NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2311 8.4401 120.2208 55.9204 30.9908 174.6320 3 A 3.8977 8.1305 122.2890 49.6332 19.1704 175.1606 4 P 4.5901 0.0000 0.0000 62.7519 34.0285 173.2149 5 A 5.2767 9.4347 122.3118 50.1305 22.2420 175.1275 6 A 5.2119 9.2801 122.7265 50.1043 22.8409 175.0774 7 V 4.5622 9.0852 121.7294 61.1827 33.9548 174.6014 8 V 4.8971 8.4150 128.1594 61.2141 33.6526 174.8430 9 T 4.3572 8.6460 118.9856 61.3192 70.0857 174.5501 10 G 4.0161 8.8633 109.1926 46.8800 0.0000 174.3152 11 A 4.3041 8.2075 119.7454 52.1698 19.7321 180.1100 12 A 4.0280 8.0627 118.9805 54.2360 18.9436 177.6333 13 K 4.7617 7.3763 112.8292 54.9510 37.5731 179.4517 14 R 3.6205 8.1726 119.9347 57.3512 29.6791 178.9155 15 I 3.7978 8.6334 126.5353 65.3708 36.6757 177.4923 16 G 3.7961 8.0202 107.4050 47.0779 0.0000 175.3186 17 R 4.1946 8.1124 121.6775 58.7157 30.1639 178.3533 18 A 3.8959 7.7840 119.9225 55.2058 18.2779 179.6421 19 I 3.5881 7.8631 117.8895 64.4675 37.3497 178.4393 20 A 3.9504 8.2395 121.8467 55.2266 18.2479 179.6674 21 V 3.5382 8.5248 117.4050 66.1822 31.6559 178.1985 22 K 4.1713 8.1711 119.1694 59.3473 31.9963 178.6676 23 L 3.9077 8.2579 119.8020 58.1491 41.5095 179.1231 24 H 4.5854 8.1197 119.0810 58.9326 29.6463 177.4241 25 Q 4.0906 8.1146 118.6661 58.9616 28.5742 178.3106 26 T 4.2656 7.6055 115.1687 63.8428 68.7474 175.2264 27 G 4.0124 7.5055 107.9572 45.1650 0.0000 173.7218 28 Y 4.3096 8.5859 118.5604 57.7137 39.4145 175.1903 29 R 4.3016 8.8458 121.8150 55.6430 31.9757 176.0167 30 V 4.9417 8.5909 115.5054 59.6264 36.0733 174.7111 31 V 4.7474 9.1601 125.1752 61.7729 33.1554 174.9524 32 I 4.2127 9.2094 130.7461 60.4703 37.7183 174.5571 33 H 5.1977 8.9609 128.4396 55.9778 31.2385 173.5852 34 Y 4.8345 8.3302 121.7754 56.3391 41.3567 173.4074 35 H 4.6288 9.1700 116.7920 57.2393 32.2129 174.8573 36 N 4.6315 7.9698 115.9074 55.2204 40.3690 177.1261 37 S 4.4737 7.8389 115.5303 57.3044 59.6503 174.6433 38 A 2.5800 7.4375 128.4031 54.7953 18.8527 178.7340 39 E 3.7236 8.0331 116.9738 59.6199 29.7563 178.8883 40 A 3.9369 7.8225 119.8246 54.8836 18.5049 179.3516 41 A 3.8851 7.7585 119.5009 55.2533 18.4061 180.0887 42 V 3.4928 7.7367 116.9338 66.0777 31.4523 178.0999 43 S 4.0451 8.1521 113.0196 61.1893 62.0722 176.0079 44 L 3.8701 7.8929 122.4887 58.1367 41.9721 178.4128 45 A 3.9843 7.9853 120.6992 55.5635 18.1465 179.2383 46 D 4.2835 8.2260 116.9899 57.6899 40.6965 178.8117 47 E 3.9171 7.9289 119.6786 59.1833 29.5655 178.8809 48 L 3.9704 8.1430 119.2727 57.7691 41.4804 179.1604 49 N 4.9578 8.4121 117.2205 55.7094 38.5311 177.1168 50 K 4.0655 8.1466 120.4770 59.2661 32.2376 178.2862 51 E 4.2039 7.6209 117.9054 57.3766 30.1981 176.5838 52 R 4.5899 8.0276 117.3371 53.9121 33.3117 175.3701 53 S 4.4483 8.8348 119.2797 60.2071 63.3817 173.7734 54 N 4.3272 8.7403 120.0382 55.0879 36.0522 174.7303 55 T 4.6119 8.3510 106.0708 61.4483 70.9644 173.6115 56 A 5.3239 8.3225 123.6964 50.6601 21.8865 175.6879 57 V 4.6354 9.1597 115.2396 59.7062 35.8477 175.2261 58 V 5.0023 8.3624 114.9277 60.2675 34.0622 175.1606 59 C 4.7255 9.1653 123.1425 57.8300 34.8638 172.3420 60 Q 3.7846 8.5140 127.4063 54.7052 29.6947 174.6629 61 A 4.4418 8.3744 127.4527 51.0195 22.8515 175.3235 62 D 4.2573 8.7296 123.0699 53.4479 40.7605 175.4862 63 L 4.2972 8.3145 126.0259 54.9995 41.5897 177.2368 64 T 3.8739 7.8513 109.6002 62.1545 68.4165 173.5743 65 N 3.9211 8.1281 124.7466 52.9316 38.7243 173.3454 66 S 4.6111 8.3140 119.7141 57.1348 65.7945 174.3361 67 N 4.3309 8.7575 116.9151 55.5576 37.0369 175.9658 68 V 4.1503 8.1831 111.3949 61.1744 32.5308 177.4528 69 L 3.9539 7.6604 122.9927 57.6994 41.8472 176.9752 70 P 4.2582 0.0000 0.0000 65.3888 31.2930 178.4199 71 A 3.9615 7.9067 119.0287 55.3378 18.5809 179.4229 72 S 4.3511 8.0499 115.0694 61.3841 62.8030 177.0625 73 C 4.1170 8.1558 119.0039 62.8114 27.8672 175.5910 74 E 3.9390 8.1254 120.2404 59.8155 29.0370 179.5235 75 E 3.9556 8.2214 118.0383 59.4637 29.3104 179.4937 76 I 3.8247 7.3815 118.0672 64.5435 37.4514 178.3053 77 I 4.0105 7.6361 120.3212 64.4976 