NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.7496 8.4449 117.7994 54.5434 30.2695 173.9102 2 K 4.2414 7.6218 116.9160 55.9554 36.2209 173.9194 3 C 4.9174 9.2601 117.8260 55.7285 42.1829 173.0571 4 D 5.1139 8.1687 121.7117 52.3864 43.4700 177.5548 5 I 3.7626 8.3710 121.3898 64.9825 36.9679 178.5235 6 T 3.9032 8.0802 116.3371 66.9186 68.2275 175.9606 7 L 4.0656 7.7475 120.1626 58.4212 40.6964 179.2189 8 Q 3.8963 8.1170 118.5581 58.8333 28.7188 177.9694 9 E 3.9043 8.2599 119.5029 59.6975 29.4760 179.1525 10 I 3.5855 7.7595 119.3369 64.9827 37.2132 178.3642 11 I 3.4911 7.9537 120.4139 64.1488 36.7490 178.4204 12 K 3.7943 8.0201 120.5040 59.8184 31.8958 179.0105 13 T 3.6605 7.8572 115.9469 66.3901 68.2476 176.5922 14 L 3.8843 8.0340 121.1097 58.1364 41.6893 178.4623 15 N 4.0730 8.1381 116.4365 57.6297 38.5787 176.2395 16 S 4.2217 8.2167 114.8893 59.6921 63.2117 175.7250 17 L 4.2408 7.3594 123.0538 57.1533 41.7632 178.6942 18 T 3.8998 7.8522 114.8000 66.8405 68.4575 174.9209 19 E 4.3363 7.9930 117.5892 57.2983 29.6537 177.0491 20 Q 4.5853 8.3307 119.3020 55.0550 30.0276 174.8408 21 K 4.5212 7.6800 116.9469 55.1899 33.5360 174.3062 22 T 4.0940 7.3035 125.4510 62.8261 74.9971 173.7207 23 L 4.2253 8.0906 126.4508 57.2691 42.8932 178.6678 24 C 5.0669 8.1349 113.8447 56.7202 40.8902 173.8463 25 T 4.2309 7.7444 110.8958 61.4731 70.1791 172.7359 26 E 4.3675 8.8807 122.7928 56.2170 29.2996 173.9664 27 L 4.2025 7.7370 116.6877 54.7995 42.9937 176.9292 28 T 4.5886 8.6235 113.5184 61.9888 69.4556 174.0003 29 V 4.6295 8.7386 118.6464 59.0071 36.5579 175.0356 30 T 3.9754 8.4656 118.6563 64.0978 68.7171 175.3311 31 D 4.8030 8.5749 128.9276 53.0239 39.4128 176.5026 32 I 4.0966 7.4401 109.4958 60.9219 37.6556 177.5235 33 F 4.8871 8.3557 119.2438 57.9364 40.6187 175.8686 34 A 4.6306 7.7914 122.4805 51.4093 19.0805 177.0276 35 A 4.1629 7.9778 122.7555 53.6658 21.0581 178.9324 36 S 3.6649 8.1393 122.6780 60.7036 60.1351 173.4941 37 K 4.3277 7.5205 119.2426 57.4576 32.9226 178.2306 38 N 4.4966 7.8898 114.7170 54.5021 38.3356 174.9723 39 T 3.9619 7.0606 113.0387 61.9905 67.8774 173.1775 40 T 4.0363 8.1766 118.7618 63.1460 69.2321 175.4572 41 E 3.5647 8.8940 124.8296 59.7997 29.2483 180.0831 42 K 4.0609 7.8568 117.6179 59.3216 32.1318 178.8591 43 E 3.8965 8.2387 119.5948 59.5874 29.5704 178.4004 44 T 3.7916 7.9080 112.6518 65.6414 67.1131 175.6148 45 F 4.5764 8.4228 119.7770 60.7183 38.9635 176.5985 46 C 4.1278 8.5462 118.6478 59.7795 41.7561 175.5735 47 R 3.7804 8.7169 120.3847 59.4129 29.5231 178.5141 48 A 4.3319 8.3962 120.7479 54.5557 18.4231 179.4161 49 A 3.7275 7.9725 119.7048 55.7989 18.3539 179.6970 50 T 4.1152 7.6780 113.5846 67.3823 68.4374 177.0687 51 V 3.6636 7.3296 111.1885 64.2355 31.5235 178.5872 52 L 3.8700 7.5687 118.8051 57.9051 41.3505 178.9061 53 R 4.1599 8.2165 118.9705 59.6280 30.0372 178.3242 54 Q 4.1828 8.5021 117.8885 59.6875 28.8495 177.9775 55 F 4.2288 8.8309 122.9586 60.5226 39.0451 176.2652 56 Y 4.1249 8.8715 117.7570 60.2514 37.9638 179.1421 57 S 3.6739 7.5052 116.2310 61.0767 63.1688 175.7303 58 H 4.1559 7.6102 119.5358 59.8254 29.7026 176.5903 59 H 3.8444 8.6206 118.0369 58.9605 28.3598 176.9051 60 E 3.9092 8.4228 117.8701 58.5669 29.8915 176.0598 61 K 4.4952 12.0000 121.5268 54.5037 35.4080 176.3128 62 D 4.2663 9.9778 127.1432 55.4857 39.6014 173.9373 63 T 3.3815 7.3740 109.5180 64.1654 67.4146 172.3305 64 R 4.7110 7.1702 121.3631 53.6593 28.3711 175.2417 65 C 4.3083 8.7429 117.2494 55.7544 42.7800 173.8335 66 L 3.8138 7.6141 118.7800 57.0117 41.2346 178.6276 67 G 3.8773 8.0744 105.3015 44.2422 0.0000 173.1257 68 A 4.1395 7.9710 124.0089 52.9438 17.7152 179.2472 69 T 4.0517 7.9213 112.5378 66.9614 66.7301 175.1221 70 A 3.7499 7.1869 124.4513 54.2513 20.2916 179.4726 71 Q 3.9324 12.0000 118.4704 