59.4295 29.6956 178.2078 48 K 4.1930 7.6777 120.9277 54.6784 30.6275 173.6199 49 V 4.4124 7.6279 119.8669 60.6630 33.8167 174.4470 50 E 4.5557 8.2772 127.3706 55.1922 32.4213 174.3450 51 H 5.8093 7.9619 114.5860 54.3102 31.1741 173.4490 52 S 4.5017 8.7897 115.2037 58.4290 63.9347 173.3369 53 D 4.5192 8.5237 120.5196 53.5301 41.2454 176.3376 54 L 3.9888 8.5006 125.6054 56.2378 42.6199 175.8491 55 S 4.6911 8.2720 119.3045 57.1223 66.7649 171.6357 56 F 5.1718 7.3258 115.6677 55.6144 41.3013 173.8597 57 S 4.7698 8.9627 115.9564 56.6099 64.5925 175.4955 58 K 3.5467 8.6295 120.3389 59.8833 31.5874 177.7115 59 D 4.5045 7.8637 115.0935 52.8129 39.3624 177.4775 60 W 3.6892 7.9351 119.7660 57.1338 28.5360 174.8667 61 S 4.2280 7.9611 114.2079 58.2684 63.8335 174.2729 62 F 5.0192 8.3787 121.6017 57.6569 40.3340 174.0254 63 Y 5.5119 8.3023 117.6729 56.1693 41.5631 173.7966 64 L 5.1877 9.4355 121.5309 53.1492 47.0444 174.8080 65 L 5.1986 9.7719 124.9947 53.8723 44.3697 174.5418 66 Y 5.1393 9.2321 124.9348 56.8429 40.2879 174.4679 67 Y 5.8142 8.3576 120.0954 57.1056 41.9019 173.3884 68 T 5.0334 8.3250 114.0035 60.6848 71.3622 172.3916 69 E 4.0560 8.6289 126.0725 56.1417 30.5664 175.7474 70 F 4.7049 8.7557 117.0253 56.5372 41.9966 173.1660 71 T 4.5401 8.0954 115.9689 60.4726 70.2973 172.1486 72 P 4.4010 0.0000 0.0000 63.3739 31.6569 175.4879 73 T 5.0259 8.7424 118.0510 59.9267 70.1718 174.6746 74 E 4.2068 8.9261 122.5652 58.3172 30.1165 177.7531 75 K 4.2416 7.9568 119.4518 57.8132 32.9991 176.4625 76 D 4.6950 7.5710 119.3710 54.0688 41.5698 175.1939 77 E 5.0319 8.8600 122.8282 54.9340 32.4875 174.7083 78 Y 5.7407 8.9514 118.8386 55.7267 42.9459 173.8142 79 A 5.0520 8.2386 121.0759 51.6691 23.4559 175.4339 80 C 5.2319 9.4646 118.9180 55.0244 46.2633 172.5155 81 R 5.0990 8.8583 127.3613 54.7476 31.6098 174.9140 82 V 4.8520 9.1968 126.8821 61.1059 35.1201 173.6592 83 N 5.2501 9.2000 124.6055 52.4300 42.5987 172.4457 84 H 4.9841 8.5359 123.1323 54.9992 33.1592 174.4949 85 V 3.5917 8.2223 115.5951 64.1710 31.7394 177.3123 86 T 4.4357 8.1053 108.6385 61.2006 69.0704 173.5862 87 L 5.0226 7.8670 122.8162 52.9164 44.1393 176.7668 88 S 4.2910 8.9297 119.0751 60.6056 63.2745 174.2164 89 Q 4.6113 7.5263 115.7841 52.7955 31.5863 172.4980 90 P 4.3897 0.0000 0.0000 63.3923 32.2083 175.4739 91 K 4.4955 9.3449 125.1542 54.8843 34.0926 174.7843 92 I 4.9514 8.4134 128.1356 59.5444 39.5513 174.9494 93 V 4.4437 8.8658 127.7565 60.8938 33.7586 174.9760 94 K 4.7700 8.7334 127.2710 55.8335 33.1203 176.4129 95 W 4.6894 9.0933 134.5385 57.2195 31.8156 175.1982 96 D 4.3674 8.3184 125.0769 52.1473 42.7918 176.1257 97 R 3.6064 7.9396 125.9725 58.2448 30.2231 176.8229 98 D 4.9765 7.7727 116.4460 53.8985 41.4055 176.1623 99 M 4.3747 8.2549 125.2471 55.8117 33.2092 174.8313 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 0 M 8.30 4.45 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.56 0.00 1 I 8.01 3.63 1.78 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 1.39 0.54 0.84 0.00 0.00 2 Q 9.22 4.79 0.00 1.93 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.69 0.00 0.00 0.00 0.00 0.00 2.33 2.60 0.00 3 R 9.04 4.75 0.00 1.91 2.16 0.00 3.20 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 4 T 8.81 5.01 4.29 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 1.25 0.00 0.00 5 P 0.00 4.86 0.00 1.96 1.72 0.00 3.76 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.75 0.00 6 K 9.48 4.56 0.00 1.75 1.82 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.48 7.81 7 I 8.28 5.13 1.91 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 1.32 0.61 0.96 0.00 0.00 8 Q 9.10 4.65 0.00 2.32 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 9 V 8.73 5.06 2.33 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 0.96 0.00 0.00 1.12 0.00 0.00 10 Y 8.69 5.35 0.00 3.22 3.14 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 11 S 8.93 4.94 0.00 4.25 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 12 R 8.99 