NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8289 8.3393 109.7364 45.2364 0.0000 176.2112 2 S 4.2414 9.1436 123.7748 55.2528 63.7685 172.8756 3 S 4.1584 8.6831 121.9738 58.2165 62.4956 173.1432 4 G 4.1972 9.2998 119.5643 45.6995 0.0000 171.7134 5 S 4.6489 8.1272 116.3327 56.5061 67.2233 174.1073 6 S 4.1571 8.0609 117.4321 62.9338 62.3942 173.0898 7 G 3.8391 8.0010 103.6770 43.4224 0.0000 171.4008 8 P 4.4377 0.0000 0.0000 61.6953 32.1158 174.1520 9 P 4.7689 0.0000 0.0000 62.4119 31.8283 175.9517 10 V 4.3248 8.0553 123.0552 59.8972 34.3523 174.9553 11 I 4.6071 8.4786 127.0478 60.3877 36.1704 176.2921 12 R 4.0451 8.5011 127.3345 58.7023 30.6248 177.4510 13 Q 4.2292 7.4678 116.5945 54.7824 32.3565 173.5706 14 G 3.8348 7.0939 111.3459 44.0436 0.0000 170.2464 15 P 4.6043 0.0000 0.0000 63.0339 32.1681 176.4740 16 V 4.8072 8.2646 114.5483 59.2039 35.1762 175.0271 17 N 5.1033 9.3956 120.8553 53.6372 39.0278 174.2771 18 Q 4.6208 8.5131 120.5788 54.7578 32.5969 173.8650 19 T 4.5100 8.4409 117.7258 62.6330 70.1001 174.3047 20 V 4.5900 8.5129 124.3025 61.0733 35.8222 174.3518 21 A 5.0701 8.4486 126.5975 50.6791 20.6696 176.9164 22 V 3.8423 8.3328 119.9700 63.8894 32.3298 174.8838 23 D 4.5501 8.8520 123.1281 55.0656 41.3542 174.5399 24 G 4.1897 7.4787 113.0143 44.6835 0.0000 176.4516 25 T 4.6560 8.2185 121.9276 62.7584 71.6932 172.1306 26 F 4.8674 8.3313 122.9488 54.9183 40.1683 174.9314 27 V 4.0789 8.3097 122.7163 61.2537 33.8459 174.8028 28 L 4.8965 8.1288 124.7577 53.1975 46.1700 175.2584 29 S 4.9937 8.9462 117.9901 56.5617 66.1919 173.2275 30 C 5.1163 8.4465 123.7041 54.7359 42.7298 172.8983 31 V 4.5534 8.7482 126.4745 61.1506 33.4056 174.1867 32 A 5.1684 8.5731 127.4521 51.4637 22.0312 175.5826 33 T 4.2952 9.0114 111.0253 60.1919 72.2200 172.2660 34 G 3.8040 8.1526 107.2470 43.7306 0.0000 172.9121 35 S 4.9277 8.3400 119.7490 55.3690 64.7408 172.4088 36 P 4.4649 0.0000 0.0000 61.4970 32.0262 175.7769 37 V 3.9750 8.5041 117.2767 61.9409 31.6281 173.8062 38 P 4.5965 0.0000 0.0000 63.1730 32.5124 175.8038 39 T 4.2553 8.1288 118.1346 62.9626 69.6760 174.0096 40 I 4.3247 8.2912 128.4539 60.5388 37.8613 175.4995 41 L 4.6599 8.1142 127.3341 52.7504 45.3174 175.3632 42 W 5.6233 8.2608 117.4039 54.5762 33.7372 174.9384 43 R 5.1647 8.8897 120.7267 54.7070 34.6467 173.6444 44 K 4.0522 9.3146 124.9844 54.7448 34.5468 175.4954 45 D 4.1887 8.8923 127.1541 55.3946 40.1101 173.4536 46 G 3.8896 8.5088 101.3781 46.0022 0.0000 174.1881 47 V 4.4622 7.4457 117.4618 59.9960 34.7104 174.6792 48 L 4.3636 8.5228 125.6124 54.4462 41.7810 177.6463 49 V 3.7803 8.0180 123.7904 62.5826 31.9746 176.9979 50 S 4.6068 8.2930 118.2151 57.7345 61.9933 174.9071 51 T 4.5855 7.8842 127.4871 63.6254 67.5124 175.1153 52 Q 4.4807 7.6747 118.7006 56.0835 32.1381 176.3092 53 D 4.5933 7.7298 117.8235 53.1116 41.8813 176.8841 54 S 4.1002 8.9101 121.3122 61.8477 63.2364 175.7213 55 R 4.2460 8.3541 119.4562 59.1816 30.7341 176.6823 56 I 4.7604 7.8205 119.4873 59.8805 38.1466 175.3619 57 K 4.6208 8.8093 127.6099 54.8201 36.3880 175.0801 58 Q 4.9186 8.4693 123.7629 53.8048 29.3861 175.8591 59 L 4.0566 8.7265 124.5904 57.2307 42.1972 176.8884 60 E 4.7551 7.6741 115.9828 53.7469 32.8602 174.2663 61 N 4.5314 8.5768 117.4710 54.7454 36.5399 175.4953 62 G 3.8901 9.0739 112.4933 44.9157 0.0000 171.7110 63 V 4.4522 7.4653 120.7380 61.6593 32.5901 174.3941 64 L 4.9050 8.4728 130.3629 53.2818 45.4015 174.7864 65 Q 4.2019 8.5730 124.6167 54.2848 32.6390 173.6409 66 I 4.5660 7.3086 126.5340 59.6174 39.3317 174.9926 67 R 3.9905 8.4821 126.3894 55.2353 31.4868 175.9608 68 Y 3.2281 7.8089 116.1459 59.0011 35.1813 171.6205 69 A 4.4928 7.6346 122.2358 51.8644 18.7274 177.9801 70 K 4.6472 8.7456 121.6901 56.0583 33.6349 178.5198 71 L 4.0082 8.5755 120.3413 58.0867 41.5723 179.8575 72 G 3.8257 7.9537 105.1783 47.3144 0.0000 174.0747 73 D 4.4551 8.4614 120.5920 56.7306 41.0954 174.2418 74 T 4.0481 7.3205 116.0321 64.0929 68.6576 173.1443 75 G 4.2424 8.6859 112.8238 45.1208 0.0000 168.9171 76 R 5.1031 8.5212 118.3709 54.9043 31.3497 175.7239 77 Y 4.9692 8.7793 122.5624 57.0904 40.1058 175.1804 78 T 5.1812 8.6772 117.8383 62.2904 73.4428 173.4298 79 C 4.7868 8.5107 124.9560 54.6543 43.0508 172.3276 80 I 5.0814 7.7866 123.3959 59.4708 41.0728 173.8250 81 A 5.1318 