59.4655 29.2240 178.1805 72 Q 4.1335 8.2142 118.4722 58.9183 28.6846 178.5759 73 F 4.5540 7.8291 121.9487 61.6917 39.3307 176.5481 74 H 4.0252 8.3542 117.9147 59.1167 29.5370 177.2967 75 R 4.2867 7.8780 121.4233 59.1151 30.0691 177.3622 76 H 4.0309 8.2453 118.1710 59.6153 29.7534 176.9964 77 K 3.8946 8.0886 119.7733 59.4107 31.7239 178.8448 78 Q 3.9340 8.1677 119.7808 59.4796 28.9737 178.3836 79 L 4.1327 8.4226 120.0402 58.0954 41.7544 179.3557 80 I 3.9059 8.0110 119.5180 64.9107 37.1115 178.4507 81 R 3.8042 8.4342 119.6811 59.2833 29.8415 178.6024 82 F 4.1629 8.0475 117.7074 60.3930 38.8937 177.7561 83 L 4.0621 8.6491 119.0299 57.4698 41.3241 179.5031 84 K 2.5960 7.3743 119.6668 58.9083 32.0361 178.8735 85 R 3.8434 7.4531 117.8324 59.3742 29.9919 178.5145 86 L 3.8826 8.2019 120.2624 58.5377 41.8015 178.3329 87 D 4.2721 8.3144 118.1244 57.4984 41.0868 178.4061 88 R 4.3485 8.2830 118.4635 58.4382 30.1382 177.4725 89 N 4.9385 8.0840 114.5564 53.2952 39.8542 176.0457 90 L 3.8674 7.9483 120.6495 58.1063 41.6018 178.8125 91 W 4.5180 7.4938 119.2196 60.0585 28.7897 178.8050 92 G 3.6419 8.1376 104.0432 47.5792 0.0000 175.0162 93 L 4.1914 7.3717 120.1256 57.5431 42.1318 178.3851 94 A 4.3960 8.2748 121.2906 54.2956 18.5483 177.3546 95 G 4.1784 8.2759 108.4230 46.2371 0.0000 174.5327 96 L 4.4484 7.7040 120.5589 54.3248 43.5335 176.0646 97 N 5.1103 8.1499 117.8773 51.3956 38.8150 176.4622 98 S 4.5193 7.7576 110.6046 58.4955 63.5976 174.0794 99 C 5.0790 8.1636 122.5902 55.4225 43.6711 173.2513 100 P 4.8690 0.0000 0.0000 61.6217 31.4803 180.6585 101 V 4.6978 9.4655 112.3467 60.5138 30.3655 170.2105 102 K 3.9670 9.0077 125.2247 57.6476 31.6888 175.5427 103 E 4.0258 8.3319 121.0268 57.5646 30.0658 175.7894 104 A 4.7125 8.4584 128.8942 52.0068 19.7792 175.3842 105 N 4.8798 8.0804 116.9743 53.6504 40.4762 174.1363 106 Q 4.6954 8.1401 115.9228 55.2195 32.0650 174.6496 107 S 4.6995 8.9978 114.2825 57.8712 66.3444 172.5276 108 T 5.2392 8.3963 108.1408 59.7524 71.1965 175.4202 109 L 4.0523 8.6154 123.3161 57.2699 41.9863 178.3549 110 E 3.8774 8.1225 119.2943 59.5755 29.6736 178.1879 111 N 4.3026 8.0170 116.9756 56.3787 38.9217 176.5682 112 F 4.0671 8.2352 122.4373 61.3454 39.4789 177.1691 113 L 3.8854 8.1298 118.5548 57.4405 41.3735 178.9124 114 E 3.7378 7.9324 119.4185 59.3721 29.8299 178.9845 115 R 3.6712 8.2563 118.7857 58.5368 30.0121 178.4821 116 L 3.8706 7.4440 120.5983 57.8307 42.0851 178.3462 117 K 3.7083 8.0660 119.9002 60.1080 32.0358 178.1411 118 T 3.7787 8.0781 115.8733 67.2936 68.3516 176.2644 119 I 3.8460 7.3316 120.0382 64.8751 37.0904 178.5182 120 M 4.3463 8.1959 119.1232 58.0875 31.7597 178.5225 121 R 3.8978 8.4363 119.4270 60.4423 30.3233 177.7639 122 E 3.6736 8.7374 116.3196 60.6963 29.2866 179.2641 123 K 4.0784 8.7627 123.9958 59.1655 32.6709 177.9657 124 Y 4.4396 8.0125 118.5734 59.6522 39.3753 177.0057 125 S 4.1838 8.2169 114.4862 61.0778 62.3542 175.5884 126 K 4.1148 7.8321 119.7264 56.9241 31.7570 176.9320 127 C 4.1759 7.9953 117.1848 59.8411 40.1328 174.7291 128 S 4.3414 7.6283 111.1011 57.8031 62.7337 173.6116 129 S 4.2025 8.3817 114.5333 58.6082 62.1422 173.8360 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 H 8.44 4.75 0.00 3.06 3.37 0.00 5.71 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 2 K 7.62 4.24 0.00 1.80 1.70 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.33 1.51 7.81 3 C 9.26 4.92 0.00 2.86 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 4 D 8.17 5.11 0.00 2.80 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.37 3.76 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.94 0.93 0.00 0.00 6 T 8.08 3.90 4.27 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 1.22 0.00 0.00 7 L 7.75 4.07 0.00 1.96 1.95 1.13 1.00 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 