NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.7982 8.3449 120.8692 59.3154 33.7259 174.5439 2 D 4.4298 7.9845 118.3030 55.1062 41.0655 176.0908 3 A 4.1568 8.7838 121.7483 53.3568 19.4936 177.3693 4 F 4.7040 7.9584 113.0136 57.6366 40.4646 176.6854 5 V 3.8972 7.3615 120.0089 63.4845 31.8713 174.5409 6 G 4.0719 8.2188 111.5420 43.4309 0.0000 172.4073 7 T 4.7243 7.9092 116.6192 62.3292 70.3895 174.2709 8 W 5.5795 9.2172 125.3886 54.8039 33.0339 174.4466 9 K 4.8361 9.5199 124.4886 55.3287 34.6122 175.4241 10 L 3.7107 7.8838 124.6696 54.9541 41.9217 176.7029 11 V 4.3418 8.1964 118.6124 61.5404 33.9515 175.6974 12 S 4.6191 7.5197 113.7175 57.2702 65.8768 172.8466 13 S 4.9772 8.2833 118.8753 57.0883 65.5572 172.9715 14 E 4.5222 8.7438 125.7904 55.2725 33.5412 175.5880 15 N 4.2987 9.0713 120.4782 54.5913 36.4507 176.2607 16 F 4.6811 8.1952 124.1267 60.8391 39.3870 176.2179 17 D 4.1419 8.1036 117.4984 57.3000 41.1062 177.7767 18 D 4.3060 8.0245 119.0220 57.3494 40.8768 178.0001 19 Y 4.0756 7.8017 119.9799 61.0211 38.7735 177.9094 20 M 3.6673 7.6934 119.6351 57.9795 31.6444 178.5723 21 K 3.7885 8.0531 120.0030 59.4410 32.0736 178.5169 22 E 3.9781 7.5480 118.2348 59.2131 29.7516 178.7282 23 V 3.9872 7.2635 110.1412 62.4066 31.5490 177.0211 24 G 3.9939 7.4084 106.0521 45.2247 0.0000 173.8049 25 V 3.7379 7.6280 119.4918 61.8798 32.2666 176.8856 26 G 3.8034 8.5698 113.3956 44.1844 0.0000 174.1478 27 F 3.8541 8.9982 126.2750 61.3664 39.5560 177.5549 28 A 4.3141 8.2229 119.6850 55.6259 18.4267 179.6740 29 T 4.0129 7.9272 107.4463 64.6536 68.8655 176.4137 30 R 3.7192 8.6533 122.3771 58.5751 29.7950 178.0802 31 K 4.0922 7.5146 117.3784 58.8062 33.1175 178.9730 32 V 3.7271 7.4841 119.2458 65.7822 31.7832 177.6343 33 A 3.4847 7.7615 120.3840 54.2287 17.8540 179.3841 34 G 3.8386 7.3427 101.6367 46.8880 0.0000 174.9165 35 M 4.3052 7.5130 118.9412 54.8275 32.9252 176.2413 36 A 4.3514 6.9580 121.2471 51.7375 19.4159 177.8575 37 K 4.4476 8.1014 120.6393 53.1807 32.5371 174.2825 38 P 4.7165 0.0000 0.0000 62.9023 33.4290 174.9726 39 N 5.4186 9.0859 119.4571 51.6257 40.8218 172.8020 40 M 4.5069 9.0173 124.2824 55.2756 33.5566 174.8957 41 I 4.9902 9.3797 129.1742 59.9446 39.5579 174.6693 42 I 5.0681 8.6655 129.1046 59.7900 39.3225 175.3670 43 S 5.0114 9.0222 120.0237 56.9920 66.8756 172.9048 44 V 4.7547 8.1869 119.3098 61.5746 34.8312 175.3402 45 N 4.7417 8.9916 124.6890 52.7911 40.5638 175.1367 46 G 3.8882 8.1976 117.3199 46.4513 0.0000 172.0219 47 D 4.6039 8.7460 124.9092 53.3654 39.8404 175.6874 48 L 4.6102 7.6142 121.2640 53.3694 43.8741 175.3461 49 V 4.4653 8.2744 124.6098 61.2363 33.7311 174.2986 50 T 4.9053 8.7005 124.7646 61.7337 71.5635 173.2721 51 I 4.7906 8.9131 127.1343 59.7197 40.1113 174.2834 52 R 4.9242 9.0404 129.0648 54.5076 32.3608 174.5234 53 S 5.0826 8.8337 121.9495 56.8448 64.5000 172.2415 54 E 5.1835 8.7835 127.7628 54.7647 31.5890 175.5963 55 S 5.0141 8.0414 115.1350 57.5808 66.0580 174.7258 56 T 4.0810 8.6452 109.9730 64.4932 69.0518 176.0141 57 F 4.4128 8.5036 123.5387 59.8983 39.4486 174.8737 58 K 4.0590 7.7072 117.6725 55.4831 35.3732 172.9773 59 N 5.3446 8.8353 123.6768 52.3202 39.5921 174.3776 60 T 4.7858 8.6103 113.9914 60.1150 72.5909 172.7690 61 E 5.2842 8.3902 121.7185 55.1836 32.8517 174.0988 62 I 4.7805 8.7524 119.7057 59.3153 40.9136 174.1433 63 S 5.1178 8.5801 122.0239 56.7181 65.4235 173.1076 64 F 4.5132 7.8729 117.5289 56.0681 41.5799 172.6134 65 K 5.0199 8.3630 117.8843 54.1012 34.9677 176.2873 66 L 4.3230 8.7156 124.0114 56.3564 42.0244 178.0976 67 G 3.8760 9.3019 110.2912 45.7825 0.0000 173.4286 68 V 4.2545 7.3868 119.7670 60.4720 32.4633 174.8703 69 E 4.5065 8.8615 128.9226 57.0350 30.1359 175.7101 70 F 5.1531 8.9574 120.3027 55.4687 42.1786 172.8368 71 D 5.1192 8.8078 119.3262 53.6013 41.9952 175.7811 72 E 4.7387 9.1516 123.0370 