NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 E 4.2963 8.4449 118.7990 56.0336 30.8462 174.5204 4 K 4.4604 8.0868 119.2936 54.5212 35.2020 172.9380 5 T 4.4130 8.5326 113.9115 62.0890 70.8500 172.6967 6 C 4.9403 8.5086 120.3053 57.2941 40.9616 173.0054 7 D 5.1180 9.1651 122.6449 52.6085 43.1923 175.3696 8 L 5.2448 8.4757 125.3245 52.8416 44.0775 176.6757 9 V 3.6561 8.2097 120.6834 62.9793 32.0078 176.7536 10 G 4.0385 8.7359 109.5976 45.1721 0.0000 173.1469 11 E 4.2222 8.4587 119.2642 55.2871 30.3105 176.8477 12 K 4.2208 8.3590 120.8214 57.9787 32.5294 176.6416 13 G 4.2273 9.1806 111.8021 45.3218 0.0000 174.1147 14 K 4.6149 7.9204 118.0152 56.4384 32.9916 175.9332 15 E 4.4902 8.0649 117.7434 55.7608 31.2122 176.6222 16 S 4.1958 8.4129 115.5121 58.5636 63.4415 175.1422 17 E 3.9672 8.8740 129.1114 59.0300 29.2664 179.2128 18 K 3.9267 7.9796 119.4569 59.5945 32.3656 178.5387 19 E 4.0011 8.1358 118.7111 59.4327 29.2870 179.1346 20 L 3.9968 8.2492 119.0553 58.0589 41.8102 179.6330 21 A 4.0323 8.1991 120.4323 55.0918 18.0738 179.7099 22 L 3.9830 7.7021 116.7585 57.7815 41.9881 179.3673 23 L 4.2797 8.2103 119.0801 57.9109 41.6350 179.6700 24 K 3.9785 7.8436 119.5710 58.9047 31.7301 179.3433 25 R 3.9146 7.6812 117.8299 58.8509 30.2378 177.5821 26 L 4.4027 7.6750 116.7195 54.8642 41.4929 178.2324 27 T 2.0000 7.2699 117.9684 65.8369 68.1508 174.1971 28 P 4.1691 0.0000 0.0000 65.1995 31.6457 177.2567 29 L 4.3895 8.0779 117.1349 55.8947 42.1718 178.6613 30 F 4.4523 8.3840 117.3690 59.8419 38.8395 176.1845 31 Q 4.2971 8.0724 114.8676 56.0980 28.8191 175.4093 32 K 4.3183 7.6691 118.2260 55.1039 33.9996 175.4999 33 S 4.4384 7.6165 114.5032 56.4053 65.4491 173.0222 34 F 5.0052 8.6027 124.2230 55.7432 42.3041 173.7400 35 E 5.8841 8.8213 121.7503 54.6038 33.2610 174.2864 36 S 4.7796 8.9064 116.9510 57.8917 66.0973 173.0163 37 T 5.2457 8.7834 123.9046 62.2626 70.2635 174.0945 38 V 4.4863 8.8853 118.4573 60.5692 37.0811 175.4256 39 G 4.3049 9.1693 107.9764 45.4410 0.0000 172.4935 40 Q 4.6129 7.8790 115.6337 53.3761 32.0754 175.6677 41 S 4.3639 8.6137 117.0216 58.9163 63.2685 172.7871 42 P 4.5998 0.0000 0.0000 63.2635 31.4263 175.7369 43 D 4.3288 7.5749 118.5210 54.5455 41.5498 175.9231 44 M 4.3182 7.4877 119.3923 55.1195 33.6704 174.3245 45 Y 5.3560 8.8292 122.9811 56.2217 42.8682 174.2105 46 S 5.1220 9.0127 117.0245 56.9206 65.0825 172.1620 47 Y 5.3164 9.3061 125.7858 56.5080 40.1591 174.7639 48 V 4.9658 8.8208 124.4541 61.0507 34.3108 173.8840 49 F 5.5518 9.2627 130.2803 56.5653 42.0847 174.1018 50 R 4.5007 8.5375 123.5294 54.3329 33.9620 175.2101 51 V 3.7963 7.9982 122.5870 62.4135 31.6200 176.1749 52 C 3.4427 8.9247 124.9471 57.3307 38.1072 173.2765 53 R 4.1290 6.6456 115.5128 53.6500 33.7070 174.6489 54 E 4.2138 8.5904 121.0340 56.9061 29.7521 176.5248 55 A 4.3976 9.0172 129.2771 52.1585 20.2182 176.6999 56 G 4.0815 7.9883 104.3580 44.2470 0.0000 173.2307 57 Q 4.6541 8.1864 115.9363 55.7206 28.8026 176.5677 58 H 4.8654 7.9293 110.3666 56.5100 31.8804 173.6338 59 S 3.8953 8.0705 113.8423 59.8326 60.1727 173.1485 60 S 4.2912 8.1989 113.8559 58.6789 63.2606 174.9614 61 G 3.4026 8.6129 109.0601 46.0933 0.0000 173.1138 62 A 4.2591 7.9766 122.6460 51.4513 19.2741 179.4181 63 G 3.6672 8.7676 110.0977 47.1248 0.0000 173.4351 64 L 5.2772 7.6276 122.2845 54.0514 45.7449 174.7822 65 V 4.9853 9.0018 118.6492 59.5276 36.3896 174.2611 66 Q 4.7149 9.1395 123.5381 54.4937 31.6955 174.0060 67 I 4.7715 8.7248 128.3317 59.6568 39.4829 174.8727 68 Q 4.6351 9.0851 129.8486 55.4308 28.9071 176.2613 69 K 3.9101 8.6421 128.1046 59.7952 32.2496 179.2713 70 S 4.2178 8.3505 113.9498 60.8361 63.1858 174.7008 71 N 4.7403 8.0529 114.6807 51.1616 37.6815 174.8157 72 G 3.8637 8.5695 