NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 C 4.4929 8.3449 118.3685 59.9654 29.8181 173.7377 3 F 4.3876 8.4153 115.8192 56.9510 41.2242 173.4040 4 H 5.5067 8.7012 116.6751 54.5174 32.2830 171.9051 5 N 5.3352 9.5529 122.9863 52.4063 41.7563 172.7600 6 S 5.2697 8.4620 115.3484 56.6257 66.4089 174.2351 *8 S 3.5287 8.7278 113.3981 57.1916 64.5125 173.4155 9 A 4.5182 7.2560 124.1702 50.7349 20.7922 176.5766 10 K 4.5394 8.0896 118.3741 55.5611 34.4106 178.4613 11 A 3.8855 8.6622 123.3021 55.6029 18.4163 180.3504 12 I 3.6246 7.7488 117.7502 64.5299 37.1276 178.3419 13 K 4.0208 7.9297 119.7580 58.9555 32.0199 179.0380 14 V 3.5815 7.5131 118.4211 65.7086 31.4560 177.7309 15 A 3.9792 8.0919 120.3206 55.3028 18.2498 179.5016 16 A 3.9948 7.9181 119.0496 55.2630 18.1952 179.6830 17 R 3.7557 7.8954 116.4089 58.9480 30.0466 177.3849 18 Y 4.5817 7.4510 113.1743 56.4077 38.5316 175.5911 19 G 3.9711 7.8955 107.3705 46.8620 0.0000 174.0583 20 R 4.7256 8.2311 117.1774 53.8807 33.2277 175.9189 21 Q 4.3890 8.8565 118.6678 55.5664 29.8310 176.9029 22 S 4.6274 8.3119 114.0747 58.4449 63.6166 175.4834 23 D 4.3267 7.8631 122.3240 58.1515 40.6756 178.8373 24 V 3.7020 7.7704 117.7424 66.1842 31.6100 178.3362 25 V 3.7693 7.6915 111.2377 63.9055 31.2560 177.9193 26 E 4.0786 8.1162 117.5944 58.5999 29.2287 178.7740 27 I 3.8080 7.1352 119.9531 63.3093 37.2164 176.7958 28 Y 4.8301 7.2862 116.3135 57.7437 38.9654 177.9368 29 Q 4.1834 8.2018 120.1461 59.6552 28.6258 179.0600 30 S 4.1453 8.1741 114.0824 61.2547 62.9511 175.5095 31 I 4.3590 7.4811 110.0869 60.6713 37.9897 175.8725 32 L 4.4845 7.7477 120.2237 55.7867 43.3512 176.7480 33 D 4.5074 7.9223 118.1389 55.2833 41.8764 176.1340 34 E 3.2533 8.2912 121.6839 57.4939 26.3197 176.5239 35 Q 4.8482 7.1825 117.5921 54.4738 28.8129 176.4980 36 Y 4.3730 8.9141 121.9609 60.4038 38.7207 176.1501 37 H 5.4888 8.2071 118.8070 54.6279 33.0313 172.7846 38 V 4.4497 9.6453 126.7920 61.1883 33.9326 174.1635 39 N 4.7662 8.7497 127.7042 52.2463 39.2403 175.3472 40 A 2.8015 8.2827 130.5061 54.7656 18.2244 178.9462 41 F 3.6857 7.5049 113.1003 59.2202 38.8481 175.9556 42 T 4.1372 7.3964 109.9920 60.4513 69.4698 174.4487 43 F 4.1186 7.3721 120.1065 57.0235 37.1225 173.4371 44 P 4.7398 0.0000 0.0000 62.6914 33.1529 177.3028 45 R 4.7626 8.5806 119.6404 56.8494 31.1176 175.4612 46 Y 4.8469 8.9829 122.3755 55.5241 42.8255 172.0448 47 P 4.6751 0.0000 0.0000 62.7325 32.4495 175.5330 48 I 4.3713 8.1521 123.2787 59.3752 41.4553 174.1367 49 I 4.4387 8.0416 126.6997 59.9329 39.0226 175.2467 50 T 4.6626 7.9040 117.6328 59.6805 71.4079 173.5312 51 S 4.2685 8.6118 114.4531 60.4317 63.3175 174.4639 52 S 4.2869 7.7096 116.7855 58.1577 62.7683 173.5906 53 D 4.5956 8.6627 124.8377 54.9839 40.3456 175.0681 54 E 5.0257 7.7943 119.6325 54.3646 31.4614 176.1517 55 V 3.5871 8.2715 124.6265 63.1838 32.3442 175.8020 56 Q 4.2721 8.6165 127.1031 54.6824 31.3354 174.8228 57 V 4.5081 7.7777 118.7597 61.6211 33.7428 174.1496 58 F 5.5061 8.7193 126.1236 55.8183 43.3563 174.1414 59 N 5.5283 9.1623 117.6870 52.0237 40.5316 174.6473 60 W 3.0913 9.1155 133.7154 57.5182 31.9457 174.9503 61 G 4.4174 8.7476 117.5549 45.5325 0.0000 171.8068 62 L 3.9601 8.2173 126.5319 55.0557 42.8171 176.3141 63 I 3.9599 8.2310 127.7031 58.4815 38.3733 173.9177 64 P 4.1512 0.0000 0.0000 62.0479 31.5276 177.8207 65 F 4.5745 8.2621 116.4614 58.9722 37.7684 176.4150 66 W 4.5707 6.2551 115.7007 56.8261 28.5182 176.4854 67 V 3.5617 6.7509 120.2984 63.4284 31.1621 175.4915 68 R 4.4154 8.8362 126.9627 57.7179 31.0154 176.7937 69 S 4.9607 7.7396 113.6030 56.1158 66.2469 174.5605 70 E 4.1748 8.8414 124.8797 59.8526 28.9044 179.0986 71 E 3.8906 8.1707 120.0776 59.0029 29.6813 178.4011 72 D 4.2843 8.0144 118.1679 57.0476 40.9589 178.2883 73 A 3.4498 7.6391 121.4078 55.2303 17.9371 179.8040 74 T 3.5419 7.2069 112.7359 66.6115 68.7705 176.5696 75 E 4.0432 7.6934 119.7278 59.5402 29.3807 179.3347 76 I 3.6436 7.6952 119.0741 64.2756 37.1953 178.3978 77 R 4.1888 7.3730 116.7389 57.6628 29.2740 177.5447 78 K 4.4736 7.5266 119.3715 57.3035 