NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2757 8.1227 123.5769 51.6738 20.1898 177.5366 2 I 3.4752 8.0323 120.1351 62.4224 38.1003 175.9666 3 T 5.0735 8.4488 107.9962 61.9707 69.7675 174.5621 4 D 4.5481 7.8940 122.6987 56.6496 41.0170 177.1521 5 I 4.5389 7.6965 116.5856 60.5146 40.0201 175.3166 6 L 4.8281 7.8186 119.5178 52.3570 44.5109 175.4942 7 S 4.6244 8.4926 116.0771 57.7797 63.6814 174.9922 8 A 4.0149 8.8056 130.9698 55.2486 18.0593 179.5189 9 K 3.8854 7.9207 117.8930 59.8193 32.3395 178.8354 10 D 4.3265 8.0385 118.7046 57.3761 40.7886 178.6680 11 I 3.5714 7.9942 120.4687 64.2187 37.1270 177.9557 12 E 3.9621 8.3661 120.2291 59.5928 29.3384 179.1549 13 S 4.1137 8.0459 114.8149 61.5168 62.6292 176.5844 14 A 3.8341 7.7408 122.6276 54.9266 18.1237 179.4241 15 L 4.3450 8.0915 117.9322 57.9387 41.5476 179.7819 16 S 4.1724 7.9976 113.3680 61.4427 62.9227 176.2308 17 S 4.3043 7.8541 116.5859 60.0079 62.3676 174.1644 18 C 5.5432 7.5843 115.6948 57.0432 29.8729 175.3403 19 Q 4.1192 8.3161 121.0859 59.6322 29.1119 177.2044 20 A 4.2173 7.8682 120.4665 51.0860 19.2924 176.5102 21 A 4.1771 8.4569 124.4786 53.8083 18.9145 177.2086 22 D 4.5958 8.8612 119.8156 55.3528 38.5563 174.9088 23 S 4.5254 7.8918 113.7460 58.6159 63.9117 173.9621 24 F 4.5129 8.5987 124.7522 58.0658 39.8939 174.6771 25 N 4.3069 7.1158 124.6477 51.0164 41.9914 174.6521 26 Y 3.2846 7.7090 126.9883 59.8305 37.8944 178.6558 27 K 3.4162 6.2496 119.4978 58.9974 32.0973 179.3527 28 S 3.9824 8.0839 115.5549 61.3872 62.7571 176.4947 29 F 3.9293 7.8702 123.2753 61.3569 39.1220 177.0118 30 F 4.5331 9.1796 118.0711 60.8644 38.8624 177.9122 31 S 4.1749 8.1265 113.3126 61.7924 62.7350 176.6569 32 T 3.8237 7.6954 118.4693 66.1331 68.2728 176.4235 33 V 3.8650 7.5591 112.0088 61.2960 31.9612 176.3923 34 G 3.8488 7.8003 106.1949 46.4745 0.0000 175.2683 35 L 4.1748 8.3017 122.3864 57.1945 41.9973 180.0736 36 S 4.3447 8.2164 114.1887 61.1415 62.8009 175.0355 37 S 4.5970 7.8793 111.7306 57.9135 63.3683 174.2996 38 K 4.4167 7.7901 121.1634 56.4305 32.6845 177.3137 39 T 4.3791 8.9603 112.9353 60.2302 71.3710 174.0539 40 P 4.2456 0.0000 0.0000 66.1301 31.2619 178.6477 41 D 4.3772 8.0350 116.8231 57.4839 40.8561 178.7068 42 Q 4.0478 7.7230 117.3845 59.0699 28.6843 178.9160 43 I 3.9202 8.2122 121.2152 64.3856 37.0565 178.6038 44 K 4.0740 8.6082 119.8330 59.3007 31.9042 179.3318 45 K 3.9425 8.2803 119.8967 59.4867 32.1817 179.0326 46 V 3.5767 7.9802 118.5485 65.8634 31.4103 177.5622 47 F 3.6103 8.7403 120.9253 61.3079 38.9954 177.1579 48 G 3.6673 8.2153 103.9501 48.0338 0.0000 175.3302 49 I 3.7859 7.1636 120.4932 64.1334 37.2313 178.1713 50 L 4.0141 7.4325 118.7233 56.8383 42.8915 178.6426 51 D 4.5174 7.8734 119.6739 53.9328 37.7496 176.3145 52 Q 3.8794 8.0113 122.5463 57.9279 29.3404 177.0944 53 D 4.6277 8.0978 114.5761 52.2272 39.6923 176.1945 54 K 3.9157 7.5796 117.7114 57.9203 29.8730 176.4845 55 S 4.3543 8.2653 112.9905 58.9823 63.6743 175.1073 56 G 3.9359 9.7731 110.0677 44.8850 0.0000 173.1749 57 F 5.2566 7.6253 116.2544 55.8525 43.5879 174.9314 58 I 4.5672 9.1443 123.1129 59.5586 38.0235 175.7732 59 E 4.5148 8.6912 127.3265 55.2750 31.1523 177.7967 60 E 3.8628 8.8633 120.5978 59.6684 29.3385 178.4653 61 E 4.0674 8.0398 115.4768 58.9315 29.9509 178.2642 62 E 4.1291 7.9587 119.8383 58.9271 29.6486 178.7151 63 L 3.8903 7.7628 118.6840 57.6807 41.5627 179.0076 64 Q 4.0034 8.0147 119.5568 58.7805 28.8012 177.4947 65 L 4.7896 7.4141 118.3166 54.6337 42.2554 178.4360 66 F 4.1314 7.9875 123.6117 61.8032 39.2315 177.0988 67 L 4.0502 7.9832 117.6336 57.4753 41.1025 179.3732 68 K 4.1896 7.8313 118.2555 59.2486 31.6620 178.8519 69 N 4.2725 7.6825 116.0952 55.2333 38.3642 176.3270 70 F 4.6729 7.9549 117.8753 57.3213 40.5211 176.1960 71 S 4.5340 7.2524 112.3367 57.1489 65.5135 175.5465 72 S 4.2929 8.9019 122.9700 60.3378 