106.5796 46.0970 0.0000 173.6310 73 K 4.0880 8.0715 122.0825 56.2369 33.0973 175.2304 74 E 4.8918 8.8125 128.9576 55.2619 31.0607 174.9331 75 T 4.6138 8.9206 123.7952 61.5872 71.9757 173.3576 76 V 4.0485 8.7667 126.7307 62.6521 31.6890 176.7077 77 V 3.6082 8.7405 128.9567 65.4210 32.7890 175.9039 78 G 4.2813 7.7570 104.1548 45.3376 0.0000 172.3984 79 R 4.9741 8.7500 122.2162 53.8091 32.6432 177.2415 80 F 4.3055 8.0441 116.9587 57.2971 38.0799 176.1948 81 N 4.7158 7.4295 117.9121 53.7748 38.2482 174.9666 82 E 4.7959 7.9897 117.9670 55.0728 29.6205 174.4041 83 T 5.3235 8.7424 118.5484 61.9995 71.9765 174.5222 84 Q 4.9596 8.9661 125.0003 54.7230 32.9787 173.6973 85 I 5.1179 8.9681 124.6116 60.0607 41.6024 173.4208 86 F 5.1927 8.5164 123.1782 56.0476 41.6990 172.8841 87 Q 4.3835 8.6072 116.1727 54.2836 31.9982 174.8938 88 G 3.2437 6.2439 108.2961 44.2477 0.0000 173.1204 89 S 4.2781 8.6189 114.6563 60.6516 63.9730 176.8806 90 N 5.7936 8.1167 116.5819 50.3492 37.8036 173.1714 91 W 5.6872 7.5348 113.8796 56.7878 32.0644 173.1833 92 I 4.9728 9.0985 121.2784 59.8882 41.1659 173.8022 93 M 4.9704 9.0583 126.8167 53.5460 34.6930 173.9569 94 L 5.0603 8.7064 128.0396 53.2522 45.2904 174.9363 95 I 5.0567 8.8088 126.2156 59.7145 41.1991 173.7540 96 Y 5.4454 9.0212 124.4131 56.6247 40.5681 175.4919 97 K 4.5099 9.0425 125.2163 54.8870 35.8848 176.8791 98 G 3.9311 8.8364 107.9262 47.1478 0.0000 174.2211 99 G 4.0668 7.7805 107.6367 44.1943 0.0000 173.9631 100 D 4.6774 8.7864 119.7038 54.1415 41.8463 176.6379 101 E 4.7234 8.6007 121.3408 56.6074 30.5580 176.5621 102 Y 4.3067 8.9366 120.8069 58.4359 38.8866 176.1804 103 D 4.7494 9.0160 120.4598 55.4649 42.5907 177.3017 104 N 5.1098 8.1713 113.7218 52.7705 40.0497 173.2953 105 H 4.7262 7.9948 113.7854 55.0197 33.1615 173.4622 106 C 4.8130 8.9807 114.0503 56.8030 37.6917 174.2288 107 G 4.0481 8.7376 103.0755 46.6300 0.0000 174.7603 108 R 4.5359 8.5687 114.5167 55.8733 28.4164 176.4440 109 E 4.4402 7.9042 116.1078 55.9895 31.2108 175.9428 110 Q 4.5438 8.5522 119.1323 55.8038 29.6811 176.7756 111 R 4.5452 8.6336 122.1002 56.5880 31.8084 175.6417 112 R 5.3993 8.7612 115.1987 55.0462 33.2567 173.3811 113 A 5.5212 9.3827 123.0451 50.3176 21.9908 175.3617 114 V 4.6201 9.1647 122.5860 61.0050 34.3876 174.3659 115 V 4.6629 8.9403 128.4551 61.3257 34.0756 173.7729 116 M 4.5295 8.9513 129.2927 54.4188 33.6792 174.6947 117 I 4.7453 8.8635 128.6821 60.0390 39.2281 175.1864 118 S 5.0198 8.9233 124.2877 56.9451 65.1167 173.1813 119 C 4.8827 8.6253 124.0584 57.0396 38.7580 173.2959 120 N 4.7455 8.6054 124.7613 52.7246 39.9834 174.7861 121 R 4.1288 8.6467 125.0415 58.3259 30.3825 177.6292 122 H 4.7069 8.2531 114.1728 56.9288 29.4227 175.1442 123 T 4.7211 7.7258 113.3705 60.2119 70.4657 174.2278 124 L 3.9265 8.9204 128.1260 57.1510 42.5401 177.2029 125 A 4.5248 7.5265 116.6211 51.7851 21.8653 174.4830 126 D 4.5364 9.0703 121.1522 54.5983 44.9461 174.4061 127 N 4.4043 8.9823 116.2683 54.1509 35.6536 175.1611 128 F 4.4931 8.3742 119.7355 58.2913 40.3784 173.4761 129 N 4.6664 8.6998 126.7631 51.3451 42.4861 171.3685 130 P 3.9780 0.0000 0.0000 62.7413 31.3039 176.3678 131 V 3.7800 8.1626 126.4122 64.7931 32.1896 175.7560 132 S 4.4509 6.8402 112.2130 57.8577 65.8083 174.1949 133 E 4.3826 8.3748 120.2052 54.2241 32.1830 174.2234 134 E 4.1222 8.3288 129.4463 54.3649 30.3771 175.6721 135 R 4.1196 8.1962 122.4086 55.6316 30.1228 175.9057 136 G 4.0205 8.3571 105.4644 45.6552 0.0000 173.9304 137 K 4.6445 7.4651 118.1920 53.9993 34.9257 177.7306 138 V 3.7574 8.2474 113.4794 63.5655 31.7628 175.8957 139 Q 4.5178 7.9345 115.3597 56.2004 30.4781 172.4062 140 D 4.4592 9.0297 114.7539 55.7550 38.0151 174.9033 141 C 4.8888 8.8541 116.3727 56.5489 