31.7961 177.5131 *80 T 4.5847 7.9376 106.6382 61.4860 70.3441 175.4452 81 L 4.1576 8.1763 124.8161 57.7713 42.6229 176.5856 82 N 5.5984 8.3299 113.4220 51.2635 42.7173 174.2476 83 A 4.4119 8.6487 122.1132 49.9735 22.0924 176.1124 84 R 4.2620 9.0593 121.5795 55.7724 30.8444 176.9491 85 A 4.0946 9.0380 127.1933 55.1680 18.6510 179.3362 86 D 4.4812 8.2616 114.4434 55.9121 39.7231 177.2065 87 T 4.6463 7.7379 108.1973 61.1180 69.0519 175.7717 88 I 3.8526 7.5012 124.4708 64.3689 37.9921 177.1944 89 F 4.5441 8.0799 117.3762 59.1415 39.2675 175.8313 90 E 4.4514 8.2050 118.7322 57.2919 30.8776 176.7129 91 K 3.9087 8.0848 120.7549 56.0092 32.5770 175.3788 92 P 4.2254 0.0000 0.0000 65.9227 31.4104 177.9626 93 S 4.3166 7.9014 112.7678 60.5264 62.9794 174.7478 94 F 5.1565 7.6328 116.5962 56.9919 41.0030 177.1447 95 R 4.0400 8.4613 118.3414 59.4187 28.9163 178.2122 96 E 4.1874 8.2375 118.2180 58.6644 30.2652 176.1659 97 P 4.3678 0.0000 0.0000 65.4336 31.0774 178.6753 98 I 3.7911 7.5582 113.1335 61.8481 37.1137 176.6365 *100 K 4.2660 7.9504 118.1361 55.4427 34.4697 175.8327 101 K 4.5251 8.2249 117.8317 54.8109 31.4194 176.0326 102 R 4.9685 7.7427 119.1926 56.1383 32.0762 177.0003 103 C 5.0192 9.5333 116.1692 57.6790 34.1823 172.1787 104 I 4.6224 8.8156 119.4922 59.4552 39.7656 175.3417 105 V 4.3084 8.1217 127.2352 60.2424 32.0470 173.4869 106 P 4.6138 0.0000 0.0000 63.1836 32.1148 175.5817 107 S 4.5307 8.3905 114.9543 57.2123 66.1226 174.0633 108 T 4.7068 8.8806 117.6157 60.1399 67.9299 173.1053 109 G 4.4445 6.7017 106.7753 43.7136 0.0000 171.8361 110 Y 5.1091 8.1773 118.2464 55.5188 42.0728 173.6782 111 F 5.7286 8.8071 117.6694 55.2693 41.7643 175.2771 112 E 4.8341 8.1740 119.3482 55.0484 34.1549 173.7505 113 W 5.3652 9.1303 122.3315 55.1811 31.5370 175.2249 114 R 5.2813 9.1877 125.0115 54.7202 31.4645 174.3961 115 H 5.2881 9.3185 124.1214 54.4747 30.1251 175.6127 116 E 4.6204 8.3000 123.1353 54.3836 31.1493 178.0141 117 G 3.7830 8.7245 115.7452 46.5838 0.0000 172.8786 118 A 4.2578 9.2582 127.2985 52.8965 19.8750 178.3731 119 N 4.9063 7.8736 112.6944 51.5599 40.9636 173.8322 120 K 4.9804 8.3165 118.4581 54.8806 34.9296 176.2881 121 I 4.4079 9.0724 128.5450 59.6470 38.3142 173.9041 122 P 4.4988 0.0000 0.0000 62.7614 32.7788 174.9240 123 Y 4.9988 8.9717 120.7757 56.2518 42.1145 173.7431 124 Y 4.7366 8.5225 123.7979 55.9437 40.9624 174.2509 125 I 4.6170 7.7765 128.0944 59.5478 40.0159 174.4548 126 Y 5.0695 8.0148 123.6535 55.9129 41.7892 173.8582 127 V 4.2082 8.2265 118.7648 60.6902 33.2514 175.2655 128 K 4.1193 8.3750 128.2716 58.1431 32.3545 176.3806 129 D 4.5284 9.1167 121.0416 55.1289 38.6489 174.0767 130 E 4.5926 7.8886 120.8380 53.2441 29.8618 173.6351 131 P 4.2911 0.0000 0.0000 64.7039 31.7562 176.1430 132 I 4.9665 7.6861 117.6012 59.3373 39.5621 174.9386 133 F 5.4935 8.3826 121.7561 54.6270 41.7597 174.3481 134 S 4.9585 8.3712 114.4620 56.7380 66.4315 172.6531 *136 A 3.7109 8.3627 120.4470 52.3247 19.8291 176.4899 137 G 4.7351 9.1367 108.1410 45.0853 0.0000 171.0669 138 I 5.5967 8.7088 111.5652 59.4852 41.3356 173.7496 139 Y 5.6056 8.5753 120.7888 56.1642 41.6872 173.1618 140 D 4.7662 9.1419 118.1354 53.2203 45.5639 173.5873 141 R 5.2020 8.6575 117.5687 54.0368 32.6334 174.0984 142 W 5.1620 9.4679 132.7344 55.3613 34.0824 173.4995 143 L 4.7834 8.1161 127.4976 53.8115 41.6679 175.5034 144 D 3.7668 7.3522 125.1779 51.5392 39.8360 177.7169 145 K 3.7525 8.7684 124.3746 58.9212 32.0630 177.9534 146 D 4.4660 7.6771 118.4041 56.0388 39.8788 177.5690 147 T 3.9773 7.9194 111.1369 61.1171 69.4185 176.0419 148 G 3.8186 8.1725 109.9494 45.5956 0.0000 173.4429 149 E 4.2455 7.7786 119.2770 55.8911 31.1038 175.3644 150 E 4.5801 8.4625 121.5930 55.3472 31.3220 175.1023 151 H 4.9340 9.2979 122.2333 54.1701 31.6287 172.8694 152 E 5.0852 8.8900 123.6722 54.9896 31.4571 175.3627 153 T 5.6169 8.8372 114.1427 60.1232 73.1474 172.3164 154 F 5.7184 8.9099 115.8599 55.8217 42.3324 173.1106 155 S 4.9762 9.3997 113.0495 56.7286 66.1918 172.5158 156 I 4.5271 8.4811 126.8214 60.3889 38.8380 175.1526 157 I 4.4468 