NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1573 8.1727 122.0505 56.2969 34.0832 174.0114 2 V 4.5857 8.1971 127.4241 60.7654 32.1732 174.5054 3 F 4.2866 10.1738 129.2987 57.4906 40.2011 174.9887 4 E 4.2128 8.7072 120.9210 55.6490 31.0465 176.8910 5 R 3.2217 8.9437 121.2501 60.7499 29.9770 179.5097 6 C 4.3606 8.0002 115.3986 59.5491 34.5362 175.8131 7 E 3.8991 8.0654 120.9624 59.1800 29.3363 178.3996 8 L 3.6430 7.9643 120.2217 57.7853 42.0628 178.6396 9 A 3.9430 7.7393 120.4040 55.4225 18.3875 179.9113 10 R 3.8993 7.8148 115.9876 59.5530 29.9517 179.5035 11 T 3.8493 7.7633 115.1266 66.6956 68.6093 176.8037 12 L 3.8742 8.2245 121.3181 57.4910 41.6891 179.5039 13 K 3.9603 8.0010 119.7776 59.4300 31.9308 178.8571 14 R 4.0349 7.8230 117.7977 58.4618 30.0082 177.3164 15 L 4.4595 7.2363 117.4095 53.9016 41.7360 176.6096 16 G 3.8813 7.7157 106.0919 47.0270 0.0000 175.3151 17 M 3.9135 7.7189 120.9786 56.4184 32.4038 175.8207 18 D 4.4052 8.0163 118.0026 55.8932 41.2249 175.8213 19 G 3.9403 9.3601 115.6456 45.4245 0.0000 171.4342 20 Y 4.2652 8.2159 121.8689 58.6294 38.8859 176.3423 21 R 3.6082 8.9674 127.1047 57.3355 27.7242 177.2755 22 G 3.8257 8.1776 103.2374 45.7665 0.0000 173.9545 23 I 4.1241 7.6187 122.0401 59.1046 38.2526 175.8774 24 S 4.6489 8.3239 120.2285 57.6708 64.1234 174.7785 25 L 4.1972 9.0017 123.8892 58.7676 41.7785 179.4692 26 A 4.1741 8.2102 119.8372 55.3215 18.2182 179.2089 27 N 4.4729 8.2784 115.2321 56.2464 38.6066 177.7083 28 W 4.2647 7.9930 120.0050 59.8474 29.1991 178.4268 29 M 4.1756 8.3415 118.9871 58.4469 31.5001 177.8875 30 C 3.2089 8.0962 118.6765 59.0884 44.7492 175.3020 31 L 3.9495 8.1682 121.6926 58.2863 41.7860 178.6558 32 A 4.1017 8.2783 120.6530 55.0710 18.1245 179.4337 33 K 2.8430 8.0445 117.8549 59.2742 32.0665 178.8825 34 W 4.2481 7.5207 116.1617 58.4329 29.2126 178.4955 35 E 4.2736 8.2538 118.3529 58.6732 29.5351 177.4998 36 A 4.5374 7.6625 117.2298 50.7042 20.9320 176.1425 37 G 3.5855 7.8023 103.7046 46.8421 0.0000 173.9556 38 Y 3.6947 7.7797 112.9898 58.4463 35.5813 168.5341 39 N 5.3691 7.5567 118.9622 51.9973 39.9458 175.8371 40 T 3.9766 9.0756 117.5906 63.8730 69.2328 175.9733 41 R 4.4786 8.0408 116.8638 55.7316 30.0591 176.1534 42 A 4.3482 7.5990 122.3694 52.5678 19.2376 177.0765 43 T 5.0224 8.4056 111.4855 60.0186 72.5622 173.2581 44 N 4.8268 8.6907 121.6504 52.5270 42.5559 172.4988 45 Y 4.6455 8.7691 128.3169 57.4150 40.7288 173.9330 46 N 4.8055 8.3873 124.9171 51.0054 38.4061 175.2158 47 A 3.7131 8.2380 127.1399 54.6342 18.9307 179.4245 48 G 3.7072 8.0205 104.4076 47.9926 0.0000 173.9294 49 D 4.7362 7.4774 115.0668 52.0316 40.2026 175.6830 50 R 3.9879 8.1228 116.4274 57.1279 28.0591 175.7758 51 S 4.9963 7.7325 111.5392 57.0012 66.6885 172.5561 52 T 5.0636 8.5901 115.7875 61.9693 72.7640 172.8617 53 D 5.4355 8.8547 125.5172 53.4443 43.1155 175.0364 54 Y 4.9535 9.4576 121.1539 57.5351 41.4427 177.1778 55 G 4.4151 9.0926 111.9649 46.3249 0.0000 173.3592 56 I 3.6174 8.2462 117.3757 63.4577 37.9440 177.4283 57 F 4.6549 7.9039 115.6234 56.3635 39.7966 175.4510 58 Q 3.4699 7.8339 119.1034 57.0909 26.6514 174.0442 59 I 4.4136 8.0653 118.9903 61.1305 39.4464 176.6690 60 N 5.4181 9.1812 125.4485 53.1920 39.8307 175.7330 61 S 4.7536 9.0002 120.7104 60.1686 63.2665 175.4187 62 R 3.7412 8.6197 122.1300 58.6059 30.3724 177.6738 63 Y 4.1577 7.6821 114.6666 57.9444 40.6783 177.1832 64 W 4.6496 8.0301 118.8640 57.5880 30.4467 173.6508 65 C 5.5571 7.9309 110.6152 53.4450 45.4145 171.8229 66 N 4.9194 8.8496 119.5607 52.1494 39.6395 174.7522 67 D 4.7422 8.4868 122.9989 52.2551 40.2813 178.0378 68 G 4.0291 8.4809 107.3308 46.2544 0.0000 174.6990 69 K 4.4703 7.9928 116.5292 56.6283 33.1704 175.7631 70 T 4.4553 7.7779 116.9309 61.3850 69.4556 172.8356 71 P 4.1916 0.0000 