62.9788 174.8603 73 S 4.4690 7.5708 114.3320 58.4031 63.6432 174.5348 74 A 4.2140 7.6102 124.6681 51.9859 18.6854 177.4810 75 R 4.2183 8.2154 116.4622 55.6589 30.5354 176.5186 76 V 3.9067 8.0161 119.3873 62.5868 32.2275 175.8444 77 L 4.4449 8.5086 127.7890 54.8704 42.3610 177.1275 78 T 4.1889 9.2267 113.0612 61.3938 70.1524 175.8348 79 S 4.0953 8.8122 117.5734 61.5843 62.7454 176.8551 80 A 3.9987 7.9413 122.8942 55.2385 18.2366 179.2391 81 E 4.0166 8.2684 117.0539 59.9810 29.5292 179.8124 82 T 3.9387 8.2309 115.8713 66.5315 68.5155 176.4822 83 K 3.9043 8.4777 121.6692 59.6645 32.2319 178.6796 84 A 4.0578 8.3061 121.0129 54.8602 18.3164 179.3726 85 F 4.2259 8.5339 119.3498 61.5851 39.5087 177.0506 86 L 3.9113 8.4882 120.1484 58.1674 41.6142 178.7439 87 A 4.0182 8.0881 119.5597 55.0912 18.3706 179.2078 88 A 4.1916 8.0919 118.4980 55.1449 18.5770 179.5585 89 G 3.8547 7.8265 102.4649 46.2156 0.0000 174.9414 90 D 4.7215 8.1120 121.4555 53.1281 38.3862 175.5769 91 T 4.0130 7.9612 120.2030 66.2351 69.0182 175.3218 92 D 4.5292 8.5252 117.3410 52.8959 39.8808 176.7871 93 G 3.8921 8.0651 107.5574 46.8284 0.0000 174.0109 94 D 4.4807 8.3834 116.8360 53.0163 39.3756 177.4071 95 G 3.9024 8.9333 108.1965 45.4527 0.0000 172.7771 96 K 4.7331 8.2247 117.5349 55.3139 36.6263 175.3378 97 I 4.7607 8.7566 120.3471 59.7591 39.6966 176.5742 98 G 4.2496 9.2712 115.5503 44.9409 0.0000 174.7728 99 V 2.5003 7.6619 119.1719 64.2700 31.1481 178.3033 100 E 3.9009 7.8881 118.7047 59.2980 29.4268 179.0282 101 E 4.0486 8.1388 118.1411 59.1963 29.5927 179.0560 102 F 4.3569 8.5227 120.9555 61.2968 39.5394 176.7524 103 Q 3.8825 8.4393 119.6320 59.4438 28.5893 178.4621 104 S 4.0938 7.9140 112.4963 61.3575 62.4778 175.5265 105 L 4.1353 7.8232 122.0287 58.1698 41.8840 178.8555 106 V 4.0404 7.6547 117.4235 65.0697 31.6010 177.1674 107 K 4.6232 8.0775 116.7229 56.4439 33.5484 176.3785 108 A 4.3619 8.0624 127.4285 52.3530 19.2842 177.0689 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 A 8.12 4.28 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 2 I 8.03 3.48 1.66 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.20 0.84 0.00 0.00 3 T 8.45 5.07 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 1.27 0.00 0.00 4 D 7.89 4.55 0.00 2.87 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 5 I 7.70 4.54 1.91 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 1.44 0.62 0.95 0.00 0.00 6 L 7.82 4.83 0.00 1.79 1.62 1.21 0.90 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 7 S 8.49 4.62 0.00 3.90 3.93 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 8 A 8.81 4.01 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 9 K 7.92 3.89 0.00 1.86 1.81 0.00 1.53 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.51 7.81 10 D 8.04 4.33 0.00 2.86 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 11 I 7.99 3.57 2.11 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.15 1.10 0.00 0.00 12 E 8.37 3.96 0.00 2.15 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 0.00 2.32 2.38 0.00 13 S 8.05 4.11 0.00 4.02 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 14 A 7.74 3.83 0.56 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 15 L 8.09 4.35 0.00 1.94 1.83 1.06 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.00 4.17 0.00 4.06 4.02 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 0.00 0.00 0.00 17 S 7.85 4.30 0.00 3.93 4.12 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 0.00 0.00 0.00 18 C 7.58 5.54 0.00 3.27 3.13 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 0.00 19 Q 8.32 4.12 0.00 2.11 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.01 0.00 0.00 0.00 0.00 0.00 2.74 2.34 0.00 20 A 7.87 4.22 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 21 A 8.46 4.18 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 22 D 8.86 4.60 0.00 2.87 