NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5547 8.3644 120.5312 53.8212 42.2611 174.6028 2 V 3.4830 8.2059 122.0695 61.8915 32.0332 170.1521 3 V 4.0770 9.6872 129.9946 62.4374 33.6698 173.8852 4 M 5.1362 8.6667 128.0309 54.1332 34.1446 175.0791 5 T 4.9003 9.1228 114.2485 59.8539 71.9649 172.9560 6 Q 5.2872 8.8089 122.2645 54.7729 32.1812 174.2985 7 T 4.8951 8.8214 110.2906 59.5590 72.6331 172.0076 8 P 4.8393 0.0000 0.0000 61.6434 33.2032 175.7920 9 L 4.3692 8.4856 119.7878 57.6517 42.9942 176.6927 10 S 5.1027 8.0013 112.7620 56.6365 66.4912 174.2582 11 L 4.6378 9.1660 126.3269 52.4289 43.0074 172.2010 12 P 5.0953 0.0000 0.0000 62.1025 32.1918 175.8679 13 V 4.6012 8.9339 116.9811 59.6365 36.6701 174.9957 14 S 4.6993 8.5081 118.2104 57.7118 64.3518 174.0138 15 L 4.2408 8.4474 122.7119 56.8022 41.8715 178.0812 16 G 3.9313 9.3655 111.6310 45.3509 0.0000 173.1877 17 N 4.7788 7.7745 117.2926 52.5071 40.4774 173.9143 18 Q 4.7620 8.4138 121.2181 55.4534 30.4326 174.5977 19 A 4.7846 8.9045 127.1664 50.0729 22.4526 174.8371 20 S 4.9223 8.5160 115.1356 56.5008 65.5176 172.9208 21 I 4.5266 8.6471 128.0930 59.7448 39.6216 174.7140 22 S 5.3536 8.7826 123.0291 57.4758 65.1113 172.4665 23 C 5.5933 9.6947 123.8096 54.9391 46.0578 172.5449 24 R 5.5124 9.5521 126.2203 54.5926 32.6959 174.1261 25 S 5.4509 9.0924 120.0681 56.5928 65.6335 175.0462 26 S 4.5373 8.7156 116.1736 60.4810 63.3920 173.7397 27 Q 4.5617 7.5094 113.9211 54.1909 31.5215 174.1454 27A S 4.2305 8.6065 113.1697 59.2807 62.6982 173.7642 27B L 4.5055 8.9989 126.4579 54.5643 41.5443 176.3188 27C V 4.0412 7.6349 120.0097 62.6681 31.3028 175.5830 27D H 4.5074 9.2793 128.1442 55.7659 30.3988 176.3393 27E S 4.2085 8.1277 118.8872 61.0831 62.6941 175.1824 28 N 4.6204 8.4991 115.7552 52.9338 37.3895 175.9998 29 G 3.9878 8.5703 108.6235 45.6565 0.0000 173.7517 30 N 4.6031 8.4880 117.4139 52.5117 40.1034 174.3062 31 T 5.1511 7.6472 115.2095 61.5375 70.8887 174.2656 32 Y 4.3938 8.1754 129.0622 56.3343 36.3596 174.3127 33 L 4.5197 7.0693 122.4908 53.4637 44.7251 175.3561 34 H 5.3777 8.9577 122.6104 53.7137 33.3422 172.3568 35 W 5.4768 9.2985 119.7527 55.3406 32.2970 174.4528 36 Y 5.2022 9.8304 121.8470 56.1610 40.9829 174.2592 37 L 4.9230 8.9794 124.2625 53.2403 44.9933 174.6917 38 Q 4.8819 9.2315 127.6412 54.3617 31.6487 174.9289 39 K 4.7782 8.5174 125.2758 54.2189 34.8159 174.3547 40 P 4.4070 0.0000 0.0000 64.1029 31.5532 177.3523 41 G 3.8988 8.9842 110.2361 45.7875 0.0000 172.4994 42 Q 4.6822 7.7218 117.7554 53.4107 31.8652 175.1055 43 S 4.5143 8.1965 113.6031 57.1560 64.4041 172.3841 44 P 4.6022 0.0000 0.0000 62.8996 31.8278 175.8388 45 K 4.7432 8.9616 123.4229 54.1175 34.9413 175.4964 46 L 3.4654 8.5438 126.7975 55.5709 42.0775 174.7658 47 L 4.5719 9.0628 127.4623 56.1689 44.2068 175.4306 48 I 5.2549 7.6978 118.6292 59.4738 40.9251 173.5769 49 Y 4.9922 8.6598 123.9397 55.1970 41.3553 175.0977 50 K 4.3284 9.5914 117.7117 56.5899 30.0488 174.6879 51 V 3.9038 8.9118 127.1063 63.2198 32.1197 173.0662 52 S 4.6796 7.5341 107.1022 57.4588 64.8311 172.7833 53 N 4.5363 7.9048 120.5064 52.2858 39.6556 174.5378 54 R 4.4802 8.4040 123.4861 55.6822 31.1351 176.4596 55 F 4.8723 9.4090 127.0666 57.6307 41.3080 174.4774 56 S 4.1045 7.0614 117.6794 60.2343 62.5939 175.3146 57 G 3.8989 8.9647 113.4586 45.1907 0.0000 172.8851 58 V 3.9791 7.5200 120.4144 60.7560 32.3680 174.1834 59 P 4.5283 0.0000 0.0000 62.8660 31.6338 176.6312 60 D 4.6645 8.5775 118.2590 54.8404 39.7466 177.4240 61 R 3.9608 7.9389 119.6390 58.6743 31.2750 176.0044 62 F 4.8992 8.1019 118.8174 56.3152 39.9132 175.6881 63 S 4.6147 9.1228 119.0493 56.4789 65.7393 173.3379 64 G 4.7278 8.6858 111.4119 44.4289 0.0000 172.5434 65 S 4.8008 9.7491 118.2201 57.0353 68.3585 171.9887 66 G 3.9892 8.6365 106.2954 44.8689 0.0000 172.9342 67 S 4.4836 8.3011 111.1073 58.2121 67.2729 178.4392 68 G 3.9413 9.2857 114.1081 46.5886 0.0000 174.5930 69 T 5.2304 8.6598 114.9645 60.4289 72.1053 174.8736 70 D 5.2559 7.6846 123.1492 52.6257 43.9316 174.9860 71 F 5.4575 9.4960 121.6370 56.1460 44.0578 174.0099 72 T 5.3439 