NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.2029 8.2493 123.5800 52.1664 20.5258 177.7871 *2 S 4.4631 8.0584 116.6633 59.9840 64.8358 175.5520 3 K 4.1262 8.1354 115.4310 57.1189 31.4552 176.0265 4 I 4.6252 7.4581 120.7217 59.7036 39.0401 174.8484 5 T 4.6268 8.7628 115.8209 59.7729 71.8311 174.3371 6 F 4.1683 8.7259 118.1917 60.3523 39.0458 177.8499 7 K 4.1525 7.9504 119.6177 59.0896 31.8600 177.6344 8 D 4.6236 7.8496 116.5567 54.7788 41.1660 176.2843 9 I 4.3804 7.2884 113.8422 59.2772 38.8942 175.2187 10 Y 4.1935 9.3507 125.6856 57.7961 39.1117 175.2294 11 I 4.0178 7.5129 126.1119 59.2442 40.4460 174.0513 12 D 4.4330 8.1581 126.1489 52.8990 39.6391 176.5416 13 G 3.8998 7.4473 108.9770 45.3745 0.0000 172.8297 14 N 4.6321 8.7208 117.3149 52.4470 39.8647 175.0213 15 K 3.5301 8.6098 125.3747 56.2008 31.8136 176.1485 16 I 3.9971 8.3494 130.2245 63.9915 38.0928 176.1789 17 T 4.3563 6.8781 113.6592 61.4862 70.8826 172.1903 18 E 4.8986 8.1291 121.3889 55.5530 31.9544 174.3961 19 D 4.7104 8.3739 124.9418 52.0046 42.5081 175.8071 20 S 4.2923 8.5786 112.5262 61.3466 63.4690 175.6807 21 R 4.3162 8.1687 121.4627 58.1813 31.0223 176.5736 22 K 4.8292 8.0637 115.0240 56.1949 36.4123 174.0116 23 A 4.9881 8.8178 122.5469 50.0608 22.4474 175.0968 24 I 4.1736 8.2113 122.3590 59.5756 39.6981 174.3381 25 Y 5.5712 8.7899 124.8273 55.5278 40.8609 174.7187 26 L 5.0206 8.3091 123.5028 53.6514 46.2701 174.6230 27 L 5.1774 10.1653 128.2558 52.2967 41.9771 174.7365 28 P 4.2312 0.0000 0.0000 64.2082 31.7688 175.9804 29 P 4.4823 0.0000 0.0000 64.1425 32.2799 176.4705 30 Q 4.4190 8.0247 118.6008 53.6016 28.8789 173.7480 31 P 4.3900 0.0000 0.0000 63.9628 32.1807 177.9418 32 L 4.1052 7.4279 117.7620 54.5683 42.3083 177.1561 33 K 4.0318 7.4746 121.2153 55.5440 30.6548 176.4464 34 Y 4.2131 8.0361 123.3262 60.8688 38.0511 179.3474 35 A 4.0890 8.1333 120.3592 54.6014 18.6315 178.0363 36 S 4.6074 7.7882 109.2750 58.6501 63.2025 174.5332 37 N 5.2574 7.7212 118.2822 51.1045 39.2071 173.0806 38 T 4.6693 8.9719 117.2173 61.1248 72.3274 171.1380 39 W 5.0504 8.4765 123.2846 54.8482 31.9579 175.5836 40 I 4.7422 8.5330 125.1839 59.5565 39.0938 174.5271 41 Y 4.7262 8.7200 126.5169 58.1618 37.8655 176.5060 42 K 4.3526 9.3931 125.0511 58.1614 32.5035 177.0287 43 T 4.5026 7.8269 112.4937 60.4490 68.7292 172.1984 *45 P 4.3010 0.0000 0.0000 62.1881 33.3371 177.7529 46 T 4.3194 7.6537 112.5072 61.4355 68.6249 175.4965 *48 N 4.5933 9.0161 116.7484 53.4845 40.4939 175.6214 49 Q 4.0769 8.0021 118.4852 58.9539 28.8787 178.2057 50 W 4.2482 8.5642 129.8470 60.3743 30.4957 178.0676 51 L 3.5552 7.5913 117.8056 57.3711 41.3024 179.2890 52 K 4.0908 7.8954 118.1873 59.5077 32.1343 178.9723 53 D 4.2297 7.8413 118.9514 57.1329 40.6418 178.4821 54 I 3.6039 7.3050 120.5038 64.7462 37.0230 178.1622 55 E 3.8887 7.7188 118.4766 59.3444 29.0400 179.6358 56 V 3.6549 7.5627 116.9021 65.9909 31.8000 177.4175 57 Q 4.1119 7.5409 117.9748 58.6565 29.0448 177.3774 58 K 4.0464 8.0687 120.8691 59.5112 32.2860 179.2135 59 K 4.2601 7.5803 113.9248 57.7761 31.5450 178.3573 *61 H 4.6971 8.0309 118.0241 55.9942 30.7053 175.7460 62 L 4.2013 8.0952 119.2694 57.8853 41.0936 179.1767 63 N 4.4717 8.1020 116.1828 55.4917 38.8955 175.8957 64 Q 4.4550 7.6220 116.1333 55.3958 29.1663 175.4694 65 S 3.6761 7.6218 114.7040 59.7566 60.6336 170.0810 66 S 4.2563 7.5046 115.9631 57.9819 63.6925 173.7756 67 Y 5.1683 8.3346 120.0873 57.9053 39.6159 174.3869 68 H 5.6314 8.2820 114.4836 53.8012 31.9994 173.0272 69 L 5.1473 9.1385 118.0398 53.4025 45.9687 176.0419 70 S 5.3680 9.1836 116.7850 57.3951 66.2614 172.8543 71 F 5.3144 9.6742 124.6822 56.0642 43.6615 173.7074 72 S 5.3934 9.3331 117.5685 56.9496 66.4190 173.2299 73 F 5.1781 8.9508 121.3256 54.8918 41.4030 174.0602 74 P 4.5697 0.0000 0.0000 62.4918 32.5271 175.9097 75 A 3.7740 8.4919 125.1718 53.8705 18.6902 177.1715 76 N 3.1400 8.4028 118.9489 53.2872 36.9009 173.7671 77 E 4.7598 7.5213 117.2124 54.5017 31.6039 175.6182 78 K 4.7070 8.4588 122.0528 54.7038 33.8692 176.6199 79 I 3.5925 7.4400 124.2252 60.8678 37.8924 176.2678 80 D 4.5220 8.1006 124.5337 52.6076 41.7619 177.3023 81 E 3.8467 8.5805 120.4286 59.5772 29.4510 179.5301 82 V 3.6779 7.8386 119.6360 64.6654 31.1966 178.0008 83 L 3.7469 7.6165 121.4435 57.4818 41.8218 178.6851 84 L 3.7014 8.0506 119.2549 57.8257 41.4097 179.5840 85 E 3.9125 8.1940 118.3974 59.1926 29.5009 178.9057 86 K 3.9719 7.9237 119.6464 59.7491 32.0059 178.8787 87 I 3.9140 7.5401 119.8579 64.5309 37.0284 178.6298 88 R 4.0232 7.7986 118.7067 59.2965 29.6746 178.7344 89 E 4.1418 8.5574 118.5135 58.7827 29.6587 177.8729 90 L 4.5784 7.9272 116.5868 54.1035 41.9757 177.1559 91 G 3.9117 8.3888 107.4303 45.9107 0.0000 174.0486 92 F 4.4756 7.9812 117.5726 57.3058 39.7204 175.4216 93 Q 4.5106 9.5237 121.6541 55.6193 30.3679 174.8540 94 I 5.0282 8.4234 122.4246 59.6700 39.9042 175.0374 95 G 4.2826 9.3498 113.0612 44.5655 0.0000 171.0459 96 V 4.7677 8.2497 118.8248 60.6844 34.6482 173.6068 97 L 5.1776 9.3991 130.0284 53.4913 44.4478 174.5879 98 E 5.3988 9.7340 125.7830 54.6347 32.6341 174.4779 99 L 4.7035 8.1880 125.8617 53.6933 43.9219 174.6808 100 Y 5.2166 8.9255 123.9030 56.2259 41.5181 174.8698 101 V 5.0701 8.8429 121.7595 61.4006 35.4236 173.9905 102 I 4.4773 8.4977 126.0636 58.9794 42.2202 173.6345 103 E 4.3295 8.5520 126.7713 55.4072 30.6538 176.8659 104 A 3.8962 8.2237 131.8398 56.0154 18.4725 179.9880 105 K 4.0799 8.0550 116.1205 59.5937 32.6734 178.1106 106 A 4.2180 7.6799 120.3537 54.8823 18.4467 178.6539 107 L 3.9704 7.6804 115.4939 57.8915 41.3837 178.6278 108 K 3.5872 7.9607 115.5645 59.9116 32.5776 179.6057 109 E 3.6438 7.8533 122.2215 58.8141 30.6473 178.4566 110 L 4.7632 8.4754 114.3667 54.4945 46.9034 176.5542 111 S 3.8811 8.7362 116.5675 59.3089 61.6147 175.4991 112 R 4.1753 8.5936 122.0796 56.9668 28.3287 176.0213 113 K 4.4797 7.7325 120.9202 55.5354 34.4424 174.6284 114 R 4.5531 7.9785 123.9344 54.9369 28.6070 176.1179 115 D 4.5232 9.2252 111.7202 54.6730 37.8149 172.9342 116 V 4.5869 7.7140 117.9426 61.4867 34.4275 173.4586 117 D 5.0246 9.3793 128.3345 52.6710 43.2775 174.7692 118 I 5.0420 