NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9773 8.0393 120.3864 62.9378 32.6839 174.1867 2 H 4.7228 8.3588 120.0056 53.2276 30.1004 172.4751 3 L 4.8409 8.1882 123.9877 53.0271 44.7528 178.3078 4 T 4.2903 8.7826 114.4304 60.3645 71.3344 174.0695 5 P 4.2105 0.0000 0.0000 65.8217 31.1528 179.1950 6 V 3.5811 7.6546 116.4844 65.8708 31.5480 177.7539 7 E 3.8851 7.8315 118.1796 59.4102 29.3270 179.4536 8 K 3.8348 8.0264 118.3981 59.5667 32.1213 179.3925 9 S 4.0636 7.9558 112.6524 61.1774 62.0949 175.9779 10 A 3.9972 8.1977 123.7793 55.0123 18.0812 179.7932 11 V 3.1587 7.6225 116.9148 66.3677 31.7714 178.4930 12 T 4.0893 7.9315 109.3165 64.3909 68.4614 176.3884 13 A 4.0078 7.8789 122.9997 55.1639 18.7083 179.0760 14 L 3.9827 7.7854 118.6388 58.0051 42.1920 178.8578 15 W 4.5812 8.7077 128.5634 60.5086 30.3566 178.0817 16 G 3.7536 8.1465 104.4415 46.8843 0.0000 174.7782 17 K 4.3878 8.0837 118.7704 55.6786 32.9573 176.7592 18 V 3.6817 7.0961 120.1564 62.0110 32.2225 175.7919 19 N 4.5518 8.0927 125.2816 51.9289 38.9745 175.4612 20 V 3.4824 8.0444 129.2489 64.9050 31.2329 177.8399 21 D 4.2918 8.0645 118.7068 57.2336 40.8152 178.2733 22 E 3.8737 8.0161 118.8871 59.6140 29.4819 179.7968 23 V 3.6200 7.9940 118.5694 65.6884 31.4814 178.2335 24 G 3.7093 8.3661 105.9317 47.7641 0.0000 175.9525 25 G 3.5798 7.8889 107.9949 47.3289 0.0000 175.6024 26 E 3.9017 8.1318 120.8689 59.0626 29.5544 179.2711 27 A 3.9217 8.1362 120.8465 55.2611 18.6246 179.5159 28 L 3.9949 7.9626 118.9971 58.0131 42.2298 179.4153 29 G 3.5258 8.1370 105.7789 47.9567 0.0000 176.0502 30 R 3.9600 8.3094 120.9323 58.1267 29.9369 179.0500 31 L 3.9296 7.6853 120.6883 58.2642 41.7090 179.0398 32 L 4.1402 7.6975 119.8570 56.8567 41.2042 179.7587 33 V 3.5861 7.3111 117.4085 65.8194 31.6929 178.0232 34 V 3.5473 7.7366 117.0624 64.2722 32.7291 175.5225 35 Y 3.9699 7.2522 116.3117 53.7337 38.0481 173.6634 36 P 4.4332 0.0000 0.0000 64.4619 31.4597 177.3956 37 W 4.4326 8.2632 114.4241 58.9400 27.8667 177.8962 38 T 4.1421 7.7849 111.0371 64.3854 68.2867 176.2888 39 Q 4.3428 8.3292 121.2198 58.0563 28.4234 178.3494 40 R 3.7465 7.3890 116.5083 58.6560 29.2983 177.9365 41 F 4.3253 7.2283 116.3873 57.5061 39.6200 175.8086 42 F 4.6444 7.8426 118.8093 56.7323 39.5799 177.3669 43 E 4.0511 8.4120 122.3047 59.2210 29.2175 178.5526 44 S 4.5225 8.0614 111.7371 59.3211 63.7204 175.6810 45 F 4.1768 8.3051 120.1049 58.8147 39.5600 175.3662 46 G 4.0319 7.4174 105.2909 43.9496 0.0000 173.1673 47 D 4.5448 8.6033 123.0372 54.4138 41.7307 176.5056 48 L 4.8895 8.3319 124.6945 54.5997 43.7088 177.6291 49 S 4.2919 8.4860 116.9705 60.6025 63.2667 174.7790 50 T 4.7350 7.4348 109.8490 58.2331 72.9875 172.7051 51 P 4.1999 0.0000 0.0000 66.1905 31.3913 178.7995 52 D 4.4180 8.0651 116.7190 57.1192 40.5304 178.5690 53 A 4.0095 7.5167 120.8996 54.9117 18.7714 179.6709 54 V 3.6628 8.1674 117.1645 66.5227 31.5036 178.0536 55 M 3.9801 8.2520 117.6855 58.3739 31.8798 178.0281 56 G 3.7123 7.8965 104.6146 46.0622 0.0000 173.6567 57 N 4.3187 7.9204 119.9688 52.9990 39.6552 173.4233 58 P 4.2342 0.0000 0.0000 65.9536 31.2980 178.5914 59 K 3.6215 8.1448 118.3339 58.7909 31.6801 179.4841 60 V 3.7084 7.6325 118.1237 65.9498 31.5637 178.0628 61 K 3.8968 7.8478 117.5582 59.4749 31.5468 179.1884 62 A 3.9862 8.0383 121.0489 55.4770 18.2885 179.1960 63 H 4.4208 8.5326 116.9471 59.1252 29.9486 177.7921 64 G 3.5905 8.4504 108.1515 47.6139 0.0000 175.6809 65 K 4.0385 8.1403 122.1004 58.8779 31.9919 178.9885 66 K 4.0103 7.7264 119.7504 59.5994 32.2243 179.3547 67 V 3.7043 7.8430 112.7441 64.2711 31.3723 178.1510 68 L 4.4450 8.2405 119.8102 57.4010 41.8366 179.0605 69 G 3.7020 8.0908 105.4308 47.6039 0.0000 175.6842 70 A 4.1943 8.0361 123.1893 54.7644 18.5360 179.4293 71 F 4.2288 8.5322 119.3653 61.6473 39.2708 177.2116 72 S 4.2739 8.5880 111.8387 61.6347 62.1873 175.3769 73 D 4.5688 8.0625 121.0197 57.2158 40.9286 178.4683 74 G 3.3331 7.9969 106.2080 47.6040 0.0000 175.7144 75 L 3.7381 7.5143 120.0876 57.1720 41.6030 178.9247 76 A 4.1833 7.4769 118.9266 53.6659 19.8406 177.1398 77 H 4.7912 8.0729 114.3172 54.0188 29.5318 174.5501 78 L 4.0200 7.7397 119.3181 