54.5593 33.6943 174.1737 73 I 4.9011 8.3208 126.9491 59.4933 38.8974 175.5479 74 T 4.0376 8.5954 118.1595 60.8840 69.3829 175.4187 75 A 4.0345 8.5628 124.4827 55.0331 18.4021 177.8124 76 D 4.8189 8.0891 113.4337 53.2062 40.2098 176.2043 77 D 4.3167 7.5775 116.2545 56.4274 38.8674 173.8263 78 R 4.4384 7.8762 117.3173 54.4271 33.2306 177.5290 79 K 4.6793 8.5948 124.9702 55.3619 32.0864 175.5360 80 V 4.6443 8.6731 120.9867 59.3460 35.5326 174.4988 81 K 4.7585 8.5919 120.5710 54.9839 34.3329 176.0945 82 S 5.4565 8.3917 121.1014 55.9721 66.5250 173.6025 83 I 4.7943 7.8350 121.9918 60.0739 41.3534 173.8568 84 I 5.0629 8.5887 128.0522 59.6534 39.8270 174.8786 85 T 4.8719 8.8214 116.0851 60.0549 72.8880 173.1739 86 L 5.0559 8.5404 122.3348 53.2295 41.8601 174.4423 87 D 4.7613 8.8580 123.3950 52.9822 42.7608 176.6600 88 G 3.7800 9.7492 115.9044 46.6796 0.0000 174.5209 89 G 3.9843 8.5795 107.8178 44.9319 0.0000 174.1475 90 A 4.7720 7.6775 121.4150 50.6315 21.7840 176.5168 91 L 4.3238 8.6598 122.8942 53.9585 42.5136 174.9299 92 V 4.4706 8.5153 126.9395 61.4678 33.3256 174.0812 93 Q 4.9456 9.3092 129.5733 54.2051 31.8815 173.9767 94 V 4.7886 8.5130 126.3737 61.3140 34.1300 173.9402 95 Q 5.0940 9.0125 127.2379 54.1690 31.3852 174.8061 96 K 5.4242 8.9067 122.7655 54.3996 35.8837 175.3986 97 W 5.1310 9.3445 120.7778 56.0493 31.7288 174.5105 98 D 4.2166 9.7002 124.2895 55.3728 37.7582 174.9786 99 G 3.8192 7.8734 104.0346 45.7328 0.0000 173.5749 100 K 4.0649 7.0749 119.6047 55.3856 33.4936 175.2315 101 S 5.2364 7.5188 113.4182 57.7167 65.3800 173.2552 102 T 5.1146 9.2422 120.2580 60.6660 71.3580 172.2273 103 T 5.1349 8.7132 117.0333 59.9663 71.8469 172.7144 104 I 4.6909 9.0804 126.5087 59.3811 39.9064 174.3061 105 K 4.7773 9.0024 129.6574 54.7988 34.2309 175.0204 106 R 5.0600 8.9342 128.5537 54.5514 31.7494 175.6951 107 K 5.1819 9.2930 123.4314 55.1235 36.7310 175.2434 108 R 4.6409 8.4408 120.0536 54.7950 31.1888 176.6097 109 D 4.8091 8.8853 124.5422 51.3983 42.0376 175.9201 110 G 4.0569 7.9520 116.4500 45.1877 0.0000 172.2897 111 D 4.7242 8.8609 124.3898 52.9526 39.9148 175.4747 112 K 4.9247 7.7568 119.2340 55.2142 36.5396 174.5302 113 L 4.6804 8.2991 123.0772 53.4122 43.9481 175.0591 114 V 4.6994 8.8962 127.3141 61.3623 33.9566 174.6190 115 V 4.8182 8.7442 126.8115 61.2212 34.4334 173.8678 116 E 4.9459 9.2664 128.6170 55.0394 31.6433 174.7480 117 C 4.7213 8.4613 123.7377 58.1140 30.1565 173.2679 118 V 4.8763 8.7018 123.9659 61.4080 34.4653 174.3668 119 M 4.4264 9.0773 127.3847 54.5552 33.8287 173.7943 120 K 3.6304 9.9383 122.3288 56.2239 28.8886 174.2092 121 G 4.2901 7.9735 115.8603 45.2052 0.0000 171.7209 122 V 3.7781 7.4749 118.4547 61.1922 32.1884 174.9868 123 T 5.0974 8.4016 119.4122 61.8833 71.2490 173.1764 124 S 5.0157 9.1861 121.3051 57.1327 65.4620 173.0372 125 T 4.9011 8.6817 120.8603 62.0761 72.3345 173.0197 126 R 5.0300 9.0519 126.2580 54.1598 33.4568 175.0189 127 V 4.7879 8.2639 123.8269 60.3437 33.7868 175.3874 128 Y 4.9296 9.4045 123.5546 56.9265 41.0615 173.8121 129 E 5.1533 9.3853 119.5827 54.9131 33.5491 174.4628 130 R 3.7264 8.8166 124.5224 56.7700 30.8305 176.3974 131 A 4.2692 8.2257 123.8689 52.1293 18.4453 177.1408 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 C 8.34 4.80 0.00 3.04 3.11 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 0.00 0.00 0.00 0.00 2 D 7.98 4.43 0.00 2.94 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 3 A 8.78 4.16 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.96 4.70 0.00 3.08 3.09 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 0.00 5 V 7.36 3.90 2.16 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 0.82 0.00 0.00 1.01 0.00 0.00 6 G 8.22 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 0.00 0.00 0.00 7 T 7.91 4.72 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 1.23 