40.6388 173.2014 142 F 5.0523 7.8301 113.2039 57.1423 41.2015 172.2094 143 Y 4.8036 8.8612 117.5929 56.1788 40.3653 174.5453 144 L 5.1985 8.5740 126.1213 53.4089 44.6796 175.1124 145 F 5.0781 9.2224 123.5946 55.7392 43.5733 173.5782 146 E 5.2128 8.9202 119.9408 55.2847 33.6684 174.5573 147 M 5.1466 8.6825 119.7338 54.9003 36.4589 172.9995 148 D 5.4345 8.8095 124.2641 53.1641 43.9266 175.5082 149 S 5.1150 8.4820 113.2702 57.6455 65.9026 176.8369 150 S 4.3170 9.0610 122.0709 61.1328 63.0751 176.5298 151 L 3.9215 7.6015 120.2323 57.2288 41.2718 177.6995 152 A 4.2698 7.8828 119.7918 52.6998 18.8402 176.0096 153 C 4.6515 8.0351 115.0089 56.2041 41.0698 174.1066 154 S 4.3486 7.9045 118.1341 58.6376 62.6714 173.9515 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 3 E 8.44 4.30 0.00 2.09 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 2.19 2.30 0.00 4 K 8.09 4.46 0.00 1.94 1.94 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.38 1.51 7.81 5 T 8.53 4.41 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 1.26 0.00 0.00 6 C 8.51 4.94 0.00 2.96 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 7 D 9.17 5.12 0.00 2.82 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 8 L 8.48 5.24 0.00 1.61 1.76 0.98 1.10 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 9 V 8.21 3.66 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 0.73 0.00 0.00 0.96 0.00 0.00 10 G 8.74 4.04 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 0.00 0.00 0.00 11 E 8.46 4.22 0.00 2.05 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 2.41 2.34 0.00 12 K 8.36 4.22 0.00 1.74 1.77 0.00 1.62 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.53 7.81 13 G 9.18 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 0.00 0.00 0.00 14 K 7.92 4.61 0.00 1.84 1.85 0.00 1.61 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.39 7.81 15 E 8.06 4.49 0.00 2.00 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 0.00 2.39 2.49 0.00 16 S 8.41 4.20 0.00 3.91 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 17 E 8.87 3.97 0.00 2.02 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 2.41 2.32 0.00 18 K 7.98 3.93 0.00 1.88 1.83 0.00 1.60 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.60 7.81 19 E 8.14 4.00 0.00 2.26 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 2.66 2.41 0.00 20 L 8.25 4.00 0.00 1.93 1.76 0.99 1.08 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 21 A 8.20 4.03 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 22 L 7.70 3.98 0.00 1.92 1.78 0.93 1.05 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 23 L 8.21 4.28 0.00 1.95 1.91 1.02 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 24 K 7.84 3.98 0.00 1.91 1.82 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.49 7.81 25 R 7.68 3.91 0.00 1.94 2.14 0.00 3.22 0.00 0.00 3.20 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 26 L 7.67 4.40 0.00 2.07 1.82 1.01 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.27 2.00 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 0.80 0.00 0.00 28 P 0.00 4.17 0.00 1.99 2.08 0.00 3.57 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.02 0.00 29 L 8.08 4.39 0.00 1.97 1.89 1.02 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 30 F 8.38 4.45 0.00 2.93 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 31 Q 8.07 4.30 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.83 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 32 K 7.67 4.32 0.00 1.63 1.14 0.00 1.71 0.00 0.00 1.53 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.31 7.81 33 S 7.62 4.44 0.00 3.62 3.47 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 0.00 34 F 8.60 5.01 0.00 2.57 2.58 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 