57.5431 42.0997 178.6057 79 D 4.6630 7.8886 115.8000 54.7522 41.5314 175.5521 80 N 5.0516 8.3017 119.3273 51.9786 39.8382 176.2637 81 L 3.9514 8.2853 118.9074 57.7658 41.7206 178.7877 82 K 4.0490 8.0582 116.3273 59.5882 32.1264 179.1669 83 G 3.6900 7.9436 105.2241 48.0833 0.0000 175.6284 84 T 3.7058 7.6255 117.1967 65.7823 68.6909 175.7923 85 F 4.8660 7.8365 117.0540 57.3287 39.1684 177.5780 86 A 4.0929 7.6980 123.7072 55.6639 18.1744 180.6511 87 T 3.8871 7.8416 113.7202 66.8190 68.6002 177.0048 88 L 4.1645 7.9943 120.3724 57.5547 41.2421 179.3675 89 S 4.4095 8.2036 114.8169 60.9203 62.3640 176.0792 90 E 3.8915 8.0827 120.8904 59.1059 29.1140 178.8736 91 L 3.8789 7.9868 120.3466 58.7725 42.2019 178.9645 92 H 4.1356 8.6417 115.7499 58.3779 28.0760 176.9293 93 C 3.6843 7.2761 120.2683 61.8091 31.2960 175.2873 94 D 4.2875 8.2376 120.1458 56.7283 40.5737 177.7576 95 K 4.2164 7.6023 116.5259 58.3421 33.0239 177.9309 96 L 4.1242 7.9253 117.0034 55.4046 41.9597 176.6018 97 H 4.1684 7.2711 113.1653 56.6203 26.6699 174.8705 98 V 3.9015 8.1186 119.0823 61.2711 32.3398 174.8755 99 D 4.4164 8.7887 127.1912 53.6678 41.6283 174.9797 100 P 3.4884 0.0000 0.0000 65.2623 31.8454 177.9033 101 E 3.8434 8.1379 118.3242 59.4553 29.2692 178.6645 102 N 4.3427 8.0637 116.3447 56.0058 38.5681 177.3503 103 F 4.5044 7.7374 119.9039 60.5617 38.9963 177.9097 104 R 4.0401 7.8457 117.4000 59.0411 30.0466 178.8614 105 L 3.8582 7.8282 118.8625 57.6773 41.5050 179.3248 106 L 4.1365 8.1124 120.4823 57.8135 41.9477 179.2417 107 G 3.6468 7.9540 105.6388 48.0513 0.0000 175.5446 108 N 4.5091 8.1034 118.7917 55.7434 38.5208 177.8391 109 V 3.6724 7.8917 119.8912 65.6211 31.5076 177.8497 110 L 3.8854 8.2349 120.5610 58.2032 41.9788 179.0909 111 V 3.5520 7.8170 118.1462 66.2858 31.3236 177.8239 112 C 4.1458 7.9052 116.0464 62.6137 27.8559 176.2200 113 V 3.5093 7.8355 119.9118 65.9428 31.1335 178.1340 114 L 3.8729 7.9557 118.7870 57.4653 41.2474 179.3574 115 A 3.6729 7.2199 120.6214 55.3409 18.1400 179.1380 116 H 4.0678 8.0455 115.5699 59.5584 29.9632 176.7263 117 H 3.9192 8.1905 119.2552 59.1066 30.1057 176.7799 118 F 4.4796 8.7505 118.7278 57.3519 39.4874 177.1501 119 G 3.8017 9.0478 108.5788 45.9785 0.0000 177.1193 120 K 4.0467 8.8966 122.4186 59.2201 32.4725 178.1842 121 E 4.1296 8.0347 118.6064 58.9706 29.7790 177.5304 122 F 4.5430 8.2362 123.1394 57.0384 37.8447 175.3553 123 T 4.2059 7.3986 115.7401 60.1724 71.2739 173.5589 124 P 4.1793 0.0000 0.0000 65.4700 31.4145 177.2497 125 P 4.1836 0.0000 0.0000 65.4257 31.3209 178.8341 126 V 3.5279 7.3316 116.4057 65.8927 31.3170 177.8781 127 Q 3.5474 7.9678 119.4274 59.0081 28.4048 177.8760 128 A 3.9667 8.1885 121.7985 55.2659 18.3207 179.5365 129 A 3.9083 7.9275 118.8793 55.5744 18.4697 179.5294 130 Y 3.8334 8.1484 115.2488 61.2234 38.0442 178.8311 131 Q 4.2527 8.5984 119.4062 58.7374 28.7535 178.9994 132 K 3.9853 7.8039 119.0338 59.2478 32.0784 179.5344 133 V 3.4682 7.6660 118.4918 66.0979 31.5598 178.1306 134 V 3.7637 8.3689 118.1338 66.1909 31.3206 177.8527 135 A 4.1869 8.1384 120.1887 54.8698 18.1324 179.9209 136 G 3.4985 8.1481 104.5968 47.8877 0.0000 176.2554 137 V 3.4700 8.2285 120.9276 65.5822 31.6388 178.0552 138 A 3.8889 7.8691 120.1595 55.1223 17.9807 179.4363 139 N 4.3101 8.0093 114.0711 56.2969 38.7815 177.2388 140 A 4.1495 8.1520 122.3824 55.1412 18.0416 179.4895 141 L 3.7936 8.0457 118.4986 57.2349 42.0358 177.9742 142 A 4.3754 7.6661 118.7626 52.4843 19.0615 178.2534 143 H 4.1818 7.8589 117.2777 58.7016 30.0778 175.9777 144 K 4.4766 8.5242 117.2049 56.2765 31.9361 176.0616 145 Y 4.3027 7.9573 117.6834 58.0748 38.4901 175.4971 146 H 4.5072 8.4298 118.2895 55.9884 28.6225 173.0916 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 V 8.04 3.98 2.04 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 0.93 0.00 0.00 0.90 0.00 0.00 2 H 8.36 4.72 0.00 3.28 3.27 0.00 5.74 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.19 4.84 0.00 1.59 1.56 0.85 0.87 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 4 T 8.78 4.29 4.21 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 1.18 0.00 0.00 5 P 0.00 4.21 0.00 2.15 2.13 0.00 3.57 