NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 3.9359 8.3393 109.7341 45.7720 0.0000 172.9154 0 S 4.4950 8.2600 110.1793 56.7352 62.6664 172.8542 1 A 4.2949 8.1272 125.9109 55.0309 20.4458 180.1193 2 R 4.2220 8.0031 115.9244 58.6434 30.2091 179.1515 3 Q 3.9488 8.0777 115.3680 59.0739 28.2199 177.8885 4 L 4.3150 7.6910 118.5645 55.3274 42.2877 178.3774 5 S 4.2476 8.0559 115.6826 59.9719 62.4939 175.6613 6 K 3.7847 8.0182 122.5648 59.0389 32.1590 176.9088 7 L 4.1951 7.5326 119.0187 56.3422 42.6697 177.7854 8 K 3.7592 7.8881 119.7351 59.9330 31.8919 178.2030 9 R 3.9111 8.0483 117.1470 59.5127 30.0783 178.3187 10 F 4.0382 8.3832 119.4533 61.3917 39.1912 176.6967 11 L 4.0713 8.7040 119.9152 58.6974 41.8682 178.5934 12 T 4.1475 8.2222 117.2406 66.6140 68.4969 176.3804 13 T 3.8233 8.1100 114.4657 64.9129 67.4160 176.0011 14 L 3.7939 8.0484 123.2262 57.9955 41.8524 178.8669 15 Q 4.1610 8.2655 116.7418 58.8911 28.8916 178.0486 16 Q 4.1582 8.1341 119.6514 58.5644 29.2267 177.5502 17 F 4.3916 8.8491 120.1544 58.5442 39.8384 177.3676 18 G 3.9612 7.8783 107.0450 48.8542 0.0000 174.7630 19 N 4.4830 7.9168 116.3755 54.9465 39.5655 175.4134 20 D 4.2125 8.1840 117.5316 57.2217 41.4911 176.8824 21 I 3.7732 7.8370 117.6854 62.8857 38.1545 175.4072 22 S 4.7747 7.2560 114.0149 56.3228 64.5085 176.3196 23 P 4.1839 0.0000 0.0000 66.8131 31.2003 177.5049 24 E 3.8444 8.4497 116.8922 59.3294 28.9017 178.2503 25 I 3.7616 7.9192 118.0159 63.8122 38.3692 177.8956 26 G 4.0175 8.0754 106.2701 46.9202 0.0000 174.9889 27 E 3.9664 8.8873 120.0906 58.9845 29.5083 179.4133 28 R 3.8359 8.0750 119.2990 59.0068 30.1466 178.1572 29 V 3.6290 8.4272 118.5727 66.3693 31.4287 178.2213 30 R 3.9520 8.1299 115.2283 59.7217 29.1516 178.4920 31 T 3.8506 8.1423 116.8660 66.4376 68.4169 176.2346 32 L 4.1023 8.5982 120.6475 58.7180 41.8354 179.0816 33 V 3.5235 8.4741 117.4105 66.8283 31.1943 177.6079 34 L 4.1542 8.7819 118.5334 58.4569 41.8738 179.3949 35 G 3.6992 8.4885 106.1183 47.7095 0.0000 175.4312 36 L 4.0780 8.4367 124.5758 57.7849 40.4403 179.6046 37 V 3.6835 7.5058 118.7785 65.4635 31.6426 175.7207 38 N 4.7457 8.0277 113.0876 54.7363 40.3685 175.5847 39 S 4.2847 7.6055 110.4094 58.0968 62.9581 174.5248 40 T 4.2872 8.0994 120.3736 62.7533 66.6732 174.1389 41 L 4.8762 7.8962 124.1444 52.2426 46.2413 176.3547 42 T 4.7267 8.0979 113.4693 59.6644 71.6366 174.7496 43 I 3.8738 8.3759 126.0574 64.8200 37.1864 177.7595 44 E 3.9797 8.3886 119.1845 59.6436 29.1508 178.2679 45 E 3.9593 8.2246 117.2155 59.4507 28.9349 178.2837 46 F 4.3465 8.9795 120.5129 60.7632 39.4768 175.8873 47 H 4.0461 8.2865 117.1327 58.1889 29.9501 175.8120 48 S 4.1628 7.9510 116.1694 60.0033 62.1237 175.5322 49 K 3.7929 8.0489 120.0173 59.6942 32.2516 179.0034 50 L 3.8172 7.1625 120.3612 58.2067 42.0837 178.6111 51 Q 3.9178 7.5911 119.1812 58.7813 28.7133 177.4526 52 E 4.3853 7.8264 114.8293 56.7005 30.2369 177.2930 53 A 4.3101 7.5395 122.1615 53.4681 19.9134 177.6481 54 T 4.2288 7.7737 107.4813 60.2389 69.9301 174.8183 55 N 4.4285 8.5971 122.8077 53.4275 37.7107 173.7029 56 F 3.6488 8.8337 119.9941 55.8586 38.1963 173.1566 57 P 4.4461 0.0000 0.0000 61.7312 31.8646 175.7070 58 L 4.3604 8.6126 119.3128 54.8720 42.0926 177.1347 59 R 4.1552 8.2419 121.8165 54.6048 30.4494 174.2536 60 P 3.7999 0.0000 0.0000 63.5155 31.5586 175.3724 61 F 3.7887 7.8224 123.8155 58.0565 35.6113 174.4840 62 V 4.0157 7.5893 122.9900 64.8718 32.8304 178.0717 63 I 3.8751 7.9174 120.1404 64.0130 37.0104 176.4769 64 P 4.4775 0.0000 0.0000 64.2798 30.9095 177.3024 65 F 4.3856 7.7680 122.6513 61.1128 39.1357 176.3200 66 L 4.0783 8.1199 118.8459 56.7932 41.6301 179.4302 67 K 3.9694 7.8240 118.3303 58.4309 32.0384 177.9001 68 A 4.6214 7.4961 117.8500 51.9074 19.7812 177.0324 69 N 4.7868 7.5241 114.1800 52.4495 40.2948 175.8237 70 L 3.8490 8.0067 