35 E 8.82 5.88 0.00 2.00 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 2.46 2.16 0.00 36 S 8.91 4.78 0.00 4.19 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 37 T 8.78 5.25 4.31 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 1.33 0.00 0.00 38 V 8.89 4.49 2.19 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 0.78 0.00 0.00 1.28 0.00 0.00 39 G 9.17 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 0.00 0.00 0.00 0.00 40 Q 7.88 4.61 0.00 2.04 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.93 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 41 S 8.61 4.36 0.00 3.82 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 42 P 0.00 4.60 0.00 2.15 2.12 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.97 0.00 43 D 7.57 4.33 0.00 2.64 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 44 M 7.49 4.32 0.00 1.99 1.82 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.53 0.00 45 Y 8.83 5.36 0.00 2.63 2.20 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 46 S 9.01 5.12 0.00 3.89 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 47 Y 9.31 5.32 0.00 3.40 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 48 V 8.82 4.97 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 0.99 0.00 0.00 0.99 0.00 0.00 49 F 9.26 5.55 0.00 2.45 1.90 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 50 R 8.54 4.50 0.00 1.57 1.49 0.00 3.38 0.00 0.00 2.98 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.69 0.00 51 V 8.00 3.80 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 1.14 0.00 0.00 0.78 0.00 0.00 52 C 8.92 3.44 0.00 1.72 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 53 R 6.65 4.13 0.00 1.40 1.50 0.00 3.19 0.00 0.00 2.80 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.56 0.00 54 E 8.59 4.21 0.00 1.99 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 2.31 2.59 0.00 55 A 9.02 4.40 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 0.00 0.00 56 G 7.99 4.08 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 0.00 0.00 0.00 57 Q 8.19 4.65 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.92 0.00 0.00 0.00 0.00 0.00 2.32 2.01 0.00 58 H 7.93 4.87 0.00 3.10 3.23 0.00 5.85 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 8.07 3.90 0.00 3.98 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 60 S 8.20 4.29 0.00 3.81 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 61 G 8.61 3.40 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 0.00 62 A 7.98 4.26 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 63 G 8.77 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 64 L 7.63 5.28 0.00 2.00 1.57 0.07 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 65 V 9.00 4.99 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 0.74 0.00 0.00 0.95 0.00 0.00 66 Q 9.14 4.71 0.00 1.89 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.79 0.00 0.00 0.00 0.00 0.00 1.83 1.36 0.00 67 I 8.72 4.77 1.87 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 1.11 0.62 0.92 0.00 0.00 68 Q 9.09 4.64 0.00 2.26 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.72 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 69 K 8.64 3.91 0.00 1.68 1.88 0.00 1.79 0.00 0.00 1.78 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.61 1.56 7.81 70 S 8.35 4.22 0.00 3.97 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 71 N 8.05 4.74 0.00 2.83 2.93 0.00 0.00 5.99 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 72 G 8.57 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 K 8.07 4.09 0.00 1.89 1.86 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.40 7.81 74 E 8.81 4.89 0.00 2.03 1.88 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 2.23 2.31 0.00 75 T 8.92 4.61 