36.9118 178.1280 78 N 4.4573 8.5312 117.8485 56.5272 38.5158 177.5941 79 S 4.2332 8.5070 115.7371 61.1633 62.9909 176.3097 80 C 4.0708 7.9975 122.2163 62.5741 31.4610 175.3659 81 F 4.1625 8.2835 118.8658 60.7686 38.2554 177.7914 82 R 3.9407 8.3698 117.0246 59.1257 29.9218 178.5859 83 A 3.8704 7.4598 119.2083 53.9040 18.5162 178.1022 84 F 4.9113 7.8386 112.3305 56.2574 41.1345 176.1381 85 G 3.9898 9.0430 108.4816 45.0408 0.0000 173.1852 86 R 3.8648 6.9777 112.8523 55.6732 31.0280 173.7310 87 C 4.3289 7.6537 118.6777 58.3146 33.3880 172.8197 88 D 4.8570 9.4809 128.4651 55.5752 42.5998 177.1256 89 V 5.4367 7.8415 117.4872 60.1847 35.3669 173.5883 90 L 4.9751 8.1592 128.9781 53.1327 45.0433 174.7499 91 V 4.5160 8.8035 126.8177 61.3637 33.3810 174.3149 92 N 4.8958 8.9981 127.7666 52.5414 37.1521 174.7090 93 N 4.7140 8.4321 121.0640 53.9576 41.4508 174.7813 94 A 4.0742 8.0045 121.1679 52.9149 18.8873 176.8396 95 S 4.5407 8.4922 114.9916 57.1571 65.4785 173.2718 96 A 4.8704 8.5317 130.3826 50.8474 20.7907 176.2486 97 F 4.4378 8.2401 122.6779 57.9830 41.5829 172.9130 98 Y 4.1589 6.8976 124.4869 55.5270 39.7521 171.4559 99 P 3.3812 0.0000 0.0000 62.5310 32.1668 176.8442 100 T 4.5267 8.1406 109.7124 58.7916 68.7775 171.2047 101 P 4.2840 0.0000 0.0000 63.6257 32.2227 176.9780 102 L 4.1702 8.4587 121.6719 56.8531 42.1345 177.4403 103 V 4.2698 7.3782 117.6245 62.0608 31.8301 174.0608 *113 G 3.6955 7.7735 107.4404 45.2282 0.0000 172.3968 114 K 4.3397 8.0889 117.9508 55.3228 33.3866 177.8150 115 T 4.1370 8.0965 111.6951 61.5728 70.8057 175.9360 116 V 3.9905 8.5786 124.2728 64.3370 31.4165 178.1552 117 E 3.9685 8.2525 117.8616 59.8533 29.1218 179.3550 118 T 3.9208 7.7694 116.5962 66.3190 68.1873 176.6086 119 Q 4.3658 8.5111 121.8016 58.4670 28.6626 179.5425 120 V 3.6283 8.3527 119.2147 65.7162 31.5742 177.6181 121 A 4.0091 8.0454 120.6425 55.4869 18.2252 179.5636 122 E 3.9659 8.4460 116.6901 59.7698 29.5770 179.5863 123 L 4.0998 8.2140 117.5998 56.6788 41.9589 178.5407 124 I 4.3047 7.6088 118.6373 63.2314 38.3878 177.1621 125 G 4.3051 8.2842 107.7056 48.9142 0.0000 175.2873 126 T 4.0222 8.1583 116.3534 63.9119 67.9291 176.2273 127 N 4.5111 8.2454 117.8286 55.3129 39.3413 175.3702 128 A 4.5285 7.8730 117.9646 53.2547 21.6664 178.0547 129 I 3.8367 8.1059 116.4687 64.2524 37.0644 178.5125 130 A 4.0146 8.2655 121.8249 54.8904 18.2912 177.8506 131 P 4.4661 0.0000 0.0000 65.0207 31.2927 178.6441 132 F 4.2078 8.1578 119.2386 61.3092 39.3552 177.3151 133 L 3.7250 8.2094 118.6849 57.5034 41.3466 179.3645 134 L 3.9993 8.5569 119.3667 57.9764 41.5439 179.6200 135 T 3.7787 7.8192 115.5389 66.9612 68.4512 176.0565 136 M 3.7950 7.6783 120.3945 58.9201 32.0808 179.1196 137 S 4.0721 8.0271 114.6028 61.4389 62.7945 176.3479 138 F 4.1168 8.2901 122.3172 61.6117 39.3645 176.8550 139 A 4.0038 8.2778 120.1057 55.0189 17.9450 179.1121 140 Q 3.7783 8.2473 117.5017 59.6111 29.1316 178.8410 141 R 3.8447 7.5717 117.0119 57.8823 30.3344 176.8133 142 Q 4.1827 7.2114 117.4306 54.7258 30.0603 175.0355 *152 S 4.2759 8.1235 112.2464 58.7021 63.8631 173.5696 153 N 4.8933 8.3060 119.9025 51.6447 38.9157 171.5607 154 L 5.0712 7.9717 121.5945 53.4119 43.9157 175.5893 155 S 5.1399 9.0062 117.0631 57.5033 67.0596 173.0454 156 I 4.7344 8.8182 121.1440 59.3825 40.8460 174.8672 157 V 4.7324 8.5264 125.2430 61.2029 34.5876 173.6878 158 N 5.0941 9.1922 125.5648 51.4872 41.2015 174.2953 159 L 4.6555 8.4233 124.1633 54.6404 41.3414 176.0930 160 C 4.6109 8.9267 124.7767 58.3672 31.8298 171.6352 161 D 5.0543 8.2979 117.8940 53.0398 43.1391 177.2119 162 A 4.0845 8.9290 129.6880 54.8441 18.8617 177.6249 163 M 4.5239 8.6400 115.5905 55.3110 32.1968 178.2523 164 V 3.5717 7.5448 115.2873 64.6621 31.6485 177.0300 165 D 4.8362 7.9757 115.4259 54.4774 41.2926 176.8705 166 Q 4.6024 7.7476 118.4818 53.2818 28.9443 173.2070 167 P 4.5751 0.0000 0.0000 62.2411 32.9051 177.1139 168 C 4.4269 8.3753 117.3422 59.2877 28.9253 173.1419 169 M 4.0622 8.5927 122.5421 57.0432 32.5384 176.0940 170 A 3.7938 8.9355 126.2145 52.8447 16.4861 178.1847 171 F 4.8635 