9.1978 129.2641 49.5471 20.9133 174.7577 82 S 5.1355 8.5496 117.6520 57.3357 64.6132 173.0491 83 T 4.8795 8.6918 116.1484 59.3869 72.3384 172.8562 84 P 4.5673 0.0000 0.0000 64.1724 31.4552 176.8289 85 S 4.6037 7.9362 114.0366 58.0992 65.4272 173.7769 86 G 3.9495 6.9612 106.2131 46.1847 0.0000 170.6008 87 E 5.7899 8.6270 118.1187 55.3188 32.7194 175.0213 88 A 4.9995 8.5545 126.3118 50.6928 23.3631 174.4030 89 T 5.4724 8.3542 107.9369 58.8663 72.2062 172.4048 90 W 5.2640 8.6327 130.2169 55.6487 34.8617 173.3000 91 S 5.0412 6.7573 117.4348 56.6823 64.6118 173.2978 92 A 4.7251 8.1082 120.9715 51.4325 23.2878 174.4809 93 Y 5.1892 8.7185 122.3943 55.8670 42.3151 174.0081 94 I 4.6001 8.4725 125.8915 59.2521 40.7197 173.8852 95 E 4.5113 7.9107 126.9071 54.1282 32.2236 174.4636 96 V 4.8664 7.9266 126.2837 61.2146 33.5748 174.6090 97 Q 4.5875 8.7439 126.5760 53.8050 31.9162 174.6480 98 E 4.3263 8.4762 124.7332 56.2008 30.7208 176.1236 99 F 4.6646 8.7460 121.9598 58.2736 42.9052 174.5145 100 G 3.9754 9.4454 113.8223 45.3306 0.0000 172.6673 101 V 4.3035 7.3261 118.8834 59.8938 33.1801 173.6891 102 P 4.5338 0.0000 0.0000 61.7038 32.1399 176.0571 103 V 3.6872 8.2086 118.4875 62.1813 31.3374 176.5767 104 Q 4.4910 8.2636 125.1284 52.9309 28.2770 173.2993 105 P 4.5125 0.0000 0.0000 61.0270 32.5886 175.1035 106 P 4.5002 0.0000 0.0000 62.3451 31.9455 176.1238 107 R 4.1921 8.1647 118.3346 54.9932 30.6639 176.1166 108 P 4.4994 0.0000 0.0000 62.8878 29.4683 174.6625 109 T 4.5301 7.9663 115.7930 60.3219 70.8936 174.7331 110 D 4.8164 8.2246 123.7369 51.3125 41.2366 175.2408 111 P 4.4182 0.0000 0.0000 63.4047 31.2250 175.7975 112 N 4.2470 7.8892 116.7478 54.5860 37.4789 174.0553 113 L 4.3232 7.7738 117.0323 54.2043 41.5909 176.0696 114 I 3.8539 7.9807 112.2477 60.0703 37.9397 174.1665 115 P 4.3809 0.0000 0.0000 62.6781 31.9585 175.4926 116 S 4.4233 8.3164 113.9295 56.7067 62.3653 173.2547 117 A 4.0010 8.3777 132.0718 55.0412 18.6509 175.1502 118 P 4.4232 0.0000 0.0000 62.8047 31.4410 176.3824 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 1 G 8.34 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 0.00 0.00 0.00 2 S 9.14 4.24 0.00 4.03 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 3 S 8.68 4.16 0.00 3.85 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 G 9.30 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.13 4.65 0.00 3.81 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 6 S 8.06 4.16 0.00 3.96 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 7 G 8.00 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 8 P 0.00 4.44 0.00 2.20 2.07 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 9 P 0.00 4.77 0.00 2.09 2.09 0.00 3.31 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 10 V 8.06 4.32 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 0.79 0.00 0.00 0.96 0.00 0.00 11 I 8.48 4.61 2.02 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.23 0.72 0.00 0.00 12 R 8.50 4.05 0.00 1.73 1.94 0.00 3.37 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.53 0.00 13 Q 7.47 4.23 0.00 1.90 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.48 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 14 G 7.09 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 0.00 0.00 0.00 15 P 0.00 4.60 0.00 2.37 2.34 0.00 3.44 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 16 V 8.26 4.81 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.99 0.00 0.00 17 N 9.40 5.10 0.00 2.65 2.88 0.00 0.00 7.25 7.82 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 18 Q 8.51 4.62 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.17 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 19 T 8.44 4.51 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 20 V 8.51 4.59 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 0.96 0.00 0.00 0.96 0.00 0.00 21 A 8.45 5.07 1.35 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 0.00 0.00 0.00 22 V 8.33 3.84 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 0.71 0.00 0.00 0.92 0.00 0.00 23 D 8.85 4.55 0.00 2.80 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 24 G 7.48 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.22 4.66 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 1.06 0.00 0.00 26 F 8.33 4.87 0.00 2.91 