123.5811 57.8705 41.9498 177.0772 71 P 4.4007 0.0000 0.0000 64.8156 31.6771 177.2793 72 L 4.3158 7.5895 118.2386 56.4528 41.8961 178.2883 73 L 4.8104 8.4288 120.9671 56.3485 41.5519 178.4314 74 Q 4.2946 7.7526 115.1167 57.5503 28.9993 177.9227 75 R 4.2025 7.4908 120.7039 59.0245 30.5352 178.4357 76 E 4.0341 8.0897 116.6282 59.0886 29.0274 178.4588 77 L 3.9371 7.5934 120.2536 58.1965 41.8035 178.8544 78 L 4.1084 7.7486 117.7154 57.2402 41.7947 178.1588 79 H 4.4830 8.4682 118.5953 58.2582 29.9922 176.7999 80 A 3.6955 7.8204 122.0271 55.1042 18.1171 179.0789 81 A 3.7182 7.2400 117.8620 55.5559 18.1290 180.1501 82 R 3.8919 7.4822 115.0391 58.4460 30.1628 177.4106 83 L 4.3322 7.3540 117.6391 54.6879 42.0875 176.1806 84 A 4.5875 7.3752 117.7699 51.4104 20.1029 176.6356 85 K 3.9091 8.2212 113.3488 57.1835 29.4515 174.8917 86 Q 4.5888 7.8306 116.9310 54.4779 33.1163 174.4286 87 N 4.7575 8.4501 115.3961 52.3053 39.4693 174.9136 88 P 4.2478 0.0000 0.0000 65.3997 31.6611 177.3783 89 A 4.4073 7.9523 119.7002 52.9071 19.5843 177.4494 90 Q 4.4218 7.8180 113.4185 56.3197 29.9448 176.8506 91 Y 4.2617 8.0483 119.4781 60.5332 38.9586 177.1155 92 L 3.9008 7.9688 118.7320 57.2298 42.5584 176.9476 93 A 3.9806 7.9990 120.8838 55.0327 18.3094 179.0431 94 Q 3.9475 8.1276 111.3188 56.3857 27.1381 173.1929 95 H 4.6646 7.4248 113.6902 55.8060 33.0330 173.2768 96 E 4.1874 8.1814 122.9828 58.7291 29.9912 178.2261 97 Q 3.9731 7.9148 115.8816 58.7264 29.1991 177.2666 98 L 4.4027 7.6450 119.5951 54.9046 41.0839 174.8312 99 L 4.5464 6.9307 117.9204 55.4991 45.6706 175.8164 100 L 4.7950 7.2409 118.9082 53.8883 43.2286 177.8362 101 D 4.6142 7.7751 118.8413 53.6718 40.5022 175.5552 102 A 4.1095 7.7930 126.7490 55.3216 19.3533 178.0511 103 S 4.3016 8.0399 113.1045 58.7968 62.8650 174.0617 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 3.94 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 0 S 8.26 4.50 0.00 4.07 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 1 A 8.13 4.29 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 2 R 8.00 4.22 0.00 1.81 1.98 0.00 3.57 0.00 0.00 3.33 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.49 0.00 3 Q 8.08 3.95 0.00 2.17 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.90 0.00 0.00 0.00 0.00 0.00 2.25 2.43 0.00 4 L 7.69 4.31 0.00 2.03 1.67 0.87 0.83 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 5 S 8.06 4.25 0.00 4.00 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 6 K 8.02 3.78 0.00 1.66 1.79 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.43 7.81 7 L 7.53 4.20 0.00 1.33 1.64 0.89 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 8 K 7.89 3.76 0.00 1.83 1.96 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.77 7.81 9 R 8.05 3.91 0.00 1.95 2.02 0.00 3.21 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 10 F 8.38 4.04 0.00 3.12 3.27 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 11 L 8.70 4.07 0.00 2.04 1.78 1.03 1.19 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 12 T 8.22 4.15 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 1.28 0.00 0.00 13 T 8.11 3.82 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 1.12 0.00 0.00 14 L 8.05 3.79 0.00 1.05 1.64 1.11 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 8.27 4.16 0.00 2.30 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.66 2.50 0.00 16 Q 8.13 4.16 0.00 2.25 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.89 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 17 F 8.85 4.39 0.00 3.14 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 18 G 7.88 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 19 N 7.92 4.48 0.00 2.64 2.74 0.00 0.00 6.90 8.44 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 20 D 8.18 4.21 0.00 1.58 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 0.00 0.00 0.00 