7.8073 116.1722 57.6833 40.0399 178.6630 172 S 4.1718 8.3742 117.5636 61.8229 62.8152 175.3114 173 L 3.9780 7.6918 122.9595 57.2186 41.4634 178.6665 174 Y 4.0426 8.0227 119.0188 60.9366 38.6336 177.8148 175 N 4.2938 8.5632 118.0006 56.8048 39.0263 176.6210 176 M 4.1217 8.6294 120.7069 58.5401 32.2291 179.0430 177 G 3.5642 8.0151 105.6567 47.6952 0.0000 175.9004 178 K 3.9445 7.7305 120.2819 59.0904 32.1044 179.3279 179 H 4.0340 8.4197 116.6788 58.8272 28.6234 177.2636 180 A 3.9672 8.2789 123.0147 55.5343 17.9992 179.4944 181 L 3.8594 7.6992 118.0043 58.0806 42.1470 179.2810 182 V 3.6464 7.5691 118.3453 65.9447 31.4840 178.1602 183 G 3.6497 7.9367 105.0354 47.7221 0.0000 175.2931 184 L 3.9947 8.1273 123.0241 58.1353 42.0490 178.9854 185 T 3.8318 8.1708 115.9785 66.9441 68.5684 176.6047 186 Q 3.9644 8.1175 119.5575 58.9770 28.7263 178.7753 187 S 4.1226 8.5679 116.2816 61.7103 62.8516 176.7613 188 A 3.9859 8.6761 123.4602 54.8759 17.5919 179.2179 189 A 3.9251 8.2486 119.7163 55.3910 18.1754 179.6652 190 L 3.8841 7.5210 116.6357 58.5059 42.3860 178.6483 191 E 4.1493 8.3716 117.8048 58.3203 29.9321 177.5963 192 L 4.7939 8.2598 117.3912 54.7447 42.4380 178.0230 193 A 4.0427 7.6930 121.2905 55.0175 18.0893 177.8817 194 P 4.4471 0.0000 0.0000 65.2270 31.4054 177.3261 195 Y 4.4624 7.9009 113.6385 57.1973 38.0284 175.9294 196 G 3.9123 8.2537 108.1336 46.2136 0.0000 173.4030 197 I 4.5409 7.8260 120.3200 60.1025 38.0833 175.6653 198 R 4.4824 8.7942 126.8368 55.2743 32.3377 176.0509 199 V 4.8047 8.7836 121.9296 61.5562 34.8008 173.9769 200 N 5.4656 9.3884 124.5760 51.6056 43.6860 173.3960 201 G 4.4557 9.3391 106.3712 44.4908 0.0000 171.9309 202 V 4.8627 8.7140 121.1224 60.7799 34.5935 174.2349 203 A 5.1106 8.8345 129.9078 48.3515 20.4519 173.6584 204 P 4.5500 0.0000 0.0000 64.3666 32.7985 176.9528 205 G 3.6266 8.9723 110.1665 47.1429 0.0000 174.6409 206 V 4.2943 8.5577 117.8133 60.9678 34.4053 173.9069 207 S 4.9985 7.9599 122.4294 56.9404 63.7749 173.1312 208 L 3.9457 8.4594 120.7733 54.9903 41.1053 176.8184 209 L 3.9939 8.2318 124.2872 53.5719 42.4132 175.7566 210 P 4.2172 0.0000 0.0000 63.1720 31.6179 177.8933 211 V 3.6694 8.5116 116.3691 64.0176 31.9418 177.3388 212 A 4.1021 8.2882 122.2003 55.3289 18.1767 177.6816 213 M 4.3530 7.6308 113.5335 55.6571 33.7468 177.3067 214 G 4.3018 8.1060 117.5554 45.7539 0.0000 174.5904 215 E 4.4533 8.7774 119.5185 57.0291 31.9381 177.0771 216 E 3.9527 8.4825 117.4784 59.4277 29.9061 178.1169 217 E 4.1413 8.1454 118.6094 59.2990 29.9420 178.5163 218 K 4.0933 8.1587 118.0796 59.9374 32.1305 178.8253 219 D 4.4568 8.3839 118.9223 57.0634 40.5023 178.8743 220 K 3.9375 7.6895 118.2045 59.2197 31.7385 179.0223 221 W 4.3416 8.0334 118.6973 59.4657 29.1716 178.8307 222 R 4.0314 8.0418 118.1677 59.3251 29.4003 179.0865 223 R 4.1092 8.3361 116.1035 58.2411 30.0461 178.5907 224 K 4.2980 7.5326 116.9581 57.3772 32.2836 177.1730 225 V 3.7347 7.4240 119.6282 61.9643 31.4999 174.6247 226 P 4.1810 0.0000 0.0000 65.4170 31.3098 176.9357 227 L 4.1658 7.9229 121.6102 53.8385 40.2344 176.0788 228 G 3.8651 8.3110 109.1307 44.0196 0.0000 171.0736 229 R 4.1367 7.9807 115.5277 55.7779 27.8332 175.7768 230 R 4.7477 7.5956 111.2355 53.8908 32.8671 174.2939 231 E 4.3729 8.4957 116.4658 55.6934 30.8984 176.2173 232 A 4.4309 8.1567 123.1869 51.9133 18.8866 178.0324 233 S 4.3222 9.1463 117.0864 57.9181 64.2567 175.4690 234 A 3.9726 8.6752 122.4250 55.3955 18.0141 179.9448 235 E 3.9824 8.0969 116.7571 59.3648 29.4222 179.1378 236 Q 3.9899 7.7905 117.3114 58.9444 28.9866 178.6565 237 I 3.8227 7.5176 120.4842 64.4604 37.1725 178.2915 238 A 4.0019 8.0990 121.4653 55.2993 18.1535 179.1061 239 D 4.3831 8.3722 117.2393 57.8214 40.9122 179.1859 240 A 4.1496 7.9373 120.7132 54.8468 18.3844 179.9219 241 V 3.5015 7.6305 116.4302 66.1740 31.5022 178.0344 242 I 3.6421 7.8988 118.7242 64.3325 37.3427 177.7438 243 F 4.4103 8.2569 121.2549 61.6249 39.0400 177.1905 244 L 3.6375 7.6602 116.8520 57.6178 41.4611 179.5030 245 V 3.8696 7.5314 111.0276 62.0551 32.0826 176.8006 246 S 4.4525 7.2328 