0.0000 64.2726 31.8329 176.2953 72 G 3.9411 8.6021 110.1146 46.2823 0.0000 173.0311 73 A 4.3548 7.7448 119.8400 50.9340 20.0205 177.5331 74 V 4.4346 8.1079 113.0800 59.6500 35.3389 176.0890 75 N 4.9243 8.0288 116.4841 51.7028 38.4856 174.2905 76 A 3.9116 8.5705 124.2345 55.2062 19.0725 178.5899 77 C 4.4788 8.3672 110.9616 57.5628 40.9670 173.0279 78 H 4.1366 7.9974 116.4578 56.5783 26.3442 173.8138 79 L 4.8124 8.4635 117.6608 53.0666 46.5626 176.2739 80 S 4.7427 8.3105 114.6640 57.7272 63.4550 175.9969 81 C 4.1319 8.5936 124.2205 59.7556 38.1527 176.3421 82 S 3.9039 7.7096 114.9566 61.3396 61.6271 176.0331 83 A 4.1328 7.7769 122.3868 54.4172 18.0044 177.8997 84 L 4.4827 7.7569 116.6274 54.9651 41.6440 177.6296 85 L 5.0555 7.7917 116.7764 54.5066 42.5196 176.7046 86 Q 4.3767 7.8286 118.0090 55.3405 29.5602 175.8735 87 D 4.4036 8.4790 119.0836 56.9461 41.1300 176.6756 88 N 4.5965 8.0177 118.1093 53.0062 38.9631 174.6181 89 I 4.1792 8.4622 119.1213 61.1319 37.9203 176.9403 90 A 3.9461 8.4008 124.8461 56.0642 18.0843 180.1178 91 D 4.2991 8.0736 116.3950 57.3556 40.9293 178.6124 92 A 4.0819 8.0103 120.9008 55.2145 18.3366 179.7555 93 V 3.3859 8.0911 116.5934 65.9819 31.4548 178.1147 94 A 3.8184 7.9431 120.5918 55.2960 18.1789 178.8400 95 C 4.2267 8.6177 117.1622 59.5749 38.2029 175.5941 96 A 3.9201 8.2057 122.9042 55.0478 17.6317 179.6538 97 K 3.7597 7.6828 116.2183 59.4072 32.2752 179.2555 98 R 4.0545 7.5525 118.9147 59.4453 29.9695 178.4246 99 V 2.4016 7.1956 117.9835 65.8922 31.0882 177.8044 100 V 3.9031 7.2994 108.0407 62.4150 31.6619 177.7350 101 R 4.2027 7.8639 117.6553 56.7368 30.6125 176.3447 102 D 4.7411 7.2524 119.9501 52.5048 42.0247 175.3494 103 P 4.2077 0.0000 0.0000 66.3523 31.1075 177.8963 104 Q 4.0159 8.1556 117.5826 56.3763 29.9643 177.4240 105 G 3.6622 7.7573 106.7136 46.2731 0.0000 176.9697 106 I 3.5186 7.8197 122.4243 63.4318 37.8104 177.5381 107 R 4.2403 7.2913 117.2716 57.6328 29.8946 177.4840 108 A 3.9009 7.5097 120.7628 53.8589 18.5222 177.4724 109 W 4.8158 7.9229 117.0871 55.1902 30.3459 177.4537 110 V 3.7214 8.7381 123.5130 65.9995 30.9711 177.6653 111 A 4.0686 8.3108 120.1145 54.7499 18.0896 179.2506 112 W 3.9902 8.2296 127.2137 60.7190 30.5743 178.4333 113 R 3.6111 8.1422 116.3937 59.2470 29.6514 178.3957 114 N 4.3778 7.9741 115.5030 55.3587 38.7267 176.7694 115 R 4.1364 7.7681 113.9553 55.9611 30.7547 175.6420 116 C 4.5806 7.1825 115.7255 58.0665 42.8228 174.1883 117 Q 3.3725 6.6168 119.8810 57.2851 28.6679 175.6513 118 N 4.1903 8.7065 120.1665 54.0516 36.1607 173.7434 119 R 4.4760 7.3962 116.4431 54.1317 32.6985 175.9991 120 D 4.5637 8.3481 118.9638 54.0237 40.0744 175.7045 121 V 4.5092 8.1431 118.0944 61.1613 32.4182 178.5548 122 R 4.0590 8.1402 122.3671 59.2257 30.0221 178.9496 123 Q 4.0177 8.0263 114.6553 59.0475 28.4886 177.4821 124 Y 4.3228 7.6781 115.4498 60.1701 37.9658 176.8660 125 V 4.4278 7.8752 110.8728 60.8270 32.5050 175.1729 126 Q 4.0748 8.0122 120.2236 57.0429 28.8775 176.8586 127 G 3.9780 8.9111 110.4912 45.9600 0.0000 174.6367 128 C 4.4055 7.8651 115.9356 56.9787 40.5757 173.6519 129 G 3.8258 8.0261 107.2543 47.0068 0.0000 174.1852 130 V 4.0005 7.9043 117.6064 61.0879 32.0049 176.0622 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 K 8.17 4.16 0.00 1.84 1.65 0.00 1.28 0.00 0.00 0.90 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.88 1.11 7.81 2 V 8.20 4.59 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 0.90 0.00 0.00 0.94 0.00 0.00 3 F 10.17 4.29 0.00 2.96 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 4 E 8.71 4.21 0.00 1.89 1.85 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 2.28 2.38 0.00 5 R 8.94 3.22 0.00 1.90 1.89 0.00 3.44 0.00 0.00 3.47 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 6 C 8.00 4.36 