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 23 S 7.89 4.53 0.00 4.04 4.17 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 24 F 8.60 4.51 0.00 3.00 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 25 N 7.12 4.31 0.00 2.45 2.24 0.00 0.00 6.92 7.56 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 26 Y 7.71 3.28 0.00 2.02 1.74 0.00 0.00 0.00 0.00 0.00 0.00 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 K 6.25 3.42 0.00 1.40 1.52 0.00 1.36 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.82 0.21 7.81 28 S 8.08 3.98 0.00 3.78 3.79 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 29 F 7.87 3.93 0.00 3.08 3.32 0.00 0.00 0.00 0.00 0.00 0.00 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 9.18 4.53 0.00 3.12 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 31 S 8.13 4.17 0.00 4.07 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 0.00 32 T 7.70 3.82 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 1.14 0.00 0.00 33 V 7.56 3.86 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 0.15 0.00 0.00 1.07 0.00 0.00 34 G 7.80 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 0.00 0.00 0.00 35 L 8.30 4.17 0.00 1.82 1.60 0.42 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 36 S 8.22 4.34 0.00 3.89 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 37 S 7.88 4.60 0.00 3.98 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 38 K 7.79 4.42 0.00 1.90 1.89 0.00 1.90 0.00 0.00 1.77 0.00 0.00 3.19 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.74 1.56 7.81 39 T 8.96 4.38 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 40 P 0.00 4.25 0.00 2.18 2.27 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 41 D 8.03 4.38 0.00 2.70 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 42 Q 7.72 4.05 0.00 2.37 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 43 I 8.21 3.92 2.08 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 1.56 0.83 1.10 0.00 0.00 44 K 8.61 4.07 0.00 2.00 1.90 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.65 7.81 45 K 8.28 3.94 0.00 1.86 2.01 0.00 1.65 0.00 0.00 1.58 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.44 7.81 46 V 7.98 3.58 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 1.12 0.00 0.00 1.07 0.00 0.00 47 F 8.74 3.61 0.00 3.08 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 48 G 8.22 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.16 3.79 1.86 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.63 0.68 0.00 0.00 50 L 7.43 4.01 0.00 1.27 1.51 0.87 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 51 D 7.87 4.52 0.00 1.89 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 0.00 0.00 0.00 52 Q 8.01 3.88 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.89 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 53 D 8.10 4.63 0.00 2.77 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 54 K 7.58 3.92 0.00 1.93 1.91 0.00 1.66 0.00 0.00 1.85 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.32 1.46 7.81 55 S 8.27 4.35 0.00 4.06 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 56 G 9.77 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 57 F 7.63 5.26 0.00 3.08 2.97 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 58 I 9.14 4.57 1.83 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 1.20 0.75 0.00 0.00 59 E 8.69 4.51 0.00 2.09 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 2.35 0.00 60 E 8.86 3.86 0.00 1.97 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 0.00 2.36 2.31 0.00 61 E 8.04 4.07 0.00 2.14 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 2.24 2.31 0.00 62 E 7.96 4.13 0.00 2.15 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 2.24 2.28 0.00 63 L 7.76 3.89 0.00 1.74 1.49 0.65 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 64 Q 8.01 4.00 0.00 2.26 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 