113.8450 57.3862 63.6242 175.4413 247 G 3.7662 8.4936 109.6509 48.0244 0.0000 174.7795 248 S 4.3742 7.7767 114.6962 59.9020 63.1592 174.4072 249 A 4.6158 7.7003 123.8653 51.7656 19.1184 178.0946 250 Q 4.0290 8.3163 119.5599 59.7779 28.9100 176.5720 251 Y 4.3987 7.9566 116.8866 57.2540 39.2167 174.6321 252 I 4.2764 7.6142 120.6613 60.8074 37.7647 175.0027 253 T 4.6160 7.9966 119.0761 61.7697 70.1717 173.7866 254 G 3.9251 9.2996 115.9301 45.5703 0.0000 173.2275 255 S 4.7275 8.0803 116.2392 57.1057 65.0553 173.4202 256 I 4.8767 8.2591 124.1560 59.6820 39.2215 175.1868 257 I 4.2155 8.5591 129.7726 60.0391 38.2093 175.8292 258 K 4.4556 8.6887 127.6276 56.3485 32.7348 177.8702 259 V 4.4696 8.7942 125.3015 60.6276 31.3414 174.9772 260 D 4.7961 7.8485 118.6298 51.3291 41.0451 177.3605 261 G 3.9520 9.3287 107.0648 46.7192 0.0000 175.3023 262 G 4.0073 8.4704 107.2884 44.5696 0.0000 175.7011 263 L 3.9431 8.1248 122.8609 58.1336 42.0504 179.4778 264 S 4.1938 8.3629 111.3566 60.7681 62.8565 175.1474 265 L 4.1878 7.5760 119.4387 55.8644 41.8146 177.0241 266 V 3.7306 7.6187 120.1095 62.2390 31.6377 175.5622 267 H 4.5274 8.4752 122.7307 54.5076 29.5736 175.1331 268 A 4.1745 8.5391 121.3735 52.6782 18.1478 177.4642 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 E 8.44 4.23 0.00 1.96 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 0.00 2.21 2.31 0.00 3 A 8.13 3.90 1.16 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 0.00 0.00 4 P 0.00 4.59 0.00 1.70 1.94 0.00 3.28 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.34 0.00 5 A 9.43 5.28 1.22 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 0.00 0.00 6 A 9.28 5.21 1.06 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 0.00 0.00 7 V 9.09 4.56 2.15 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 0.92 0.00 0.00 1.02 0.00 0.00 8 V 8.41 4.90 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 0.94 0.00 0.00 0.89 0.00 0.00 9 T 8.65 4.36 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 10 G 8.86 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 11 A 8.21 4.30 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 12 A 8.06 4.03 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 13 K 7.38 4.76 0.00 1.78 1.67 0.00 1.83 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.42 7.81 14 R 8.17 3.62 0.00 1.99 1.11 0.00 3.13 0.00 0.00 3.34 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 15 I 8.63 3.80 1.86 0.00 0.00 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 1.55 0.88 0.94 0.00 0.00 16 G 8.02 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 17 R 8.11 4.19 0.00 1.82 2.10 0.00 3.15 0.00 0.00 3.26 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.51 0.00 18 A 7.78 3.90 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 19 I 7.86 3.59 1.98 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 1.43 0.72 0.85 0.00 0.00 20 A 8.24 3.95 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 21 V 8.52 3.54 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 1.00 0.00 0.00 0.97 0.00 0.00 22 K 8.17 4.17 0.00 2.14 1.77 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.48 7.81 23 L 8.26 3.91 0.00 1.74 1.45 0.67 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.12 4.59 0.00 3.35 3.49 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Q 8.11 4.09 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.58 0.00 26 T 7.61 4.27 4.62 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 1.33 0.00 0.00 27 G 7.51 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 Y 8.59 4.31 0.00 2.96 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 29 R 8.85 4.30 0.00 0.89 0.66 0.00 2.75 0.00 0.00 3.05 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.31 0.00 30 V 8.59 4.94 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 0.80 0.00 0.00 0.98 0.00 0.00 31 V 9.16 4.75 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 1.04 0.00 0.00 1.15 0.00 0.00 32 I 9.21 4.21 1.97 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 1.15 0.65 0.98 0.00 0.00 33 H 8.96 5.20 0.00 3.26 3.38 0.00 5.56 