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 1.17 0.00 0.00 76 V 8.77 4.05 2.19 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 0.95 0.00 0.00 0.89 0.00 0.00 77 V 8.74 3.61 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 0.65 0.00 0.00 0.70 0.00 0.00 78 G 7.76 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 0.00 0.00 0.00 0.00 79 R 8.75 4.97 0.00 1.63 1.65 0.00 3.15 0.00 0.00 3.04 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 80 F 8.04 4.31 0.00 3.03 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 81 N 7.43 4.72 0.00 2.75 2.67 0.00 0.00 5.88 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 82 E 7.99 4.80 0.00 2.10 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 2.22 2.23 0.00 83 T 8.74 5.32 4.55 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 1.36 0.00 0.00 84 Q 8.97 4.96 0.00 2.19 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.71 0.00 0.00 0.00 0.00 0.00 2.53 2.60 0.00 85 I 8.97 5.12 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 1.29 0.89 0.98 0.00 0.00 86 F 8.52 5.19 0.00 3.16 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 87 Q 8.61 4.38 0.00 1.95 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 88 G 6.24 3.24 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 0.00 0.00 0.00 0.00 89 S 8.62 4.28 0.00 3.83 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 90 N 8.12 5.79 0.00 2.75 2.98 0.00 0.00 6.26 8.88 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 91 W 7.53 5.69 0.00 3.39 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 92 I 9.10 4.97 1.89 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 1.02 0.70 0.87 0.00 0.00 93 M 9.06 4.97 0.00 1.07 1.72 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 2.31 2.17 0.00 94 L 8.71 5.06 0.00 1.69 1.33 0.84 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 95 I 8.81 5.06 1.93 0.00 0.00 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 1.21 0.63 1.01 0.00 0.00 96 Y 9.02 5.45 0.00 2.96 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 K 9.04 4.51 0.00 1.77 1.82 0.00 1.83 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.47 7.81 98 G 8.84 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 99 G 7.78 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 D 8.79 4.68 0.00 2.51 2.55 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 0.00 101 E 8.60 4.72 0.00 1.88 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 0.00 2.35 2.35 0.00 102 Y 8.94 4.31 0.00 3.03 2.92 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 0.00 103 D 9.02 4.75 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 0.00 104 N 8.17 5.11 0.00 2.66 2.71 0.00 0.00 6.67 8.16 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 0.00 105 H 7.99 4.73 0.00 2.77 2.64 0.00 5.96 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 C 8.98 4.81 0.00 2.81 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 0.00 107 G 8.74 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 0.00 0.00 0.00 108 R 8.57 4.54 0.00 2.03 2.09 0.00 3.16 0.00 0.00 3.17 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 109 E 7.90 4.44 0.00 2.18 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 0.00 2.64 2.55 0.00 110 Q 8.55 4.54 0.00 2.02 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.08 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 111 R 8.63 4.55 0.00 1.72 1.93 0.00 2.91 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.27 0.00 112 R 8.76 5.40 0.00 2.11 2.14 0.00 3.05 0.00 0.00 3.46 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.84 0.00 113 A 9.38 5.52 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 0.00 114 V 9.16 4.62 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 0.93 0.00 0.00 0.84 0.00 0.00 115 