0.00 0.00 8 W 9.22 5.58 0.00 3.33 3.29 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 9 K 9.52 4.84 0.00 1.81 1.98 0.00 1.32 0.00 0.00 1.80 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.66 1.40 7.81 10 L 7.88 3.71 0.00 1.50 1.39 0.74 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.20 4.34 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 0.82 0.00 0.00 0.94 0.00 0.00 12 S 7.52 4.62 0.00 3.81 3.57 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 13 S 8.28 4.98 0.00 3.69 3.59 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 0.00 0.00 0.00 0.00 14 E 8.74 4.52 0.00 1.92 1.78 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 2.21 2.25 0.00 15 N 9.07 4.30 0.00 3.11 2.96 0.00 0.00 6.78 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 16 F 8.20 4.68 0.00 3.07 3.09 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 0.00 17 D 8.10 4.14 0.00 2.78 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 18 D 8.02 4.31 0.00 3.01 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 19 Y 7.80 4.08 0.00 3.03 3.05 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 20 M 7.69 3.67 0.00 1.82 1.73 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.00 0.00 21 K 8.05 3.79 0.00 1.84 1.93 0.00 1.61 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.42 7.81 22 E 7.55 3.98 0.00 2.11 1.91 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 2.52 2.37 0.00 23 V 7.26 3.99 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 0.28 0.00 0.00 0.68 0.00 0.00 24 G 7.41 3.99 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 0.00 0.00 0.00 25 V 7.63 3.74 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 0.71 0.00 0.00 0.81 0.00 0.00 26 G 8.57 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 27 F 9.00 3.85 0.00 3.06 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 28 A 8.22 4.31 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 29 T 7.93 4.01 4.47 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 30 R 8.65 3.72 0.00 1.87 1.91 0.00 3.12 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.41 0.00 31 K 7.51 4.09 0.00 1.81 1.73 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.58 1.42 7.81 32 V 7.48 3.73 2.27 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 1.29 0.00 0.00 1.04 0.00 0.00 33 A 7.76 3.48 0.53 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 34 G 7.34 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 35 M 7.51 4.31 0.00 1.96 2.12 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.53 0.00 36 A 6.96 4.35 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 37 K 8.10 4.45 0.00 1.71 1.70 0.00 1.73 0.00 0.00 1.66 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.34 7.81 38 P 0.00 4.72 0.00 2.25 2.10 0.00 3.48 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 2.14 2.20 0.00 39 N 9.09 5.42 0.00 2.72 2.81 0.00 0.00 6.91 7.21 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 40 M 9.02 4.51 0.00 1.79 1.61 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.42 0.00 41 I 9.38 4.99 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.91 0.95 0.00 0.00 42 I 8.67 5.07 2.30 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 0.78 0.98 0.00 0.00 43 S 9.02 5.01 0.00 3.82 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 44 V 8.19 4.75 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 0.77 0.00 0.00 0.92 0.00 0.00 45 N 8.99 4.74 0.00 2.66 2.57 0.00 0.00 7.20 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 46 G 8.20 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 D 8.75 4.60 0.00 2.78 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.61 4.61 0.00 1.63 1.47 0.83 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 49 V 8.27 4.47 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 0.00 0.00 0.71 0.00 0.00 0.76 0.00 0.00 50 T 8.70 4.91 4.16 