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 7 E 8.07 3.90 0.00 2.06 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 2.57 2.41 0.00 8 L 7.96 3.64 0.00 1.45 1.45 -0.04 0.82 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 9 A 7.74 3.94 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 10 R 7.81 3.90 0.00 1.88 1.99 0.00 3.14 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.76 3.85 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 1.21 0.00 0.00 12 L 8.22 3.87 0.00 1.58 1.59 0.94 0.35 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 13 K 8.00 3.96 0.00 1.94 1.95 0.00 1.65 0.00 0.00 1.58 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.82 4.03 0.00 2.02 2.02 0.00 3.30 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.24 4.46 0.00 1.59 1.53 0.83 0.87 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 16 G 7.72 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 17 M 7.72 3.91 0.00 1.39 1.99 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.23 0.00 18 D 8.02 4.41 0.00 2.67 2.67 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 19 G 9.36 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 20 Y 8.22 4.27 0.00 3.34 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 21 R 8.97 3.61 0.00 1.90 1.84 0.00 3.21 0.00 0.00 2.96 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.38 0.00 22 G 8.18 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 23 I 7.62 4.12 1.82 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.75 -0.13 0.00 0.00 24 S 8.32 4.65 0.00 4.07 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 25 L 9.00 4.20 0.00 2.10 1.82 0.98 1.13 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 26 A 8.21 4.17 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.28 4.47 0.00 2.82 2.77 0.00 0.00 6.91 7.15 0.00 0.00 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 W 7.99 4.26 0.00 3.52 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 29 M 8.34 4.18 0.00 2.16 2.34 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.90 0.00 30 C 8.10 3.21 0.00 2.66 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 L 8.17 3.95 0.00 1.87 1.87 0.69 -0.33 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 32 A 8.28 4.10 1.44 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 0.00 0.00 0.00 33 K 8.04 2.84 0.00 1.61 1.78 0.00 0.67 0.00 0.00 1.16 0.00 0.00 2.59 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.09 0.23 7.81 34 W 7.52 4.25 0.00 3.33 3.26 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 35 E 8.25 4.27 0.00 1.99 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 2.52 2.33 0.00 36 A 7.66 4.54 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 G 7.80 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 0.00 0.00 0.00 38 Y 7.78 3.69 0.00 3.21 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 39 N 7.56 5.37 0.00 2.93 2.82 0.00 0.00 7.00 7.10 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 40 T 9.08 3.98 4.43 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 1.48 0.00 0.00 41 R 8.04 4.48 0.00 2.00 2.10 0.00 3.08 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 42 A 7.60 4.35 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 43 T 8.41 5.02 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 1.33 0.00 0.00 44 N 8.69 4.83 0.00 2.93 2.67 0.00 0.00 6.99 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 45 Y 8.77 4.65 0.00 3.07 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 46 N 8.39 4.81 0.00 2.64 2.60 0.00 0.00 6.55 8.10 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 47 A 8.24 3.71 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 48 G 8.02 3.71 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 0.00 0.00 0.00 49 D 7.48 4.74 0.00 2.71 2.68 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 