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Y 8.33 4.83 0.00 3.06 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 H 9.17 4.63 0.00 3.24 3.32 0.00 5.73 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 36 N 7.97 4.63 0.00 2.71 2.82 0.00 0.00 6.92 7.57 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 37 S 7.84 4.47 0.00 3.88 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 38 A 7.44 2.58 1.15 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 0.00 0.00 39 E 8.03 3.72 0.00 1.98 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 2.33 2.34 0.00 40 A 7.82 3.94 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 41 A 7.76 3.89 1.17 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 0.00 0.00 42 V 7.74 3.49 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 0.95 0.00 0.00 0.86 0.00 0.00 43 S 8.15 4.05 0.00 4.00 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 44 L 7.89 3.87 0.00 1.91 1.81 0.91 0.92 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 45 A 7.99 3.98 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 46 D 8.23 4.28 0.00 2.88 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 47 E 7.93 3.92 0.00 1.97 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 0.00 2.29 2.34 0.00 48 L 8.14 3.97 0.00 1.75 1.28 0.80 0.50 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 49 N 8.41 4.96 0.00 2.73 2.91 0.00 0.00 6.90 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.15 4.07 0.00 1.91 1.98 0.00 1.69 0.00 0.00 1.63 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.50 7.81 51 E 7.62 4.20 0.00 2.23 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 2.38 2.43 0.00 52 R 8.03 4.59 0.00 1.88 1.77 0.00 3.15 0.00 0.00 3.12 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 53 S 8.83 4.45 0.00 3.88 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 54 N 8.74 4.33 0.00 2.89 2.98 0.00 0.00 6.84 7.54 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 55 T 8.35 4.61 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 1.25 0.00 0.00 56 A 8.32 5.32 1.23 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 57 V 9.16 4.64 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.89 0.00 0.00 58 V 8.36 5.00 2.38 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 0.72 0.00 0.00 1.10 0.00 0.00 59 C 9.17 4.73 0.00 2.96 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 60 Q 8.51 3.78 0.00 1.78 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.39 0.00 0.00 0.00 0.00 0.00 1.73 2.27 0.00 61 A 8.37 4.44 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 D 8.73 4.26 0.00 2.62 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 63 L 8.31 4.30 0.00 1.69 1.67 0.82 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 64 T 7.85 3.87 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 65 N 8.13 3.92 0.00 2.80 2.82 0.00 0.00 7.03 7.63 0.00 0.00 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 S 8.31 4.61 0.00 4.00 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 0.00 67 N 8.76 4.33 0.00 2.86 3.01 0.00 0.00 5.89 7.68 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 68 V 8.18 4.15 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 0.68 0.00 0.00 0.93 0.00 0.00 69 L 7.66 3.95 0.00 1.83 1.79 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.26 0.00 2.20 2.10 0.00 3.75 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 71 A 7.91 3.96 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 72 S 8.05 4.35 0.00 3.98 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 73 C 8.16 4.12 0.00 3.03 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.13 3.94 0.00 2.20 2.02 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 2.31 2.54 0.00 75 E 8.22 3.96 0.00 2.27 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 2.32 2.60 0.00 76 I 7.38 3.82 1.99 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.71 0.93 0.00 0.00 77 I 7.64 4.01 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.71 1.16 0.00 0.00 78 N 8.53 4.46 0.00 2.96 2.90 0.00 0.00 6.80 8.23 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 79 