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 2.09 2.12 0.00 6 V 7.65 3.58 2.06 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 1.12 0.00 0.00 0.91 0.00 0.00 7 E 7.83 3.89 0.00 2.23 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 2.29 2.32 0.00 8 K 8.03 3.83 0.00 1.75 1.79 0.00 1.62 0.00 0.00 1.51 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.39 1.57 7.81 9 S 7.96 4.06 0.00 3.88 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 10 A 8.20 4.00 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 11 V 7.62 3.16 2.01 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 0.62 0.00 0.00 0.44 0.00 0.00 12 T 7.93 4.09 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 1.17 0.00 0.00 13 A 7.88 4.01 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.79 3.98 0.00 1.81 1.96 0.21 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.71 4.58 0.00 3.79 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 16 G 8.15 3.75 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 0.00 0.00 0.00 17 K 8.08 4.39 0.00 2.08 2.14 0.00 1.71 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.50 7.81 18 V 7.10 3.68 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 -0.17 0.00 0.00 0.95 0.00 0.00 19 N 8.09 4.55 0.00 2.69 2.57 0.00 0.00 6.92 7.71 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 20 V 8.04 3.48 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 0.76 0.00 0.00 1.11 0.00 0.00 21 D 8.06 4.29 0.00 2.91 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 22 E 8.02 3.87 0.00 1.92 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 2.27 2.31 0.00 23 V 7.99 3.62 1.98 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 1.05 0.00 0.00 0.64 0.00 0.00 24 G 8.37 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 25 G 7.89 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 0.00 0.00 0.00 26 E 8.13 3.90 0.00 2.12 1.96 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 2.39 2.43 0.00 27 A 8.14 3.92 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 28 L 7.96 3.99 0.00 1.76 1.63 0.89 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.14 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.31 3.96 0.00 1.84 1.90 0.00 3.34 0.00 0.00 3.07 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 31 L 7.69 3.93 0.00 1.91 1.87 1.03 0.67 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 32 L 7.70 4.14 0.00 1.91 1.67 0.89 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.31 3.59 1.98 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 0.71 0.00 0.00 0.90 0.00 0.00 34 V 7.74 3.55 1.48 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 -0.04 0.00 0.00 0.72 0.00 0.00 35 Y 7.25 3.97 0.00 2.59 1.43 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 0.00 36 P 0.00 4.43 0.00 2.30 2.17 0.00 3.91 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 2.18 2.13 0.00 37 W 8.26 4.43 0.00 3.51 3.43 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 0.00 38 T 7.78 4.14 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 1.08 0.00 0.00 39 Q 8.33 4.34 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 40 R 7.39 3.75 0.00 1.64 1.89 0.00 2.77 0.00 0.00 2.98 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.50 0.00 41 F 7.23 4.33 0.00 1.54 2.35 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 42 F 7.84 4.64 0.00 2.72 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 0.00 0.00 0.00 43 E 8.41 4.05 0.00 1.95 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 2.26 2.21 0.00 44 S 8.06 4.52 0.00 4.13 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 45 F 8.31 4.18 0.00 3.24 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 46 G 7.42 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 47 D 8.60 4.54 0.00 2.65 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 48 L 8.33 4.89 0.00 1.65 1.60 1.07 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.49 4.29 0.00 4.01 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 50 T 7.43 4.73 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 52 D 8.07 4.42 0.00 2.67 2.70 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 53 A 7.52 4.01 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 