21 I 7.84 3.77 1.93 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 1.48 0.94 0.93 0.00 0.00 22 S 7.26 4.77 0.00 4.04 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 23 P 0.00 4.18 0.00 2.27 2.32 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.00 0.00 24 E 8.45 3.84 0.00 2.21 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 0.00 2.36 2.38 0.00 25 I 7.92 3.76 1.88 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 1.47 1.21 0.97 0.00 0.00 26 G 8.08 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 0.00 0.00 0.00 27 E 8.89 3.97 0.00 2.16 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 2.70 2.33 0.00 28 R 8.07 3.84 0.00 2.14 2.04 0.00 3.17 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 29 V 8.43 3.63 2.32 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 1.30 0.00 0.00 0.98 0.00 0.00 30 R 8.13 3.95 0.00 2.09 2.20 0.00 2.83 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.66 0.00 31 T 8.14 3.85 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 1.24 0.00 0.00 32 L 8.60 4.10 0.00 1.96 2.11 0.85 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.47 3.52 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 1.08 0.00 0.00 1.15 0.00 0.00 34 L 8.78 4.15 0.00 1.77 1.75 0.81 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.49 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 0.00 0.00 0.00 36 L 8.44 4.08 0.00 1.70 1.82 0.77 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 37 V 7.51 3.68 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 0.83 0.00 0.00 0.93 0.00 0.00 38 N 8.03 4.75 0.00 2.74 2.83 0.00 0.00 7.33 7.49 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 39 S 7.61 4.28 0.00 3.87 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 40 T 8.10 4.29 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 1.23 0.00 0.00 41 L 7.90 4.88 0.00 1.55 1.56 0.91 0.99 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 42 T 8.10 4.73 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 1.28 0.00 0.00 43 I 8.38 3.87 1.97 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 1.55 0.78 1.18 0.00 0.00 44 E 8.39 3.98 0.00 2.08 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 0.00 2.44 2.42 0.00 45 E 8.22 3.96 0.00 2.04 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 0.00 2.35 2.50 0.00 46 F 8.98 4.35 0.00 3.13 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 47 H 8.29 4.05 0.00 3.27 3.59 0.00 5.83 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 S 7.95 4.16 0.00 3.96 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 49 K 8.05 3.79 0.00 1.87 1.85 0.00 1.61 0.00 0.00 1.57 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.51 7.81 50 L 7.16 3.82 0.00 1.73 1.34 0.71 0.60 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 51 Q 7.59 3.92 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.51 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 52 E 7.83 4.39 0.00 2.17 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 2.45 2.37 0.00 53 A 7.54 4.31 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 54 T 7.77 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 1.26 0.00 0.00 55 N 8.60 4.43 0.00 2.98 2.98 0.00 0.00 6.21 7.39 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 56 F 8.83 3.65 0.00 3.07 3.12 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 57 P 0.00 4.45 0.00 2.11 1.97 0.00 3.62 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.75 0.00 58 L 8.61 4.36 0.00 1.57 1.61 0.94 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 59 R 8.24 4.16 0.00 1.79 1.85 0.00 2.81 0.00 0.00 2.94 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 60 P 0.00 3.80 0.00 1.95 1.86 0.00 3.77 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.91 0.00 61 F 7.82 3.79 0.00 3.27 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 62 V 7.59 4.02 