S 8.51 4.23 0.00 4.02 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 80 C 8.00 4.07 0.00 3.07 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 81 F 8.28 4.16 0.00 3.31 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 82 R 8.37 3.94 0.00 1.85 1.94 0.00 3.14 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 83 A 7.46 3.87 0.16 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 0.00 0.00 84 F 7.84 4.91 0.00 2.98 2.93 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 85 G 9.04 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 R 6.98 3.86 0.00 1.76 1.83 0.00 2.99 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.38 0.00 87 C 7.65 4.33 0.00 2.23 2.37 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 88 D 9.48 4.86 0.00 2.95 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 89 V 7.84 5.44 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 0.99 0.00 0.00 0.99 0.00 0.00 90 L 8.16 4.98 0.00 1.49 0.76 0.88 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.80 4.52 2.02 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 0.87 0.00 0.00 0.82 0.00 0.00 92 N 9.00 4.90 0.00 2.82 2.73 0.00 0.00 6.13 6.60 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 93 N 8.43 4.71 0.00 2.67 2.95 0.00 0.00 7.19 7.96 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 94 A 8.00 4.07 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 95 S 8.49 4.54 0.00 4.00 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 96 A 8.53 4.87 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 97 F 8.24 4.44 0.00 2.90 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 98 Y 6.90 4.16 0.00 2.96 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 3.38 0.00 1.75 0.99 0.00 3.63 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.69 0.00 100 T 8.14 4.53 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 1.18 0.00 0.00 101 P 0.00 4.28 0.00 2.02 2.00 0.00 3.60 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.03 0.00 102 L 8.46 4.17 0.00 1.64 1.72 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 103 V 7.38 4.27 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 0.82 0.00 0.00 0.93 0.00 0.00 *113 G 7.77 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 0.00 114 K 8.09 4.34 0.00 1.74 1.71 0.00 1.43 0.00 0.00 1.65 0.00 0.00 2.66 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.25 1.18 7.81 115 T 8.10 4.14 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 0.00 116 V 8.58 3.99 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 1.03 0.00 0.00 0.94 0.00 0.00 117 E 8.25 3.97 0.00 2.19 2.27 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 0.00 2.37 2.36 0.00 118 T 7.77 3.92 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 1.24 0.00 0.00 119 Q 8.51 4.37 0.00 2.28 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.83 0.00 0.00 0.00 0.00 0.00 2.63 2.47 0.00 120 V 8.35 3.63 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.00 0.00 0.00 121 A 8.05 4.01 1.51 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 0.00 0.00 122 E 8.45 3.97 0.00 2.22 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 0.00 2.42 2.61 0.00 123 L 8.21 4.10 0.00 1.63 1.66 0.62 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.61 4.30 1.96 0.00 0.00 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 1.55 1.06 0.87 0.00 0.00 125 G 8.28 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 0.00 0.00 0.00 126 T 8.16 4.02 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 1.35 0.00 0.00 127 N 8.25 4.51 0.00 2.85 2.78 0.00 0.00 6.61 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 0.00 128 A 7.87 4.53 1.26 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 0.00 0.00 129 I 8.11 3.84 2.01 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.98 0.98 0.00 0.00 130 A 8.27 4.01 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 0.00 131 P 0.00 4.47 0.00 2.19 2.11 0.00 4.03 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.00 0.00 132 F 8.16 4.21 0.00 3.15 3.27 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 0.00 0.00 0.00 0.00 133 