8.4406 128.1035 61.1139 38.3633 175.1229 158 T 4.8799 8.8382 116.7512 60.2126 71.9216 173.1030 159 T 4.7983 7.9622 111.8341 59.8835 72.3890 172.6464 160 D 4.7708 8.6373 120.9831 54.4163 41.6249 176.7862 161 T 4.2521 8.3919 110.6395 61.3009 70.1922 174.2860 162 N 4.9020 8.1552 120.7086 51.2202 40.9535 175.5025 163 S 4.1279 8.4162 114.3200 61.7061 62.9050 176.1681 164 L 3.8754 7.8293 123.3542 58.2882 42.0070 179.0042 165 T 3.9223 8.8929 115.9905 66.4884 68.1179 176.3721 166 D 4.5520 8.4280 119.8444 57.1802 41.2424 177.4368 167 Y 4.1317 7.5062 119.7042 60.4845 39.1607 177.5050 168 I 3.4890 7.5568 120.2219 63.6716 38.6596 176.2213 169 D 4.8568 8.2176 121.2291 52.9594 37.4354 176.2639 170 N 4.6506 7.6127 114.8456 53.7013 38.4025 176.1797 171 T 4.3001 7.8658 108.5774 63.1302 70.3057 175.5221 172 K 4.2356 8.4267 119.7499 55.5215 33.4658 176.0374 173 H 4.1347 7.9673 114.7767 57.3386 26.3590 172.9675 174 R 4.7687 8.4289 116.8657 53.8505 34.0974 173.5453 *176 P 3.9266 0.0000 0.0000 62.3405 32.1021 176.9348 177 A 4.1315 8.5731 123.4670 51.7532 18.0277 177.0265 178 I 4.1754 7.9339 121.9016 61.0356 38.5757 175.6142 179 L 5.0239 8.4760 126.1684 52.9220 44.1351 176.8585 180 T 4.3993 9.2624 113.2427 61.0642 69.7443 175.3949 181 Q 4.3087 8.6042 123.7282 58.9131 28.6782 178.2348 182 E 3.9497 7.6543 118.9287 58.7960 29.7283 178.3297 183 E 4.3433 8.1788 118.0426 57.8277 29.3513 178.2786 184 E 4.0636 7.7378 119.1551 59.5952 29.6779 178.8177 185 E 4.0230 8.2583 118.2640 59.3308 29.8202 178.3153 186 K 3.8833 8.2514 119.0883 59.5888 31.9337 177.9556 187 W 4.4486 8.4241 127.3971 60.4689 30.6581 177.0159 188 L 4.3376 7.7772 115.6200 53.8189 41.5747 176.3056 189 N 4.4576 7.8065 120.1250 52.6858 39.0642 174.0000 190 P 4.2939 0.0000 0.0000 65.3712 31.5854 177.5496 191 S 4.3625 8.2227 112.5784 59.1928 63.0695 174.6228 192 L 4.1886 7.3938 121.7777 55.0468 41.8659 177.9124 193 S 4.5649 8.6755 118.6794 56.8671 65.8781 175.3161 194 K 3.6966 8.4402 121.7886 59.7728 31.6753 178.3362 195 A 3.9694 7.8275 120.2783 55.1899 18.1367 179.2782 196 E 3.9772 7.7821 116.3509 59.4721 29.8973 179.3456 197 I 4.0634 8.1444 119.7866 64.5665 37.2397 178.3480 198 A 4.3395 8.4447 121.8203 55.2496 18.0392 179.7269 199 S 4.2012 8.3314 111.6307 60.8414 63.1140 175.7402 200 L 4.5949 7.7704 120.5784 54.4089 42.8020 177.1341 201 L 4.5143 7.7505 120.2682 52.6464 40.7944 175.5054 202 K 4.7299 7.7057 120.2058 53.3174 36.6004 174.6045 203 P 4.3253 0.0000 0.0000 62.4281 31.7020 176.7688 204 F 4.4122 8.5907 124.8136 57.8888 40.3732 174.2958 205 D 4.3169 7.4291 125.4208 54.1513 41.1803 177.5053 206 T 3.8039 8.5439 119.1675 64.9814 67.5046 174.9364 207 E 4.0265 8.0187 118.0075 58.7153 29.8205 176.7766 208 K 4.1887 7.5395 119.1506 56.6537 32.7034 175.5331 *210 D 4.5087 7.8970 116.7659 54.5345 42.8021 173.2928 211 A 5.0870 8.1882 121.1619 51.5938 22.2095 174.9458 212 Y 5.0544 8.2317 116.0702 55.6121 42.0538 174.3346 213 V 3.8876 8.5272 121.3406 62.9421 32.8939 175.3164 214 I 4.8714 7.8627 121.6383 59.2077 40.4550 174.2915 215 R 4.5515 8.2274 118.4935 55.1054 31.0504 177.1656 216 N 4.9016 8.9175 119.4020 54.6663 37.6239 175.0558 217 D 4.6697 8.0572 118.6273 53.4788 40.4886 178.0687 218 F 4.2847 8.2617 116.2306 59.8786 37.9143 177.3327 219 L 3.7080 6.8482 119.6699 56.3086 41.4337 177.4855 220 K 4.3264 7.5356 116.3591 56.1554 32.8968 176.7536 221 K 4.3384 7.4271 118.5484 55.1815 33.1649 176.4766 222 S 4.3444 8.3884 115.0520 57.5077 63.0836 173.0697 223 P 4.5669 0.0000 0.0000 65.5263 31.2393 177.1058 224 N 5.5107 8.1256 112.1809 51.8091 37.7909 173.9875 225 D 4.5280 8.5409 120.7496 53.1067 41.3588 175.2869 226 P 2.9700 0.0000 0.0000 64.9941 31.2077 177.9925 227 T 4.0012 7.6220 107.6026 63.2175 68.6023 176.4519 228 I 3.7816 7.3388 122.8181 63.9812 37.1361 176.8767 229 V 4.0121 6.7714 109.6802 60.7524 31.5860 175.6485 230 Q 3.9918 7.7917 122.8306 55.5087 29.2487 175.8528 231 R 4.2660 8.3988 125.8183 56.3060 30.5713 175.7825 232 A 4.1846 8.7777 128.4420 52.0988 19.2366 177.3930 233 L 4.1559 8.5418 119.4491 56.2637 39.9597 177.1157 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 2 C 8.34 4.49 0.00 2.53 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 3 F 8.42 4.39 0.00 3.02 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 0.00 0.00 0.00 4 H 8.70 5.51 0.00 3.53 3.81 0.00 5.60 0.00 0.00 0.00 0.00 6.