54 V 8.17 3.66 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 1.05 0.00 0.00 0.97 0.00 0.00 55 M 8.25 3.98 0.00 1.98 2.14 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.80 0.00 56 G 7.90 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 57 N 7.92 4.32 0.00 3.08 2.84 0.00 0.00 6.83 7.36 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 58 P 0.00 4.23 0.00 2.23 2.25 0.00 3.70 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 59 K 8.14 3.62 0.00 1.46 0.74 0.00 1.53 0.00 0.00 1.21 0.00 0.00 2.82 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.16 1.22 7.81 60 V 7.63 3.71 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 1.14 0.00 0.00 1.12 0.00 0.00 61 K 7.85 3.90 0.00 1.98 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.56 7.81 62 A 8.04 3.99 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 63 H 8.53 4.42 0.00 3.62 3.63 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 64 G 8.45 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 65 K 8.14 4.04 0.00 1.86 2.00 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.47 1.57 7.81 66 K 7.73 4.01 0.00 1.93 1.95 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.54 7.81 67 V 7.84 3.70 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 0.68 0.00 0.00 0.97 0.00 0.00 68 L 8.24 4.45 0.00 2.09 1.83 0.79 1.23 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 69 G 8.09 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 70 A 8.04 4.19 1.56 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 71 F 8.53 4.23 0.00 3.31 3.35 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 72 S 8.59 4.27 0.00 4.59 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 0.00 73 D 8.06 4.57 0.00 2.81 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 74 G 8.00 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 0.00 0.00 0.00 75 L 7.51 3.74 0.00 1.54 1.48 -0.28 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.48 4.18 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 77 H 8.07 4.79 0.00 3.06 3.11 0.00 5.83 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.74 4.02 0.00 1.54 1.67 0.73 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.89 4.66 0.00 2.63 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 80 N 8.30 5.05 0.00 2.66 2.61 0.00 0.00 7.12 6.32 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 81 L 8.29 3.95 0.00 1.72 1.79 0.88 0.89 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 82 K 8.06 4.05 0.00 1.68 1.84 0.00 1.56 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.37 7.81 83 G 7.94 3.69 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 0.00 0.00 0.00 84 T 7.63 3.71 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 0.44 0.00 0.00 85 F 7.84 4.87 0.00 3.15 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 86 A 7.70 4.09 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 87 T 7.84 3.89 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 1.23 0.00 0.00 88 L 7.99 4.16 0.00 1.87 1.83 1.15 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.20 4.41 0.00 4.09 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 0.00 90 E 8.08 3.89 0.00 2.23 1.96 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 2.31 2.45 0.00 91 L 7.99 3.88 0.00 1.89 1.91 0.91 0.86 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 92 H 8.64 4.14 0.00 3.56 3.72 0.00 5.85 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 93 C 7.28 3.68 0.00 1.23 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 94 D 8.24 4.29 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 95 K 7.60 4.22 0.00 1.74 1.81 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.36 7.81 96 L 7.93 4.12 0.00 1.68 1.62 0.69 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.27 4.17 0.00 3.43 3.44 0.00 5.64 0.00 0.00 0.00 0.00 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.12 3.90 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 0.04 0.00 0.00 0.40 0.00 0.00 99 D 8.79 4.42 0.00 2.80 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 0.00 100 P 0.00 3.49 0.00 1.98 1.94 0.00 3.42 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.74 0.00 101 