8 Q 8.12 3.90 0.00 2.24 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.96 0.00 0.00 0.00 0.00 0.00 2.75 2.85 0.00 9 E 8.26 3.90 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 2.33 2.38 0.00 10 I 7.76 3.59 1.83 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 1.32 0.42 0.69 0.00 0.00 11 I 7.95 3.49 1.66 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.47 0.60 0.00 0.00 12 K 8.02 3.79 0.00 1.75 1.73 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.41 7.81 13 T 7.86 3.66 4.27 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 1.25 0.00 0.00 14 L 8.03 3.88 0.00 1.75 1.62 0.91 0.67 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 15 N 8.14 4.07 0.00 2.69 2.92 0.00 0.00 7.25 7.73 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 16 S 8.22 4.22 0.00 3.44 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 17 L 7.36 4.24 0.00 1.70 1.67 0.96 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.85 3.90 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 1.16 0.00 0.00 19 E 7.99 4.34 0.00 1.91 1.94 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 2.30 2.23 0.00 20 Q 8.33 4.59 0.00 1.90 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.59 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 21 K 7.68 4.52 0.00 1.90 1.71 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.72 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.49 7.81 22 T 7.30 4.09 4.26 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 1.23 0.00 0.00 23 L 8.09 4.23 0.00 1.68 1.74 0.95 1.02 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 24 C 8.13 5.07 0.00 3.08 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 25 T 7.74 4.23 4.26 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 1.24 0.00 0.00 26 E 8.88 4.37 0.00 2.23 2.23 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 2.27 2.33 0.00 27 L 7.74 4.20 0.00 1.90 1.88 1.17 0.79 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 28 T 8.62 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 1.29 0.00 0.00 29 V 8.74 4.63 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 0.54 0.00 0.00 0.87 0.00 0.00 30 T 8.47 3.98 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 1.25 0.00 0.00 31 D 8.57 4.80 0.00 2.76 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 32 I 7.44 4.10 1.58 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 -0.36 0.97 0.00 0.00 33 F 8.36 4.89 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.79 4.63 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 35 A 7.98 4.16 1.26 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 0.00 0.00 36 S 8.14 3.66 0.00 3.98 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 0.00 37 K 7.52 4.33 0.00 1.89 2.15 0.00 1.78 0.00 0.00 1.98 0.00 0.00 3.17 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.54 1.67 7.81 38 N 7.89 4.50 0.00 2.76 2.89 0.00 0.00 6.76 7.25 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 39 T 7.06 3.96 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 1.31 0.00 0.00 40 T 8.18 4.04 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 41 E 8.89 3.56 0.00 1.71 1.45 0.00 0.00 0.00 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 2.28 0.00 42 K 7.86 4.06 0.00 1.80 2.02 0.00 1.78 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.68 1.51 7.81 43 E 8.24 3.90 0.00 2.04 2.04 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 2.30 2.33 0.00 44 T 7.91 3.79 4.13 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 0.00 0.00 0.00 1.12 0.00 0.00 45 F 8.42 4.58 0.00 3.18 2.86 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 0.00 0.00 0.00 46 C 8.55 4.13 0.00 3.23 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 47 R 8.72 3.78 0.00 1.89 2.10 0.00 3.11 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 48 A 8.40 