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 N 9.55 5.34 0.00 2.87 2.70 0.00 0.00 6.38 7.77 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 6 S 8.46 5.27 0.00 3.90 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 *8 S 8.73 3.53 0.00 3.75 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 9 A 7.26 4.52 1.20 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 0.00 0.00 10 K 8.09 4.54 0.00 1.78 1.80 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.48 7.81 11 A 8.66 3.89 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 12 I 7.75 3.62 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.99 0.89 0.00 0.00 13 K 7.93 4.02 0.00 1.79 1.89 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.46 7.81 14 V 7.51 3.58 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 0.92 0.00 0.00 0.89 0.00 0.00 15 A 8.09 3.98 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.92 3.99 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 17 R 7.90 3.76 0.00 1.74 2.10 0.00 2.95 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.53 0.00 18 Y 7.45 4.58 0.00 2.89 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 19 G 7.90 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 0.00 0.00 0.00 20 R 8.23 4.73 0.00 1.73 1.82 0.00 3.32 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.68 0.00 21 Q 8.86 4.39 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 22 S 8.31 4.63 0.00 3.95 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 23 D 7.86 4.33 0.00 2.99 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 24 V 7.77 3.70 2.29 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 1.13 0.00 0.00 0.92 0.00 0.00 25 V 7.69 3.77 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 1.00 0.00 0.00 0.92 0.00 0.00 26 E 8.12 4.08 0.00 2.09 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 2.51 0.00 27 I 7.14 3.81 1.08 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.48 0.43 0.00 0.00 28 Y 7.29 4.83 0.00 2.96 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 29 Q 8.20 4.18 0.00 2.05 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.66 6.83 0.00 0.00 0.00 0.00 0.00 2.50 2.41 0.00 30 S 8.17 4.15 0.00 3.90 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 31 I 7.48 4.36 1.94 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.79 0.98 0.00 0.00 32 L 7.75 4.48 0.00 1.71 1.64 1.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 33 D 7.92 4.51 0.00 2.74 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 34 E 8.29 3.25 0.00 2.16 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 2.33 2.22 0.00 35 Q 7.18 4.85 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.78 6.90 0.00 0.00 0.00 0.00 0.00 2.51 2.44 0.00 36 Y 8.91 4.37 0.00 3.11 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 37 H 8.21 5.49 0.00 3.45 3.36 0.00 5.71 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 9.65 4.45 2.49 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 1.27 0.00 0.00 1.26 0.00 0.00 39 N 8.75 4.77 0.00 2.76 2.69 0.00 0.00 7.02 8.32 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 40 A 8.28 2.80 -0.70 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 41 F 7.50 3.69 0.00 2.97 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 42 T 7.40 4.14 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 1.20 0.00 0.00 43 F 7.37 4.12 0.00 3.20 3.13 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 0.00 44 P 0.00 4.74 0.00 2.36 2.33 0.00 3.82 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.36 0.00 45 R 8.58 4.76 0.00 1.73 1.82 0.00 2.72 0.00 0.00 2.51 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 46 Y 8.98 4.85 0.00 3.26 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 47 P 0.00 4.68 0.00 1.79 1.76 0.00 2.20 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.51 0.00 48 