4.13 0.00 1.84 2.25 0.00 3.20 0.00 0.00 3.06 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.47 0.00 13 H 8.39 5.10 0.00 3.24 3.22 0.00 5.72 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.36 0.00 2.11 2.07 0.00 3.78 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 2.09 2.17 0.00 15 A 8.77 4.30 1.66 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 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.60 4.65 0.00 1.99 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 17 N 8.33 5.23 0.00 2.73 2.81 0.00 0.00 7.39 7.65 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 18 G 9.08 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 0.00 0.00 0.00 19 K 7.50 4.57 0.00 1.70 1.65 0.00 1.86 0.00 0.00 1.68 0.00 0.00 2.71 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.34 7.81 20 S 8.64 4.07 0.00 3.68 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 21 N 8.77 4.96 0.00 2.62 2.33 0.00 0.00 6.69 7.36 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 22 F 8.95 5.21 0.00 3.02 2.88 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 23 L 8.72 4.12 0.00 0.27 0.67 -0.36 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.97 5.39 0.00 1.57 2.11 0.00 0.00 5.94 5.12 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 25 C 9.35 5.23 0.00 2.92 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 26 Y 9.51 5.33 0.00 3.41 3.17 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 27 V 8.39 5.01 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 0.57 0.00 0.00 1.12 0.00 0.00 28 S 8.29 5.40 0.00 3.93 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.82 4.53 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 0.00 0.00 0.00 30 F 7.33 5.54 0.00 3.02 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 31 H 8.46 5.10 0.00 3.26 3.20 0.00 5.67 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 5.00 0.00 2.16 2.19 0.00 3.92 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 33 S 8.49 4.08 0.00 3.34 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 34 D 7.96 4.39 0.00 2.65 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 35 I 8.00 4.57 1.55 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.50 0.82 0.00 0.00 36 E 9.24 4.49 0.00 1.95 1.86 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 2.11 2.16 0.00 37 V 8.01 4.56 0.67 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 0.26 0.00 0.00 0.41 0.00 0.00 38 D 9.00 4.95 0.00 2.49 2.44 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 39 L 8.38 4.98 0.00 1.56 1.52 0.90 0.51 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 40 L 9.13 5.19 0.00 1.53 1.52 0.91 0.49 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 41 K 8.82 4.16 0.00 1.79 1.60 0.00 1.94 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.05 0.65 7.81 42 N 9.86 3.89 0.00 2.76 2.82 0.00 0.00 7.18 7.69 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 43 G 8.50 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 44 E 7.59 4.41 0.00 2.01 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 45 R 8.37 4.34 0.00 1.79 1.82 0.00 3.60 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 46 I 8.59 4.05 1.93 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.82 0.92 0.00 0.00 47 E 8.90 4.06 0.00 1.95 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 2.31 2.29 0.00 48 K 7.68 4.19 0.00 1.70 1.72 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.39 7.81 49 V 7.63 4.41 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 0.97 0.00 0.00 0.99 0.00 0.00 50 E 8.28 4.56 0.00 1.16 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.04 0.00 51 H 7.96 5.81 0.00 2.22 1.80 0.00 5.34 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.79 4.50 0.00 4.01 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.52 4.52 0.00 2.71 2.66 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 0.00 0.00 0.00 0.00 54 L 8.50 3.99 0.00 1.60 1.61 0.74 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.27 4.69 0.00 3.75 