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 1.18 0.00 0.00 51 I 8.91 4.79 2.05 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 1.18 1.43 0.94 0.00 0.00 52 R 9.04 4.92 0.00 1.88 1.80 0.00 3.07 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 53 S 8.83 5.08 0.00 3.99 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 54 E 8.78 5.18 0.00 2.03 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 2.26 2.26 0.00 55 S 8.04 5.01 0.00 4.00 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 56 T 8.65 4.08 4.30 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 1.25 0.00 0.00 57 F 8.50 4.41 0.00 2.97 3.21 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 58 K 7.71 4.06 0.00 1.06 1.36 0.00 1.39 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.15 1.15 7.81 59 N 8.84 5.34 0.00 2.64 2.76 0.00 0.00 6.80 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 60 T 8.61 4.79 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 61 E 8.39 5.28 0.00 1.98 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 2.21 2.32 0.00 62 I 8.75 4.78 2.10 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 1.55 1.27 1.10 0.00 0.00 63 S 8.58 5.12 0.00 3.66 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 64 F 7.87 4.51 0.00 2.56 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 0.00 0.00 0.00 65 K 8.36 5.02 0.00 1.74 1.73 0.00 1.68 0.00 0.00 1.81 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.57 1.39 7.81 66 L 8.72 4.32 0.00 1.68 1.67 0.96 1.11 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 67 G 9.30 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 V 7.39 4.25 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 0.86 0.00 0.00 1.03 0.00 0.00 69 E 8.86 4.51 0.00 2.04 1.89 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 2.29 2.27 0.00 70 F 8.96 5.15 0.00 3.10 3.07 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 71 D 8.81 5.12 0.00 2.65 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 72 E 9.15 4.74 0.00 1.86 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 2.19 2.38 0.00 73 I 8.32 4.90 1.87 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 1.39 0.77 0.89 0.00 0.00 74 T 8.60 4.04 4.16 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 1.06 0.00 0.00 75 A 8.56 4.03 1.48 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 0.00 0.00 76 D 8.09 4.82 0.00 2.82 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 77 D 7.58 4.32 0.00 2.82 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 78 R 7.88 4.44 0.00 1.38 1.27 0.00 2.21 0.00 0.00 2.53 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.28 0.00 79 K 8.59 4.68 0.00 1.75 1.76 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.45 7.81 80 V 8.67 4.64 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 0.32 0.00 0.00 0.77 0.00 0.00 81 K 8.59 4.76 0.00 1.63 1.62 0.00 1.61 0.00 0.00 1.79 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.52 7.81 82 S 8.39 5.46 0.00 2.72 3.11 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 0.00 0.00 0.00 0.00 83 I 7.84 4.79 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.88 0.93 0.00 0.00 84 I 8.59 5.06 1.57 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.53 0.81 0.00 0.00 85 T 8.82 4.87 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 86 L 8.54 5.06 0.00 1.57 1.71 0.99 1.13 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 87 D 8.86 4.76 0.00 2.67 2.51 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 0.00 0.00 0.00 0.00 88 G 9.75 3.78 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 0.00 0.00 0.00 89 G 8.58 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 90 A 7.68 4.77 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 91 L 8.66 4.32 0.00 1.10 1.23 0.68 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 92 V 8.52 4.47 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 