65 L 7.41 4.79 0.00 1.67 1.61 0.89 1.40 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 66 F 7.99 4.13 0.00 3.25 2.99 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 67 L 7.98 4.05 0.00 1.91 1.79 1.02 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.83 4.19 0.00 1.86 1.84 0.00 1.68 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.62 7.81 69 N 7.68 4.27 0.00 2.03 2.29 0.00 0.00 6.91 7.31 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 70 F 7.95 4.67 0.00 3.18 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 71 S 7.25 4.53 0.00 4.02 3.76 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 72 S 8.90 4.29 0.00 4.02 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 73 S 7.57 4.47 0.00 3.99 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 74 A 7.61 4.21 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 75 R 8.22 4.22 0.00 1.96 1.98 0.00 3.07 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 76 V 8.02 3.91 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 0.86 0.00 0.00 0.93 0.00 0.00 77 L 8.51 4.44 0.00 1.52 1.52 0.61 0.41 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 78 T 9.23 4.19 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 1.29 0.00 0.00 79 S 8.81 4.10 0.00 3.90 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 80 A 7.94 4.00 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 81 E 8.27 4.02 0.00 2.23 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 0.00 2.47 2.60 0.00 82 T 8.23 3.94 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 1.24 0.00 0.00 83 K 8.48 3.90 0.00 1.93 2.01 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.49 7.81 84 A 8.31 4.06 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 85 F 8.53 4.23 0.00 3.31 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 86 L 8.49 3.91 0.00 1.81 1.83 0.96 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 87 A 8.09 4.02 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.09 4.19 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.83 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 0.00 0.00 0.00 90 D 8.11 4.72 0.00 2.68 2.71 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 91 T 7.96 4.01 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 1.23 0.00 0.00 92 D 8.53 4.53 0.00 2.78 2.80 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 93 G 8.07 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 94 D 8.38 4.48 0.00 2.73 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 G 8.93 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 0.00 0.00 0.00 96 K 8.22 4.73 0.00 1.77 1.72 0.00 0.91 0.00 0.00 1.41 0.00 0.00 2.27 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.18 7.81 97 I 8.76 4.76 1.98 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 1.22 1.01 1.18 0.00 0.00 98 G 9.27 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 0.00 0.00 0.00 99 V 7.66 2.50 1.10 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 0.74 0.00 0.00 0.50 0.00 0.00 100 E 7.89 3.90 0.00 2.07 2.03 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 2.38 2.40 0.00 101 E 8.14 4.05 0.00 2.27 2.26 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 2.45 2.42 0.00 102 F 8.52 4.36 0.00 3.42 3.23 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 0.00 103 Q 8.44 3.88 0.00 2.27 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 104 S 7.91 4.09 0.00 3.93 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 0.00 105 L 7.82 4.14 0.00 1.91 1.87 0.75 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 106 V 7.65 4.04 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 0.88 0.00 0.00 0.34 0.00 0.00 107 K 8.08 4.62 0.00 1.78 1.81 0.00 1.73 0.00 0.00 1.83 0.00 0.00 3.08 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.49 1.58 7.81 108 A 8.06 4.36 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