9.3144 116.5196 62.0248 73.1020 172.6353 73 L 4.5280 8.4603 127.8474 53.0628 43.9905 174.6488 74 K 4.7411 8.8495 128.5070 54.7266 34.5385 174.7660 75 I 4.2931 8.5767 128.9279 59.5331 38.7234 175.1456 76 S 4.3408 8.5854 124.1618 58.2814 63.5452 175.0272 77 R 3.8532 8.2207 119.6609 55.4403 27.3991 176.8612 78 V 3.6652 8.0442 118.0318 63.4979 32.6481 174.6866 79 E 4.9638 9.2417 125.0999 53.9213 33.0629 176.9613 80 A 4.0507 8.4941 122.6929 55.1500 18.5870 179.8855 81 E 4.0997 8.2078 112.9672 59.2886 29.6702 177.7000 82 D 4.8718 8.1282 117.8286 55.2760 41.3484 176.8245 83 L 4.1695 7.6941 119.6365 54.4728 42.4291 177.8897 84 G 3.8334 6.7492 108.4334 44.5879 0.0000 170.8522 85 V 4.7565 7.9766 120.6689 61.3430 33.5769 174.8978 86 Y 5.1169 9.1967 126.4900 56.8736 39.9674 174.5515 87 F 5.5983 9.8161 123.3216 55.8925 42.2309 172.6697 88 C 4.5131 9.3220 118.4312 55.0334 39.8024 172.4029 89 S 4.9480 8.2254 113.0358 57.1965 65.9297 172.9954 90 Q 4.9211 8.4603 123.9075 53.9534 31.3336 175.6146 91 S 3.9272 8.4017 115.5664 58.3814 63.4813 175.4940 92 T 3.9747 8.3515 119.1765 66.7392 68.5085 174.6112 93 H 4.9967 8.6709 117.1631 53.7538 31.2487 173.6141 94 V 4.1748 8.2671 122.9430 60.8458 32.4413 174.0031 95 P 4.4207 0.0000 0.0000 61.9699 32.3025 175.8913 96 F 4.8348 8.2214 119.1817 58.2554 39.6345 174.4901 97 T 4.8625 8.3052 111.9564 60.0627 72.7711 172.4726 98 F 5.2239 8.6220 119.1901 55.4632 41.6404 175.3976 99 G 4.0653 9.3133 112.0262 45.8256 0.0000 174.7128 100 S 4.3859 8.5671 114.8487 59.5099 63.2241 175.8610 101 G 3.5470 8.2976 104.3441 45.2350 0.0000 173.1918 102 T 4.7992 8.4651 116.0985 61.4061 72.5956 173.2026 103 K 4.7193 9.1311 129.8177 55.5647 33.2188 175.5093 104 L 4.8821 8.9271 131.3378 54.8536 43.2871 175.4118 105 E 5.0179 9.0566 123.1217 54.7138 33.7279 174.2466 106 I 4.7686 8.4011 122.3231 60.6241 37.9418 175.2542 107 K 4.6523 8.8115 127.3974 55.0791 34.7577 176.8685 108 R 4.2043 8.3605 120.2311 56.5140 30.7728 175.4565 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 D 8.36 4.55 0.00 2.70 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.21 3.48 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 0.72 0.00 0.00 0.84 0.00 0.00 3 V 9.69 4.08 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 0.92 0.00 0.00 0.98 0.00 0.00 4 M 8.67 5.14 0.00 1.94 2.10 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 5 T 9.12 4.90 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 1.25 0.00 0.00 6 Q 8.81 5.29 0.00 2.34 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.78 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 7 T 8.82 4.90 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 1.25 0.00 0.00 8 P 0.00 4.84 0.00 2.36 2.13 0.00 3.79 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.95 0.00 9 L 8.49 4.37 0.00 1.74 1.72 1.01 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.00 5.10 0.00 3.75 3.92 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 11 L 9.17 4.64 0.00 1.62 1.50 0.92 0.91 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 12 P 0.00 5.10 0.00 1.98 1.98 0.00 3.67 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 2.03 2.30 0.00 13 V 8.93 4.60 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 0.72 0.00 0.00 0.93 0.00 0.00 14 S 8.51 4.70 0.00 3.76 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 15 L 8.45 4.24 0.00 1.62 1.62 0.92 1.01 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 16 G 9.37 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 0.00 0.00 0.00 17 N 7.77 4.78 0.00 2.91 2.71 0.00 0.00 6.45 7.62 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 18 Q 8.41 4.76 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.70 0.00 0.00 0.00 0.00 0.00 2.22 2.41 0.00 19 A 8.90 4.78 1.07 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 20 S 8.52 4.92 0.00 3.76 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 21 I 8.65 4.53 1.59 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.46 1.15 0.00 0.00 22 S 8.78 5.35 0.00 3.87 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 23 C 9.69 5.59 0.00 3.04 