L 8.21 3.73 0.00 1.88 1.66 1.01 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.56 4.00 0.00 1.66 1.69 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 135 T 7.82 3.78 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 1.16 0.00 0.00 136 M 7.68 3.79 0.00 1.83 1.95 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 1.76 2.31 0.00 137 S 8.03 4.07 0.00 3.89 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 0.00 138 F 8.29 4.12 0.00 3.05 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 0.00 139 A 8.28 4.00 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 0.00 140 Q 8.25 3.78 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.96 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 141 R 7.57 3.84 0.00 1.87 1.22 0.00 2.97 0.00 0.00 3.00 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.00 142 Q 7.21 4.18 0.00 1.92 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.44 0.00 0.00 0.00 0.00 0.00 2.22 2.14 0.00 *152 S 8.12 4.28 0.00 4.02 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 0.00 153 N 8.31 4.89 0.00 2.64 2.74 0.00 0.00 7.03 7.78 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 0.00 154 L 7.97 5.07 0.00 1.80 1.85 1.01 0.77 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 0.00 155 S 9.01 5.14 0.00 3.96 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 0.00 156 I 8.82 4.73 1.67 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.06 0.74 0.00 0.00 157 V 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3.27 0.00 0.00 3.28 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 199 V 8.78 4.80 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 0.89 0.00 0.00 0.94 0.00 0.00 200 N 9.39 5.47 0.00 2.56 2.71 0.00 0.00 6.21 8.46 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 0.00 201 G 9.34 4.46 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 0.00 202 V 8.71 4.86 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 0.93 0.00 0.00 0.94 0.00 0.00 203 A 8.83 5.11 1.22 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 0.00 0.00 204 P 0.00 4.55 0.00 2.04 1.95 0.00 4.02 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 2.08 1.91 0.00 205 G 8.97 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.56 4.29 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 0.92 0.00 0.00 0.96 0.00 0.00 207 S 7.96 5.00 0.00 3.73 3.57 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 0.00 208 L 8.46 3.95 0.00 1.61 1.62 0.87 0.89 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 0.00 209 L 8.23 3.99 0.00 1.62 1.58 1.03 1.03 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 0.00 210 P 0.00 4.22 0.00 2.26 2.05 0.00 3.52 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 2.11 2.12 0.00 211 V 8.51 3.67 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 0.68 0.00 0.00 0.94 0.00 0.00 212 A 8.29 4.10 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 0.00 213 M 7.63 4.35 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.58 0.00 214 G 8.11 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 0.00 215 E 8.78 4.45 0.00 2.02 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 2.27 2.33 0.00 216 E 8.48 3.95 0.00 2.01 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 2.30 2.39 0.00 217 E 8.15 4.14 0.00 2.14 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 0.00 2.48 2.47 0.00 218 K 8.16 4.09 0.00 1.97 1.92 0.00 1.93 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.58 1.75 7.81 219 D 8.38 4.46 0.00 2.71 2.71 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 0.00 220 K 7.69 3.94 0.00 1.78 1.46 0.00 1.54 0.00 0.00 1.62 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.53 7.81 221 W 8.03 4.34 0.00 3.53 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 0.00 222 R 8.04 4.03 0.00 2.00 2.22 0.00 3.39 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.90 0.00 223 R 8.34 4.11 0.00 1.75 1.96 0.00 3.13 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 224 K 7.53 4.30 0.00 1.99 1.88 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.59 0.00 0.00 2.16 0.00 0.00 0.00 0.00 1.39 1.46 