I 8.15 4.37 0.89 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.49 0.70 0.00 0.00 49 I 8.04 4.44 1.31 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 0.32 0.29 0.72 0.00 0.00 50 T 7.90 4.66 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 0.91 0.00 0.00 51 S 8.61 4.27 0.00 4.02 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 7.71 4.29 0.00 3.87 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 53 D 8.66 4.60 0.00 2.79 2.90 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 54 E 7.79 5.03 0.00 1.84 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 2.23 2.35 0.00 55 V 8.27 3.59 1.97 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 0.54 0.00 0.00 0.89 0.00 0.00 56 Q 8.62 4.27 0.00 0.98 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.52 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 57 V 7.78 4.51 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 0.55 0.00 0.00 1.01 0.00 0.00 58 F 8.72 5.51 0.00 3.31 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 59 N 9.16 5.53 0.00 2.88 2.89 0.00 0.00 7.05 7.24 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 60 W 9.12 3.09 0.00 3.25 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 61 G 8.75 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 62 L 8.22 3.96 0.00 1.73 1.74 1.06 1.07 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 63 I 8.23 3.96 1.70 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 0.87 0.71 -0.20 0.00 0.00 64 P 0.00 4.15 0.00 0.49 0.85 0.00 2.79 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.63 0.00 65 F 8.26 4.57 0.00 3.24 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 66 W 6.26 4.57 0.00 3.48 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 67 V 6.75 3.56 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 0.43 0.00 0.00 -0.02 0.00 0.00 68 R 8.84 4.42 0.00 1.93 2.05 0.00 3.39 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 69 S 7.74 4.96 0.00 4.05 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 70 E 8.84 4.17 0.00 2.30 2.53 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 2.40 2.38 0.00 71 E 8.17 3.89 0.00 2.10 1.97 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 2.36 2.44 0.00 72 D 8.01 4.28 0.00 2.78 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 73 A 7.64 3.45 0.42 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 74 T 7.21 3.54 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 1.12 0.00 0.00 75 E 7.69 4.04 0.00 2.04 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 2.42 2.45 0.00 76 I 7.70 3.64 1.56 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.46 0.67 0.00 0.00 77 R 7.37 4.19 0.00 1.88 1.80 0.00 2.44 0.00 0.00 2.53 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.50 0.00 78 K 7.53 4.47 0.00 1.98 1.95 0.00 1.74 0.00 0.00 1.79 0.00 0.00 3.11 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.76 1.63 7.81 *80 T 7.94 4.58 4.54 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 1.27 0.00 0.00 81 L 8.18 4.16 0.00 1.86 1.48 0.44 0.22 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 82 N 8.33 5.60 0.00 2.54 2.59 0.00 0.00 6.59 7.35 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 83 A 8.65 4.41 0.03 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 84 R 9.06 4.26 0.00 1.88 1.93 0.00 3.35 0.00 0.00 2.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 85 A 9.04 4.09 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 86 D 8.26 4.48 0.00 2.84 2.87 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 87 T 7.74 4.65 4.33 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 1.28 0.00 0.00 88 I 7.50 3.85 1.89 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.70 0.19 0.00 0.00 89 F 8.08 4.54 0.00 3.18 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 90 E 8.20 4.45 0.00 2.02 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 0.00 2.30 2.40 0.00 91 K 8.08 3.91 0.00 2.07 1.80 0.00 1.83 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.12 1.36 7.81 92 P 0.00 4.23 0.00 1.91 1.73 0.00 3.66 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 