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 24 R 9.55 5.51 0.00 1.88 1.75 0.00 3.13 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.84 0.00 25 S 9.09 5.45 0.00 3.94 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 S 8.72 4.54 0.00 3.93 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 27 Q 7.51 4.56 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.80 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 27A S 8.61 4.23 0.00 3.89 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 27B L 9.00 4.51 0.00 1.86 1.64 0.66 1.05 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 27C V 7.63 4.04 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 0.76 0.00 0.00 0.99 0.00 0.00 27D H 9.28 4.51 0.00 3.42 3.64 0.00 5.64 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27E S 8.13 4.21 0.00 3.80 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 28 N 8.50 4.62 0.00 2.92 3.06 0.00 0.00 6.19 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 29 G 8.57 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 30 N 8.49 4.60 0.00 2.98 2.26 0.00 0.00 6.63 7.26 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 31 T 7.65 5.15 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 1.30 0.00 0.00 32 Y 8.18 4.39 0.00 2.88 2.77 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 33 L 7.07 4.52 0.00 0.84 0.85 0.39 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 34 H 8.96 5.38 0.00 2.85 3.03 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 W 9.30 5.48 0.00 3.23 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 36 Y 9.83 5.20 0.00 3.11 2.95 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 37 L 8.98 4.92 0.00 1.37 1.35 -0.02 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 9.23 4.88 0.00 2.31 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.53 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 39 K 8.52 4.78 0.00 1.72 1.71 0.00 1.75 0.00 0.00 1.88 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.41 7.81 40 P 0.00 4.41 0.00 2.05 2.01 0.00 3.76 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 41 G 8.98 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 42 Q 7.72 4.68 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.88 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 43 S 8.20 4.51 0.00 3.81 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 44 P 0.00 4.60 0.00 1.66 1.93 0.00 3.45 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.82 0.00 45 K 8.96 4.74 0.00 1.69 1.75 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.55 1.53 7.81 46 L 8.54 3.47 0.00 1.10 0.51 0.27 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 47 L 9.06 4.57 0.00 1.74 1.85 0.40 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 48 I 7.70 5.25 2.17 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 1.43 0.77 1.09 0.00 0.00 49 Y 8.66 4.99 0.00 2.86 2.85 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 50 K 9.59 4.33 0.00 1.83 1.68 0.00 2.04 0.00 0.00 2.49 0.00 0.00 2.63 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.99 1.61 7.81 51 V 8.91 3.90 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 1.13 0.00 0.00 0.97 0.00 0.00 52 S 7.53 4.68 0.00 3.93 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 53 N 7.90 4.54 0.00 1.44 1.82 0.00 0.00 6.98 6.94 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 54 R 8.40 4.48 0.00 1.72 1.93 0.00 3.25 0.00 0.00 3.47 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 55 F 9.41 4.87 0.00 3.23 3.02 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 56 S 7.06 4.10 0.00 3.58 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 57 G 8.96 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 0.00 0.00 0.00 58 V 7.52 3.98 2.25 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 0.69 0.00 0.00 0.98 0.00 0.00 59 P 0.00 4.53 0.00 2.41 2.28 0.00 3.87 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.19 0.00 60 D 8.58 4.66 0.00 2.82 2.85 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 61 R 7.94 3.96 0.00 1.52 1.89 0.00 3.18 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 62 F 8.10 4.90 0.00 3.05 