E 8.14 3.84 0.00 2.06 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 2.32 2.41 0.00 102 N 8.06 4.34 0.00 2.49 2.71 0.00 0.00 6.94 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 0.00 103 F 7.74 4.50 0.00 3.11 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 0.00 104 R 7.85 4.04 0.00 2.00 1.97 0.00 3.12 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 105 L 7.83 3.86 0.00 1.73 1.40 0.80 -0.10 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 0.00 106 L 8.11 4.14 0.00 1.82 1.87 0.91 1.12 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 0.00 107 G 7.95 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 0.00 0.00 0.00 108 N 8.10 4.51 0.00 2.83 2.96 0.00 0.00 6.72 7.91 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 0.00 109 V 7.89 3.67 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 1.03 0.00 0.00 1.17 0.00 0.00 110 L 8.23 3.89 0.00 1.77 1.83 0.95 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.82 3.55 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 1.28 0.00 0.00 1.24 0.00 0.00 112 C 7.91 4.15 0.00 3.19 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 0.00 113 V 7.84 3.51 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 1.04 0.00 0.00 0.90 0.00 0.00 114 L 7.96 3.87 0.00 0.93 1.13 0.50 1.25 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 0.00 115 A 7.22 3.67 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 0.00 116 H 8.05 4.07 0.00 3.18 3.43 0.00 5.78 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.19 3.92 0.00 3.06 3.17 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.75 4.48 0.00 3.26 3.15 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 0.00 0.00 0.00 0.00 119 G 9.05 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 0.00 0.00 0.00 120 K 8.90 4.05 0.00 1.92 2.02 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.52 7.81 121 E 8.03 4.13 0.00 2.38 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 2.42 2.36 0.00 122 F 8.24 4.54 0.00 3.02 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 0.00 123 T 7.40 4.21 4.21 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 1.27 0.00 0.00 124 P 0.00 4.18 0.00 2.16 2.14 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.18 0.00 2.11 2.06 0.00 3.55 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 2.09 2.11 0.00 126 V 7.33 3.53 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 0.93 0.00 0.00 0.89 0.00 0.00 127 Q 7.97 3.55 0.00 1.67 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 128 A 8.19 3.97 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 0.00 129 A 7.93 3.91 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 0.00 130 Y 8.15 3.83 0.00 3.33 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 0.00 131 Q 8.60 4.25 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.74 2.61 0.00 132 K 7.80 3.99 0.00 1.97 1.81 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.57 7.81 133 V 7.67 3.47 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 0.86 0.00 0.00 0.77 0.00 0.00 134 V 8.37 3.76 2.47 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 1.02 0.00 0.00 1.20 0.00 0.00 135 A 8.14 4.19 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 0.00 136 G 8.15 3.50 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 0.00 137 V 8.23 3.47 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 0.64 0.00 0.00 0.71 0.00 0.00 138 A 7.87 3.89 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 0.00 139 N 8.01 4.31 0.00 2.85 2.89 0.00 0.00 7.02 7.51 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 0.00 140 A 8.15 4.15 1.46 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 0.00 0.00 141 L 8.05 3.79 0.00 1.42 0.78 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.67 4.38 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 0.00 143 H 7.86 4.18 0.00 3.30 3.55 0.00 5.75 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.52 4.48 0.00 1.81 1.84 0.00 1.66 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.44 7.81 145 Y 7.96 4.30 0.00 3.04 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 0.00 146 H 8.43 4.51 0.00 3.20 3.22 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00