1.87 2.00 0.00 93 S 7.90 4.32 0.00 2.72 3.34 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.88 1.34 0.00 103 C 9.53 5.02 0.00 3.13 3.29 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 0.00 104 I 8.82 4.62 1.65 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.04 0.67 0.00 0.00 105 V 8.12 4.31 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 0.40 0.00 0.00 0.73 0.00 0.00 106 P 0.00 4.61 0.00 2.03 1.94 0.00 3.72 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.67 0.00 107 S 8.39 4.53 0.00 3.57 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 0.00 108 T 8.88 4.71 4.15 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 1.28 0.00 0.00 109 G 6.70 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 0.00 0.00 0.00 0.00 110 Y 8.18 5.11 0.00 3.15 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 0.00 111 F 8.81 5.73 0.00 2.88 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 0.00 112 E 8.17 4.83 0.00 1.76 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 2.49 2.46 0.00 113 W 9.13 5.37 0.00 3.51 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 0.00 114 R 9.19 5.28 0.00 1.97 2.01 0.00 3.27 0.00 0.00 3.35 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.28 0.00 115 H 9.32 5.29 0.00 3.05 3.23 0.00 5.67 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.30 4.62 0.00 1.95 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 2.25 2.25 0.00 117 G 8.72 3.78 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 0.00 0.00 0.00 118 A 9.26 4.26 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 N 7.87 4.91 0.00 2.79 2.76 0.00 0.00 6.93 7.31 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 0.00 120 K 8.32 4.98 0.00 1.60 1.89 0.00 1.48 0.00 0.00 1.45 0.00 0.00 2.69 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.03 1.29 7.81 121 I 9.07 4.41 2.12 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.80 0.82 0.00 0.00 122 P 0.00 4.50 0.00 2.10 2.51 0.00 3.75 0.00 0.00 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 123 Y 8.97 5.00 0.00 2.88 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 0.00 124 Y 8.52 4.74 0.00 2.83 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 0.00 0.00 0.00 125 I 7.78 4.62 0.58 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.10 0.62 0.00 0.00 126 Y 8.01 5.07 0.00 2.93 2.43 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 0.00 127 V 8.23 4.21 1.97 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 1.11 0.00 0.00 -0.11 0.00 0.00 128 K 8.38 4.12 0.00 1.81 1.79 0.00 1.86 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.25 7.81 129 D 9.12 4.53 0.00 2.86 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 0.00 130 E 7.89 4.59 0.00 1.99 1.91 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 2.25 2.31 0.00 131 P 0.00 4.29 0.00 2.22 2.13 0.00 3.61 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 132 I 7.69 4.97 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.57 0.89 0.00 0.00 133 F 8.38 5.49 0.00 2.94 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 0.00 134 S 8.37 4.96 0.00 3.82 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 *136 A 8.36 3.71 0.12 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 0.00 0.00 137 G 9.14 4.74 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 0.00 0.00 0.00 138 I 8.71 5.60 1.93 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.75 1.00 0.00 0.00 139 Y 8.58 5.61 0.00 3.05 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 0.00 140 D 9.14 4.77 0.00 2.74 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 0.00 141 R 8.66 5.20 0.00 1.98 2.02 0.00 3.02 0.00 0.00 3.36 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 142 W 9.47 5.16 0.00 3.43 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 L 8.12 4.78 0.00 1.46 1.65 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 144 D 7.35 3.77 0.00 2.57 1.54 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 0.00 145 K 8.77 3.75 0.00 1.75 1.91 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.40 7.81 146 D 7.68 4.47 0.00 2.77 