50 R 8.12 3.99 0.00 2.05 2.20 0.00 3.12 0.00 0.00 3.19 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 51 S 7.73 5.00 0.00 3.88 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 52 T 8.59 5.06 4.11 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 0.64 0.00 0.00 53 D 8.85 5.44 0.00 2.73 2.75 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 54 Y 9.46 4.95 0.00 2.94 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 55 G 9.09 4.42 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 0.00 56 I 8.25 3.62 1.68 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.69 0.14 0.00 0.00 57 F 7.90 4.65 0.00 3.22 3.01 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 58 Q 7.83 3.47 0.00 2.48 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.85 0.00 0.00 0.00 0.00 0.00 2.53 2.69 0.00 59 I 8.07 4.41 2.14 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.98 1.15 0.00 0.00 60 N 9.18 5.42 0.00 3.05 3.11 0.00 0.00 6.96 7.37 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 61 S 9.00 4.75 0.00 4.08 4.39 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 62 R 8.62 3.74 0.00 1.61 1.28 0.00 2.68 0.00 0.00 2.89 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.08 0.00 63 Y 7.68 4.16 0.00 1.43 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 0.00 0.00 0.00 64 W 8.03 4.65 0.00 3.59 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 65 C 7.93 5.56 0.00 3.15 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 66 N 8.85 4.92 0.00 2.80 2.70 0.00 0.00 7.07 8.34 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 67 D 8.49 4.74 0.00 2.97 2.74 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 68 G 8.48 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 0.00 0.00 0.00 69 K 7.99 4.47 0.00 1.84 1.90 0.00 1.63 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.45 7.81 70 T 7.78 4.46 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 1.17 0.00 0.00 71 P 0.00 4.19 0.00 2.01 1.99 0.00 3.82 0.00 0.00 3.88 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 72 G 8.60 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 73 A 7.74 4.35 1.25 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 74 V 8.11 4.43 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 0.64 0.00 0.00 0.84 0.00 0.00 75 N 8.03 4.92 0.00 2.73 2.65 0.00 0.00 6.75 7.70 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 76 A 8.57 3.91 1.25 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 77 C 8.37 4.48 0.00 3.36 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 78 H 8.00 4.14 0.00 3.31 3.36 0.00 5.63 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.46 4.81 0.00 1.66 1.50 0.96 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.31 4.74 0.00 3.83 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 81 C 8.59 4.13 0.00 2.27 1.40 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 0.00 82 S 7.71 3.90 0.00 3.79 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 83 A 7.78 4.13 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 84 L 7.76 4.48 0.00 1.92 1.79 1.06 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.79 5.06 0.00 1.80 1.71 1.12 1.13 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 86 Q 7.83 4.38 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.66 7.11 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 87 D 8.48 4.40 0.00 2.65 2.68 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 88 N 8.02 4.60 0.00 2.70 2.76 0.00 0.00 6.99 7.94 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 89 I 8.46 4.18 1.78 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.46 0.96 0.00 0.00 90 A 8.40 3.95 1.37 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 0.00 0.00 0.00 91 D 8.07 4.30 0.00 2.72 2.74 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 