2.96 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 63 S 9.12 4.61 0.00 3.81 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 64 G 8.69 4.73 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 0.00 0.00 0.00 65 S 9.75 4.80 0.00 3.74 3.74 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 66 G 8.64 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 67 S 8.30 4.48 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 68 G 9.29 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 69 T 8.66 5.23 4.44 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 1.26 0.00 0.00 70 D 7.68 5.26 0.00 2.39 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.50 5.46 0.00 3.11 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 72 T 9.31 5.34 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 1.23 0.00 0.00 73 L 8.46 4.53 0.00 0.27 0.23 0.59 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.85 4.74 0.00 1.72 1.52 0.00 1.54 0.00 0.00 1.74 0.00 0.00 2.78 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.21 1.29 7.81 75 I 8.58 4.29 1.58 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.28 0.35 0.00 0.00 76 S 8.59 4.34 0.00 3.61 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 77 R 8.22 3.85 0.00 1.82 1.87 0.00 3.24 0.00 0.00 2.25 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.48 0.00 78 V 8.04 3.67 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 0.97 0.00 0.00 0.84 0.00 0.00 79 E 9.24 4.96 0.00 2.02 1.82 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 2.19 2.35 0.00 80 A 8.49 4.05 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 81 E 8.21 4.10 0.00 2.13 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 0.00 2.50 2.52 0.00 82 D 8.13 4.87 0.00 2.91 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 83 L 7.69 4.17 0.00 1.78 1.65 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 84 G 6.75 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 85 V 7.98 4.76 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 0.26 0.00 0.00 0.91 0.00 0.00 86 Y 9.20 5.12 0.00 2.98 3.14 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 87 F 9.82 5.60 0.00 3.19 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 88 C 9.32 4.51 0.00 1.85 1.18 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 89 S 8.23 4.95 0.00 4.00 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 90 Q 8.46 4.92 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.62 0.00 0.00 0.00 0.00 0.00 2.17 2.17 0.00 91 S 8.40 3.93 0.00 2.72 2.91 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 92 T 8.35 3.97 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 1.05 0.00 0.00 93 H 8.67 5.00 0.00 3.12 3.21 0.00 5.64 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 V 8.27 4.17 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 0.70 0.00 0.00 0.94 0.00 0.00 95 P 0.00 4.42 0.00 2.20 1.97 0.00 3.83 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 96 F 8.22 4.83 0.00 2.84 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 97 T 8.31 4.86 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 1.34 0.00 0.00 98 F 8.62 5.22 0.00 2.81 2.91 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 99 G 9.31 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 0.00 100 S 8.57 4.39 0.00 3.96 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 0.00 101 G 8.30 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 0.00 0.00 0.00 102 T 8.47 4.80 4.36 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 1.26 0.00 0.00 103 K 9.13 4.72 0.00 1.81 1.71 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.40 7.81 104 L 8.93 4.88 0.00 2.05 1.75 0.88 0.59 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 0.00 105 E 9.06 5.02 0.00 2.05 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 2.20 2.29 0.00 106 I 8.40 4.77 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 1.42 0.84 0.91 0.00 0.00 107 K 8.81 4.65 0.00 1.71 1.78 0.00 1.54 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.38 7.81 108 R 8.36 4.20 0.00 1.77 1.81 0.00 3.24 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00