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 0.00 147 T 7.92 3.98 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 1.27 0.00 0.00 148 G 8.17 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 0.00 0.00 0.00 149 E 7.78 4.25 0.00 1.96 1.71 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 2.28 2.24 0.00 150 E 8.46 4.58 0.00 1.81 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 2.19 2.24 0.00 151 H 9.30 4.93 0.00 3.44 3.37 0.00 5.59 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 E 8.89 5.09 0.00 1.95 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 2.24 2.30 0.00 153 T 8.84 5.62 4.37 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 1.27 0.00 0.00 154 F 8.91 5.72 0.00 3.39 3.44 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 0.00 155 S 9.40 4.98 0.00 4.04 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 0.00 156 I 8.48 4.53 1.87 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.30 0.73 0.00 0.00 157 I 8.44 4.45 1.81 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.52 0.86 0.00 0.00 158 T 8.84 4.88 4.17 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 0.00 0.00 0.00 1.07 0.00 0.00 159 T 7.96 4.80 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 1.11 0.00 0.00 160 D 8.64 4.77 0.00 2.60 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 0.00 161 T 8.39 4.25 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 1.28 0.00 0.00 162 N 8.16 4.90 0.00 2.98 3.10 0.00 0.00 5.69 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 S 8.42 4.13 0.00 4.05 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 0.00 164 L 7.83 3.88 0.00 1.70 1.78 0.81 0.69 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 0.00 165 T 8.89 3.92 4.33 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 1.28 0.00 0.00 166 D 8.43 4.55 0.00 2.82 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 0.00 167 Y 7.51 4.13 0.00 3.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 I 7.56 3.49 1.67 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.66 0.63 0.00 0.00 169 D 8.22 4.86 0.00 2.79 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 0.00 170 N 7.61 4.65 0.00 2.81 2.92 0.00 0.00 6.22 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 0.00 171 T 7.87 4.30 4.20 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 1.06 0.00 0.00 172 K 8.43 4.24 0.00 2.17 1.97 0.00 1.96 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.67 7.81 173 H 7.97 4.13 0.00 3.35 3.36 0.00 5.59 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 0.00 174 R 8.43 4.77 0.00 1.86 1.81 0.00 3.39 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.75 0.00 *176 P 0.00 3.93 0.00 1.70 1.70 0.00 3.16 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.53 0.00 177 A 8.57 4.13 1.05 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 0.00 178 I 7.93 4.18 1.03 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.49 -0.22 0.00 0.00 179 L 8.48 5.02 0.00 1.37 1.52 0.44 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 180 T 9.26 4.40 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 181 Q 8.60 4.31 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.95 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 182 E 7.65 3.95 0.00 2.06 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 2.37 2.37 0.00 183 E 8.18 4.34 0.00 2.20 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 0.00 2.37 2.40 0.00 184 E 7.74 4.06 0.00 2.22 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 2.44 2.75 0.00 185 E 8.26 4.02 0.00 2.10 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 0.00 2.43 2.43 0.00 186 K 8.25 3.88 0.00 1.94 2.11 0.00 1.85 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.63 1.59 7.81 187 W 8.42 4.45 0.00 3.39 3.38 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 0.00 188 L 7.78 4.34 0.00 1.85 1.71 0.99 1.13 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 0.00 189 N 7.81 4.46 0.00 2.79 2.78 0.00 0.00 7.14 7.21 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 0.00 190 P 0.00 4.29 0.00 2.07 2.09 0.00 3.72 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 191 S 8.22 4.36 0.00 3.93 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 0.00 192 L 7.39 4.19 0.00 1.71 1.59 1.