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 0.97 0.00 0.00 0.88 0.00 0.00 63 I 7.92 3.88 1.92 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 0.70 0.98 0.00 0.00 64 P 0.00 4.48 0.00 2.31 2.29 0.00 3.91 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 2.30 2.19 0.00 65 F 7.77 4.39 0.00 3.46 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 66 L 8.12 4.08 0.00 1.57 1.34 0.74 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 67 K 7.82 3.97 0.00 1.88 1.91 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.57 1.68 7.81 68 A 7.50 4.62 1.21 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 0.00 0.00 69 N 7.52 4.79 0.00 2.67 2.73 0.00 0.00 6.40 6.26 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 70 L 8.01 3.85 0.00 1.76 1.65 0.91 0.98 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 71 P 0.00 4.40 0.00 2.24 2.14 0.00 3.64 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.02 0.00 72 L 7.59 4.32 0.00 1.71 1.71 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.43 4.81 0.00 1.70 1.69 1.02 0.74 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 74 Q 7.75 4.29 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.88 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 75 R 7.49 4.20 0.00 2.00 1.98 0.00 3.23 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 76 E 8.09 4.03 0.00 2.20 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 0.00 2.60 2.38 0.00 77 L 7.59 3.94 0.00 1.90 1.74 1.10 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.75 4.11 0.00 1.90 1.71 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 79 H 8.47 4.48 0.00 3.16 3.38 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 7.82 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 7.24 3.72 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 82 R 7.48 3.89 0.00 1.79 1.95 0.00 3.28 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.77 0.00 83 L 7.35 4.33 0.00 1.42 1.51 0.87 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 84 A 7.38 4.59 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 85 K 8.22 3.91 0.00 1.92 1.93 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.50 7.81 86 Q 7.83 4.59 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.85 6.98 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 87 N 8.45 4.76 0.00 2.79 2.76 0.00 0.00 6.62 8.05 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 88 P 0.00 4.25 0.00 2.19 2.17 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 89 A 7.95 4.41 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 90 Q 7.82 4.42 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 91 Y 8.05 4.26 0.00 3.05 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 92 L 7.97 3.90 0.00 1.55 1.65 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.00 3.98 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 0.00 0.00 0.00 0.00 0.00 94 Q 8.13 3.95 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.52 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 95 H 7.42 4.66 0.00 3.15 3.13 0.00 5.94 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 96 E 8.18 4.19 0.00 2.00 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 2.29 2.34 0.00 97 Q 7.91 3.97 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.39 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 98 L 7.64 4.40 0.00 1.63 1.65 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 99 L 6.93 4.55 0.00 1.70 1.57 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 100 L 7.24 4.80 0.00 1.61 1.55 0.92 1.01 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 0.00 101 D 7.78 4.61 0.00 2.79 2.61 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 0.00 102 A 7.79 4.11 1.29 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 0.00 103 S 8.04 4.30 0.00 3.99 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