4.33 1.56 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 0.00 0.00 49 A 7.97 3.73 0.31 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 50 T 7.68 4.12 4.37 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 1.32 0.00 0.00 51 V 7.33 3.66 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 0.98 0.00 0.00 0.45 0.00 0.00 52 L 7.57 3.87 0.00 1.85 1.81 1.14 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.22 4.16 0.00 2.35 2.25 0.00 3.31 0.00 0.00 3.27 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.84 0.00 54 Q 8.50 4.18 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.56 0.00 0.00 0.00 0.00 0.00 2.41 2.61 0.00 55 F 8.83 4.23 0.00 3.13 3.10 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 56 Y 8.87 4.12 0.00 3.31 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 57 S 7.51 3.67 0.00 3.53 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.61 4.16 0.00 3.19 3.38 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 59 H 8.62 3.84 0.00 3.02 3.19 0.00 5.67 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 60 E 8.42 3.91 0.00 1.98 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 0.00 2.54 2.40 0.00 61 K 12.00 4.50 0.00 1.72 0.74 0.00 1.76 0.00 0.00 1.54 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.36 7.81 62 D 9.98 4.27 0.00 2.67 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 63 T 7.37 3.38 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 1.15 0.00 0.00 64 R 7.17 4.71 0.00 1.81 1.98 0.00 3.12 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.50 0.00 65 C 8.74 4.31 0.00 3.10 3.66 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 66 L 7.61 3.81 0.00 1.69 1.54 0.76 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.07 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 68 A 7.97 4.14 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 69 T 7.92 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 1.24 0.00 0.00 70 A 7.19 3.75 1.49 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 0.00 0.00 71 Q 12.00 3.93 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 72 Q 8.21 4.13 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.71 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 73 F 7.83 4.55 0.00 2.98 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 74 H 8.35 4.03 0.00 3.28 3.32 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 R 7.88 4.29 0.00 1.98 2.04 0.00 3.36 0.00 0.00 3.26 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 76 H 8.25 4.03 0.00 3.52 3.65 0.00 5.84 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 77 K 8.09 3.89 0.00 1.88 1.73 0.00 0.92 0.00 0.00 1.18 0.00 0.00 2.76 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.21 1.01 7.81 78 Q 8.17 3.93 0.00 2.28 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.89 0.00 0.00 0.00 0.00 0.00 2.62 2.61 0.00 79 L 8.42 4.13 0.00 1.75 1.80 1.02 0.85 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 80 I 8.01 3.91 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.50 1.18 0.00 0.00 81 R 8.43 3.80 0.00 1.86 1.85 0.00 2.93 0.00 0.00 2.84 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.49 0.00 82 F 8.05 4.16 0.00 3.30 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 83 L 8.65 4.06 0.00 1.84 1.84 1.20 0.85 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 84 K 7.37 2.60 0.00 1.16 1.69 0.00 1.75 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.30 1.31 7.81 85 R 7.45 3.84 0.00 2.10 1.98 0.00 3.09 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 86 L 8.20 3.88 0.00 1.71 1.84 0.81 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.31 4.27 0.00 3.05 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 88 R 8.28 4.35 0.00 2.03 2.10 0.00 3.24 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.78 0.00 89 N 8.08 4.94 0.00 