7.81 225 V 7.42 3.73 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.96 0.00 0.00 226 P 0.00 4.18 0.00 2.17 2.10 0.00 3.88 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 227 L 7.92 4.17 0.00 1.74 1.62 0.91 1.45 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 0.00 228 G 8.31 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 0.00 0.00 0.00 229 R 7.98 4.14 0.00 1.88 2.07 0.00 3.42 0.00 0.00 2.25 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.49 0.00 230 R 7.60 4.75 0.00 1.85 1.85 0.00 3.03 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 231 E 8.50 4.37 0.00 2.22 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 2.26 2.33 0.00 232 A 8.16 4.43 1.24 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 0.00 233 S 9.15 4.32 0.00 4.06 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 A 8.68 3.97 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 0.00 235 E 8.10 3.98 0.00 2.06 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 2.40 2.45 0.00 236 Q 7.79 3.99 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.94 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 237 I 7.52 3.82 2.03 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 1.66 1.56 0.90 0.00 0.00 238 A 8.10 4.00 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 0.00 239 D 8.37 4.38 0.00 2.92 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 0.00 240 A 7.94 4.15 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 0.00 241 V 7.63 3.50 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 0.99 0.00 0.00 0.95 0.00 0.00 242 I 7.90 3.64 2.08 0.00 0.00 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 1.67 0.93 0.97 0.00 0.00 243 F 8.26 4.41 0.00 3.12 3.27 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 0.00 0.00 0.00 0.00 244 L 7.66 3.64 0.00 1.77 1.63 0.97 0.96 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 0.00 245 V 7.53 3.87 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 0.64 0.00 0.00 0.91 0.00 0.00 246 S 7.23 4.45 0.00 4.07 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 0.00 247 G 8.49 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 0.00 0.00 0.00 248 S 7.78 4.37 0.00 3.97 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 0.00 249 A 7.70 4.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 Q 8.32 4.03 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.86 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 251 Y 7.96 4.40 0.00 2.87 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 0.00 252 I 7.61 4.28 1.92 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 1.27 0.76 0.99 0.00 0.00 253 T 8.00 4.62 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 1.10 0.00 0.00 254 G 9.30 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 0.00 255 S 8.08 4.73 0.00 3.83 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 256 I 8.26 4.88 1.87 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 1.33 0.60 0.90 0.00 0.00 257 I 8.56 4.22 1.92 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.80 0.93 0.00 0.00 258 K 8.69 4.46 0.00 1.64 1.74 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.44 7.81 259 V 8.79 4.47 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 0.99 0.00 0.00 0.93 0.00 0.00 260 D 7.85 4.80 0.00 2.80 2.79 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 0.00 261 G 9.33 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 262 G 8.47 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 263 L 8.12 3.94 0.00 1.85 1.73 0.98 0.79 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 0.00 264 S 8.36 4.19 0.00 4.02 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 0.00 265 L 7.58 4.19 0.00 1.85 1.77 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 266 V 7.62 3.73 2.15 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 0.70 0.00 0.00 1.07 0.00 0.00 267 H 8.48 4.53 0.00 3.26 3.34 0.00 5.79 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 268 A 8.54 4.17 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 * Residues marked with a * may have inaccurate shift predictions.