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 27 V 8.31 4.08 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 0.72 0.00 0.00 0.80 0.00 0.00 28 L 8.13 4.90 0.00 0.95 1.63 0.32 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.95 4.99 0.00 3.87 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 30 C 8.45 5.12 0.00 2.94 2.79 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 31 V 8.75 4.55 2.12 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 0.92 0.00 0.00 0.86 0.00 0.00 32 A 8.57 5.17 1.14 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 0.00 0.00 33 T 9.01 4.30 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 34 G 8.15 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.34 4.93 0.00 3.95 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.46 0.00 2.19 2.11 0.00 3.80 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 1.98 1.94 0.00 37 V 8.50 3.98 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 1.02 0.00 0.00 0.92 0.00 0.00 38 P 0.00 4.60 0.00 2.07 2.01 0.00 3.79 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.10 0.00 39 T 8.13 4.26 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 1.19 0.00 0.00 40 I 8.29 4.32 1.77 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.18 0.47 0.00 0.00 41 L 8.11 4.66 0.00 1.46 1.54 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 42 W 8.26 5.62 0.00 3.35 3.15 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 0.00 43 R 8.89 5.16 0.00 1.78 1.81 0.00 3.10 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.68 0.00 44 K 9.31 4.05 0.00 1.50 1.56 0.00 1.38 0.00 0.00 0.86 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.22 1.27 7.81 45 D 8.89 4.19 0.00 2.80 2.65 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 46 G 8.51 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 47 V 7.45 4.46 2.24 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 1.09 0.00 0.00 0.99 0.00 0.00 48 L 8.52 4.36 0.00 1.71 1.66 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 49 V 8.02 3.78 2.37 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 0.93 0.00 0.00 1.05 0.00 0.00 50 S 8.29 4.61 0.00 3.94 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 51 T 7.88 4.59 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 1.26 0.00 0.00 52 Q 7.67 4.48 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.93 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 53 D 7.73 4.59 0.00 2.90 2.56 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 0.00 54 S 8.91 4.10 0.00 4.03 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 55 R 8.35 4.25 0.00 1.85 2.24 0.00 3.36 0.00 0.00 3.42 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.89 0.00 56 I 7.82 4.76 1.87 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.36 0.85 0.00 0.00 57 K 8.81 4.62 0.00 1.77 1.53 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.40 7.81 58 Q 8.47 4.92 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.97 0.00 0.00 0.00 0.00 0.00 2.51 2.27 0.00 59 L 8.73 4.06 0.00 1.62 1.70 0.91 0.86 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 60 E 7.67 4.76 0.00 1.99 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 61 N 8.58 4.53 0.00 2.83 2.87 0.00 0.00 6.05 7.00 0.00 0.00 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 9.07 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 63 V 7.47 4.45 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 0.90 0.00 0.00 1.01 0.00 0.00 64 L 8.47 4.90 0.00 1.71 0.69 0.90 -0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 8.57 4.20 0.00 1.96 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.41 0.00 0.00 0.00 0.00 0.00 1.98 2.11 0.00 66 I 7.31 4.57 0.56 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.24 1.01 0.00 0.00 67 R 8.48 3.99 0.00 1.59 0.99 0.00 3.30 0.00 0.00 3.05 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.45 0.00 68 Y 7.81 3.23 0.00 3.17 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 69 A 7.63 4.49 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 70 K 8.75 4.65 0.00 2.08 1.77 0.00 1.71 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.57 1.76 7.81 71 L 8.58 4.01 0.00 1.70 1.71 0.93 0.83 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 72 G 7.95 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 0.00 0.00 0.00 73 D 8.46 4.46 0.00 