2.81 2.89 0.00 0.00 7.07 6.16 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 90 L 7.95 3.87 0.00 1.58 1.17 0.81 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 91 W 7.49 4.52 0.00 3.43 3.34 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 92 G 8.14 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 93 L 7.37 4.19 0.00 1.59 1.62 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.27 4.40 1.49 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 0.00 0.00 95 G 8.28 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.70 4.45 0.00 1.69 1.72 0.97 0.96 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 97 N 8.15 5.11 0.00 2.71 2.64 0.00 0.00 6.48 7.12 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 98 S 7.76 4.52 0.00 3.83 3.75 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 99 C 8.16 5.08 0.00 3.09 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 0.00 100 P 0.00 4.87 0.00 2.20 1.36 0.00 3.93 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 2.00 0.00 101 V 9.47 4.70 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 0.94 0.00 0.00 102 K 9.01 3.97 0.00 1.94 2.19 0.00 1.58 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.22 1.22 7.81 103 E 8.33 4.03 0.00 1.91 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 2.38 2.37 0.00 104 A 8.46 4.71 1.24 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 0.00 105 N 8.08 4.88 0.00 2.74 2.80 0.00 0.00 6.89 7.71 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 0.00 106 Q 8.14 4.70 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.73 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 107 S 9.00 4.70 0.00 4.06 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 0.00 108 T 8.40 5.24 4.33 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 1.27 0.00 0.00 109 L 8.62 4.05 0.00 1.66 1.53 0.75 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.12 3.88 0.00 2.12 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 2.32 0.00 111 N 8.02 4.30 0.00 2.84 2.97 0.00 0.00 7.03 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 0.00 112 F 8.24 4.07 0.00 3.34 3.18 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 0.00 0.00 0.00 113 L 8.13 3.89 0.00 1.73 1.64 0.91 0.75 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 E 7.93 3.74 0.00 1.94 1.81 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 2.23 2.39 0.00 115 R 8.26 3.67 0.00 1.61 1.14 0.00 2.79 0.00 0.00 2.68 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 116 L 7.44 3.87 0.00 1.09 1.45 1.03 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 117 K 8.07 3.71 0.00 1.81 1.93 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.40 7.81 118 T 8.08 3.78 4.13 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 0.00 0.00 0.00 1.17 0.00 0.00 119 I 7.33 3.85 1.94 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.67 0.45 0.00 0.00 120 M 8.20 4.35 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.37 0.00 121 R 8.44 3.90 0.00 1.90 2.03 0.00 3.10 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 122 E 8.74 3.67 0.00 2.21 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 2.32 2.50 0.00 123 K 8.76 4.08 0.00 1.87 2.08 0.00 1.91 0.00 0.00 1.98 0.00 0.00 3.25 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.57 1.51 7.81 124 Y 8.01 4.44 0.00 3.01 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 0.00 125 S 8.22 4.18 0.00 4.19 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 0.00 126 K 7.83 4.11 0.00 1.78 1.77 0.00 1.88 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.40 7.81 127 C 8.00 4.18 0.00 2.98 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 0.00 128 S 7.63 4.34 0.00 3.78 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 0.00 129 S 8.38 4.20 0.00 3.80 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00