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 56 F 7.33 5.17 0.00 2.96 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 S 8.96 4.77 0.00 4.14 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 58 K 8.63 3.55 0.00 1.64 1.75 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.37 7.81 59 D 7.86 4.50 0.00 2.79 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 60 W 7.94 3.69 0.00 3.29 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 61 S 7.96 4.23 0.00 3.80 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 62 F 8.38 5.02 0.00 1.58 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 63 Y 8.30 5.51 0.00 2.92 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 64 L 9.44 5.19 0.00 1.90 1.67 1.23 0.22 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 65 L 9.77 5.20 0.00 2.03 1.72 1.15 0.04 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 66 Y 9.23 5.14 0.00 3.17 2.88 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 67 Y 8.36 5.81 0.00 3.11 3.22 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 0.00 0.00 0.00 68 T 8.33 5.03 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 1.05 0.00 0.00 69 E 8.63 4.06 0.00 1.63 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 70 F 8.76 4.70 0.00 2.89 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 71 T 8.10 4.54 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 1.10 0.00 0.00 72 P 0.00 4.40 0.00 2.32 2.27 0.00 3.29 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.79 0.00 73 T 8.74 5.03 4.48 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 1.42 0.00 0.00 74 E 8.93 4.21 0.00 2.15 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 2.30 2.32 0.00 75 K 7.96 4.24 0.00 1.76 1.90 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.46 7.81 76 D 7.57 4.69 0.00 3.17 2.44 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 77 E 8.86 5.03 0.00 1.90 1.87 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 2.28 2.27 0.00 78 Y 8.95 5.74 0.00 3.03 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 79 A 8.24 5.05 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 80 C 9.46 5.23 0.00 2.92 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 81 R 8.86 5.10 0.00 1.89 1.72 0.00 3.05 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 82 V 9.20 4.85 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 0.70 0.00 0.00 0.81 0.00 0.00 83 N 9.20 5.25 0.00 2.77 2.51 0.00 0.00 6.57 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 84 H 8.54 4.98 0.00 3.05 2.99 0.00 5.74 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.22 3.59 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 0.70 0.00 0.00 0.84 0.00 0.00 86 T 8.11 4.44 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 1.37 0.00 0.00 87 L 7.87 5.02 0.00 1.71 1.74 0.89 0.74 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 88 S 8.93 4.29 0.00 3.97 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 89 Q 7.53 4.61 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.89 0.00 0.00 0.00 0.00 0.00 2.21 2.35 0.00 90 P 0.00 4.39 0.00 1.93 2.02 0.00 3.64 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.32 0.00 91 K 9.34 4.50 0.00 1.82 1.76 0.00 1.47 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.43 7.81 92 I 8.41 4.95 1.88 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 1.22 0.77 0.93 0.00 0.00 93 V 8.87 4.44 2.14 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 1.06 0.00 0.00 0.97 0.00 0.00 94 K 8.73 4.77 0.00 1.74 1.80 0.00 1.82 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.50 1.48 7.81 95 W 9.09 4.69 0.00 3.31 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 96 D 8.32 4.37 0.00 2.60 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 97 R 7.94 3.61 0.00 1.59 1.82 0.00 3.09 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 1.02 0.00 98 D 7.77 4.98 0.00 2.58 2.60 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 99 M 8.25 4.37 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00