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 193 S 8.68 4.56 0.00 4.05 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 0.00 194 K 8.44 3.70 0.00 1.65 1.66 0.00 1.40 0.00 0.00 1.54 0.00 0.00 2.19 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.80 0.21 7.81 195 A 7.83 3.97 1.30 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 0.00 196 E 7.78 3.98 0.00 2.11 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 2.38 2.37 0.00 197 I 8.14 4.06 2.43 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.39 1.17 0.00 0.00 198 A 8.44 4.34 1.57 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 0.00 0.00 199 S 8.33 4.20 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 0.00 200 L 7.77 4.59 0.00 2.17 1.88 1.26 0.96 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 0.00 201 L 7.75 4.51 0.00 1.80 1.60 1.04 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 202 K 7.71 4.73 0.00 1.69 1.66 0.00 1.85 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.47 7.81 203 P 0.00 4.33 0.00 2.04 2.09 0.00 3.69 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.23 0.00 204 F 8.59 4.41 0.00 2.75 2.90 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 0.00 205 D 7.43 4.32 0.00 2.27 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 0.00 206 T 8.54 3.80 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 1.14 0.00 0.00 207 E 8.02 4.03 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 208 K 7.54 4.19 0.00 1.68 1.82 0.00 0.89 0.00 0.00 1.30 0.00 0.00 2.71 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.27 1.11 7.81 *210 D 7.90 4.51 0.00 2.42 1.79 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 0.00 211 A 8.19 5.09 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 0.00 0.00 0.00 0.00 0.00 212 Y 8.23 5.05 0.00 3.10 3.17 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 0.00 0.00 0.00 0.00 213 V 8.53 3.89 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 0.95 0.00 0.00 0.32 0.00 0.00 214 I 7.86 4.87 1.82 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 1.32 0.73 0.99 0.00 0.00 215 R 8.23 4.55 0.00 2.07 1.97 0.00 3.15 0.00 0.00 3.41 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 216 N 8.92 4.90 0.00 2.93 3.14 0.00 0.00 6.14 8.06 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 0.00 217 D 8.06 4.67 0.00 2.88 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 0.00 218 F 8.26 4.28 0.00 3.12 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 0.00 219 L 6.85 3.71 0.00 1.33 1.53 0.72 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 220 K 7.54 4.33 0.00 1.72 1.81 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.48 7.81 221 K 7.43 4.34 0.00 2.02 1.79 0.00 1.77 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.49 1.57 7.81 222 S 8.39 4.34 0.00 3.89 3.78 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 0.00 223 P 0.00 4.57 0.00 2.32 2.44 0.00 3.71 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.19 0.00 224 N 8.13 5.51 0.00 2.96 3.03 0.00 0.00 6.33 8.06 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 0.00 225 D 8.54 4.53 0.00 2.75 2.72 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 0.00 0.00 0.00 0.00 226 P 0.00 2.97 0.00 1.94 1.73 0.00 3.48 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.87 0.00 227 T 7.62 4.00 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 1.14 0.00 0.00 228 I 7.34 3.78 2.02 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.67 0.98 0.00 0.00 229 V 6.77 4.01 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.88 0.00 0.00 230 Q 7.79 3.99 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.23 0.00 231 R 8.40 4.27 0.00 1.31 1.61 0.00 2.61 0.00 0.00 2.97 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 232 A 8.78 4.18 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 L 8.54 4.16 0.00 1.65 1.68 0.92 0.55 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 * Residues marked with a * may have inaccurate shift predictions.