0.84 0.00 0.00 0.92 0.00 0.00 93 Q 9.31 4.95 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.17 2.14 0.00 94 V 8.51 4.79 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 0.94 0.00 0.00 0.92 0.00 0.00 95 Q 9.01 5.09 0.00 2.12 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.53 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 96 K 8.91 5.42 0.00 1.70 1.69 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.36 7.81 97 W 9.34 5.13 0.00 3.36 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 98 D 9.70 4.22 0.00 2.56 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 99 G 7.87 3.82 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 0.00 0.00 0.00 100 K 7.07 4.06 0.00 0.79 0.74 0.00 1.28 0.00 0.00 1.34 0.00 0.00 2.57 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.01 0.94 7.81 101 S 7.52 5.24 0.00 3.77 3.63 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 0.00 102 T 9.24 5.11 4.62 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 103 T 8.71 5.13 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 1.24 0.00 0.00 104 I 9.08 4.69 1.83 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.76 0.86 0.00 0.00 105 K 9.00 4.78 0.00 1.77 1.74 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.37 7.81 106 R 8.93 5.06 0.00 1.50 1.69 0.00 2.92 0.00 0.00 3.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.42 0.00 107 K 9.29 5.18 0.00 1.76 1.91 0.00 1.30 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.39 7.81 108 R 8.44 4.64 0.00 1.52 1.75 0.00 2.94 0.00 0.00 2.51 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.92 0.00 109 D 8.89 4.81 0.00 2.56 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 0.00 110 G 7.95 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 0.00 0.00 0.00 111 D 8.86 4.72 0.00 2.85 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 0.00 112 K 7.76 4.92 0.00 2.05 2.02 0.00 1.48 0.00 0.00 1.77 0.00 0.00 2.81 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.63 1.41 7.81 113 L 8.30 4.68 0.00 0.27 0.99 0.71 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.90 4.70 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 0.82 0.00 0.00 0.93 0.00 0.00 115 V 8.74 4.82 2.22 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 0.94 0.00 0.00 0.85 0.00 0.00 116 E 9.27 4.95 0.00 1.87 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 2.20 2.23 0.00 117 C 8.46 4.72 0.00 1.86 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 0.00 118 V 8.70 4.88 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 1.05 0.00 0.00 0.92 0.00 0.00 119 M 9.08 4.43 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.52 0.00 120 K 9.94 3.63 0.00 1.88 1.77 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.70 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.40 7.81 121 G 7.97 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 0.00 0.00 0.00 0.00 122 V 7.47 3.78 2.13 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 0.95 0.00 0.00 1.03 0.00 0.00 123 T 8.40 5.10 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 1.19 0.00 0.00 124 S 9.19 5.02 0.00 4.07 3.54 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 0.00 0.00 0.00 0.00 125 T 8.68 4.90 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 0.00 126 R 9.05 5.03 0.00 1.74 1.61 0.00 2.30 0.00 0.00 2.92 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.39 0.00 127 V 8.26 4.79 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 0.76 0.00 0.00 0.95 0.00 0.00 128 Y 9.40 4.93 0.00 3.00 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 0.00 129 E 9.39 5.15 0.00 2.13 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 2.26 2.37 0.00 130 R 8.82 3.73 0.00 1.50 1.52 0.00 3.02 0.00 0.00 2.93 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.03 0.00 131 A 8.23 4.27 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