92 A 8.01 4.08 1.40 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 0.00 0.00 0.00 93 V 8.09 3.39 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 0.75 0.00 0.00 0.93 0.00 0.00 94 A 7.94 3.82 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 95 C 8.62 4.23 0.00 3.10 3.28 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 96 A 8.21 3.92 0.82 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 97 K 7.68 3.76 0.00 1.65 1.50 0.00 1.32 0.00 0.00 0.88 0.00 0.00 2.22 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 1.01 7.81 98 R 7.55 4.05 0.00 1.93 2.15 0.00 3.29 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 1.85 1.94 0.00 99 V 7.20 2.40 1.72 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 -0.23 0.00 0.00 -0.53 0.00 0.00 100 V 7.30 3.90 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 0.95 0.00 0.00 1.35 0.00 0.00 101 R 7.86 4.20 0.00 2.08 2.03 0.00 3.23 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 102 D 7.25 4.74 0.00 2.99 2.59 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 0.00 103 P 0.00 4.21 0.00 2.14 2.20 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 104 Q 8.16 4.02 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.85 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.76 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 0.00 0.00 0.00 106 I 7.82 3.52 1.04 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 -0.30 -0.27 -0.31 0.00 0.00 107 R 7.29 4.24 0.00 1.98 2.04 0.00 3.24 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.53 0.00 108 A 7.51 3.90 0.82 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 0.00 109 W 7.92 4.82 0.00 3.51 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 0.00 110 V 8.74 3.72 2.18 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 1.09 0.00 0.00 1.00 0.00 0.00 111 A 8.31 4.07 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.23 3.99 0.00 3.40 3.51 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 0.00 113 R 8.14 3.61 0.00 2.08 1.97 0.00 3.58 0.00 0.00 3.58 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.09 0.00 114 N 7.97 4.38 0.00 2.67 2.70 0.00 0.00 6.91 7.82 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 0.00 115 R 7.77 4.14 0.00 1.01 0.89 0.00 2.75 0.00 0.00 2.86 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.92 0.00 116 C 7.18 4.58 0.00 1.91 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 0.00 117 Q 6.62 3.37 0.00 0.93 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.57 0.00 0.00 0.00 0.00 0.00 2.16 2.11 0.00 118 N 8.71 4.19 0.00 2.80 2.83 0.00 0.00 6.93 7.66 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 0.00 119 R 7.40 4.48 0.00 1.89 1.82 0.00 3.18 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 120 D 8.35 4.56 0.00 2.64 2.62 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 0.00 121 V 8.14 4.51 2.40 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 0.95 0.00 0.00 1.06 0.00 0.00 122 R 8.14 4.06 0.00 1.99 2.01 0.00 3.30 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 123 Q 8.03 4.02 0.00 1.92 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.12 0.00 0.00 0.00 0.00 0.00 2.29 1.78 0.00 124 Y 7.68 4.32 0.00 3.29 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 0.00 125 V 7.88 4.43 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 0.90 0.00 0.00 1.06 0.00 0.00 126 Q 8.01 4.07 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.76 0.00 0.00 0.00 0.00 0.00 2.53 2.30 0.00 127 G 8.91 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 0.00 128 C 7.87 4.41 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 0.00 129 G 8.03 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 0.00 130 V 7.90 4.00 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 0.76 0.00 0.00 0.96 0.00 0.00