V 8.94 4.66 1.84 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 0.66 0.00 0.00 0.31 0.00 0.00 116 M 8.95 4.53 0.00 2.09 1.81 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 117 I 8.86 4.75 2.00 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 1.23 0.51 0.94 0.00 0.00 118 S 8.92 5.02 0.00 3.78 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 0.00 119 C 8.63 4.88 0.00 3.17 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 0.00 120 N 8.61 4.75 0.00 2.77 2.65 0.00 0.00 7.22 7.65 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 0.00 121 R 8.65 4.13 0.00 1.81 1.99 0.00 3.25 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 122 H 8.25 4.71 0.00 3.29 3.34 0.00 5.63 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.73 4.72 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 1.27 0.00 0.00 124 L 8.92 3.93 0.00 1.66 1.73 0.94 1.09 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 0.00 125 A 7.53 4.52 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 126 D 9.07 4.54 0.00 2.77 2.54 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 0.00 127 N 8.98 4.40 0.00 2.96 2.92 0.00 0.00 6.87 7.45 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 0.00 128 F 8.37 4.49 0.00 2.90 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 0.00 129 N 8.70 4.67 0.00 2.69 2.47 0.00 0.00 6.80 7.27 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 0.00 130 P 0.00 3.98 0.00 1.87 1.45 0.00 3.63 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.02 0.00 131 V 8.16 3.78 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 0.65 0.00 0.00 0.84 0.00 0.00 132 S 6.84 4.45 0.00 3.69 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 0.00 133 E 8.37 4.38 0.00 1.48 1.53 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 1.62 1.47 0.00 134 E 8.33 4.12 0.00 1.41 1.12 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 2.07 2.04 0.00 135 R 8.20 4.12 0.00 1.42 1.75 0.00 2.58 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.40 0.00 136 G 8.36 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 0.00 137 K 7.47 4.64 0.00 1.81 1.76 0.00 1.71 0.00 0.00 1.86 0.00 0.00 3.18 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.52 7.81 138 V 8.25 3.76 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 0.70 0.00 0.00 0.93 0.00 0.00 139 Q 7.93 4.52 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.93 0.00 0.00 0.00 0.00 0.00 2.17 2.32 0.00 140 D 9.03 4.46 0.00 2.91 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 0.00 141 C 8.85 4.89 0.00 3.01 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 0.00 142 F 7.83 5.05 0.00 3.17 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 0.00 143 Y 8.86 4.80 0.00 3.13 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 0.00 144 L 8.57 5.20 0.00 1.71 1.35 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 145 F 9.22 5.08 0.00 2.81 2.56 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 0.00 146 E 8.92 5.21 0.00 1.76 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 2.14 2.13 0.00 147 M 8.68 5.15 0.00 2.06 1.90 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.44 0.00 148 D 8.81 5.43 0.00 2.80 2.57 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 0.00 149 S 8.48 5.11 0.00 3.89 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 0.00 150 S 9.06 4.32 0.00 4.05 4.31 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 0.00 151 L 7.60 3.92 0.00 1.62 1.78 0.99 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 152 A 7.88 4.27 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 0.00 0.00 153 C 8.04 4.65 0.00 3.07 3.03 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 0.00 154 S 7.90 4.35 0.00 3.97 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