2.94 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 T 7.32 4.05 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 1.43 0.00 0.00 75 G 8.69 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 0.00 0.00 0.00 0.00 76 R 8.52 5.10 0.00 1.77 1.96 0.00 2.75 0.00 0.00 3.20 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.39 0.00 77 Y 8.78 4.97 0.00 3.15 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.68 5.18 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 1.32 0.00 0.00 79 C 8.51 4.79 0.00 2.32 2.90 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 80 I 7.79 5.08 1.80 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 1.27 0.44 0.89 0.00 0.00 81 A 9.20 5.13 1.17 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 0.00 0.00 82 S 8.55 5.14 0.00 3.88 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 83 T 8.69 4.88 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 84 P 0.00 4.57 0.00 2.20 2.20 0.00 3.71 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 1.98 1.98 0.00 85 S 7.94 4.60 0.00 3.92 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 86 G 6.96 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 0.00 0.00 0.00 87 E 8.63 5.79 0.00 1.94 1.77 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 2.25 2.15 0.00 88 A 8.55 5.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 T 8.35 5.47 4.38 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 1.22 0.00 0.00 90 W 8.63 5.26 0.00 3.42 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 S 6.76 5.04 0.00 3.75 3.55 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 0.00 0.00 0.00 0.00 92 A 8.11 4.73 1.61 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 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 8.72 5.19 0.00 3.01 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 I 8.47 4.60 1.58 0.00 0.00 0.81 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 0.67 0.30 0.00 0.00 95 E 7.91 4.51 0.00 1.80 1.55 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 0.00 2.16 2.19 0.00 96 V 7.93 4.87 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 1.01 0.00 0.00 0.81 0.00 0.00 97 Q 8.74 4.59 0.00 2.09 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.85 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 98 E 8.48 4.33 0.00 1.84 1.61 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 0.00 2.22 2.29 0.00 99 F 8.75 4.66 0.00 3.07 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.45 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 0.00 101 V 7.33 4.30 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 0.89 0.00 0.00 0.96 0.00 0.00 102 P 0.00 4.53 0.00 2.22 2.07 0.00 3.84 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 1.99 1.96 0.00 103 V 8.21 3.69 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 0.83 0.00 0.00 0.93 0.00 0.00 104 Q 8.26 4.49 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.08 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 105 P 0.00 4.51 0.00 2.17 2.07 0.00 3.79 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 106 P 0.00 4.50 0.00 2.20 2.10 0.00 3.75 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 1.98 1.98 0.00 107 R 8.16 4.19 0.00 1.82 1.89 0.00 3.21 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 108 P 0.00 4.50 0.00 2.17 2.10 0.00 3.74 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 109 T 7.97 4.53 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 1.25 0.00 0.00 110 D 8.22 4.82 0.00 2.91 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 P 0.00 4.42 0.00 2.20 2.20 0.00 3.85 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 1.98 1.95 0.00 112 N 7.89 4.25 0.00 2.84 2.97 0.00 0.00 7.13 7.63 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 0.00 113 L 7.77 4.32 0.00 1.79 1.70 0.92 0.73 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 0.00 114 I 7.98 3.85 1.87 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 1.47 0.59 0.91 0.00 0.00 115 P 0.00 4.38 0.00 2.20 2.09 0.00 3.75 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 1.98 1.95 0.00 116 S 8.32 4.42 0.00 3.84 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 A 8.38 4.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 P 0.00 4.42 0.00 2.19 2.05 0.00 3.80 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 1.98 1.96 0.00