8.4511 125.8376 59.6718 39.9536 174.9333 119 Q 4.6906 8.7666 124.4022 53.6645 32.8043 174.9753 120 L 4.5588 8.6515 122.6573 54.9373 42.6374 176.9525 121 V 4.1524 8.4616 123.5202 62.8927 32.3022 175.4041 122 S 4.8974 10.0497 122.5248 56.3689 66.1983 174.5925 123 S 4.5417 8.6202 113.0785 59.8750 62.6592 174.6753 124 N 4.6631 7.7785 118.1935 54.4039 38.9984 175.1437 125 N 5.0397 8.2579 113.4972 51.0602 39.1496 175.7137 126 I 3.3876 7.9053 119.8231 64.9071 37.6960 177.0534 127 N 4.4952 8.1657 116.3297 56.1573 38.4793 177.0471 128 D 4.3411 8.1087 120.2023 57.3629 40.9779 177.8019 129 Y 3.9495 7.9334 119.6906 60.7839 38.8108 178.2932 130 L 4.1071 8.2929 119.8779 58.0164 41.5012 178.7631 131 H 4.0616 8.4986 117.7345 59.4986 30.1257 177.1663 132 V 3.4965 7.6710 119.6928 65.8179 31.1691 177.3890 133 Y 3.5139 7.6769 119.5471 60.4574 38.4407 177.3475 134 D 4.4030 8.1349 117.7043 56.8047 41.2914 177.3146 135 A 4.2479 7.3240 118.6790 51.6840 19.3707 177.4136 136 F 4.3081 6.9857 116.2450 57.1930 39.5766 175.2017 137 A 4.2120 8.4138 125.3002 52.7828 19.4822 177.9628 138 R 4.6795 7.9463 116.0075 53.7925 30.5123 174.9594 139 P 4.0055 0.0000 0.0000 64.9640 31.6670 178.0158 140 F 4.7337 7.4007 114.6666 56.8402 39.5203 174.8469 141 G 3.9829 7.9946 107.9356 44.6347 0.0000 175.0020 142 D 4.4023 8.7854 117.5839 57.5205 40.5474 179.1083 143 S 4.3097 8.0865 112.0171 61.2655 62.5200 175.1440 144 Y 4.0361 8.1191 121.0435 60.5674 39.0090 176.9246 145 A 4.5059 8.3983 121.8112 55.3778 18.5494 180.7614 146 N 4.6469 8.6834 115.4446 53.1866 38.6105 177.7025 *148 V 3.9741 7.8046 121.1836 63.0041 33.7317 177.1081 149 K 3.6944 8.2650 119.2269 59.8346 31.9994 179.0917 150 Q 4.0802 8.1479 119.3832 59.2973 28.3993 177.6347 151 H 4.2810 8.1714 119.0816 58.9319 29.9816 177.2670 152 I 3.7434 7.7156 121.8688 64.4834 36.7782 177.4993 153 Y 4.1288 8.4898 119.6785 60.4924 38.7013 177.5977 154 S 4.5663 7.8902 111.4598 58.4801 63.9288 174.4046 155 S 4.5083 7.6247 114.8315 57.5805 64.3660 175.2912 156 Y 4.2686 8.1019 119.7459 59.3835 37.6408 178.5156 157 N 3.7639 6.7069 117.5489 55.6098 39.1813 175.5116 158 L 4.1818 7.3823 116.4559 56.2005 42.4805 176.6122 159 D 4.6347 7.9607 118.0643 53.1402 40.6540 176.1311 160 D 4.8865 8.4888 117.6516 54.3891 41.4676 175.8896 161 I 4.4039 7.4774 120.8058 59.9770 38.4218 175.6526 162 E 4.3927 8.9219 126.7385 56.2539 30.9850 176.0293 163 R 5.2279 8.4604 120.3381 54.5479 34.7337 174.1613 164 L 5.4406 8.9580 121.6786 52.9029 46.1161 175.8298 165 V 4.9145 8.5698 119.9078 60.0198 34.5600 174.4152 166 A 5.0080 9.0591 127.6486 51.3516 20.4136 175.4929 167 Y 5.7528 9.9256 119.7895 55.2082 41.6248 175.2068 168 V 4.5286 7.8264 121.7038 60.4355 34.4757 175.3665 169 N 4.1362 9.1364 122.7376 54.9481 35.1739 174.1730 170 H 4.1199 8.3689 110.5707 56.5752 26.8974 174.4360 171 Q 4.7533 7.4762 118.9847 53.0499 30.6994 173.4919 172 P 3.9570 0.0000 0.0000 62.8463 31.9038 176.5556 173 V 4.0470 7.7317 117.8393 62.4610 35.7355 173.7360 174 G 4.1445 7.2056 104.1409 46.3789 0.0000 172.5411 175 I 5.8496 8.3832 116.1522 58.3308 41.9931 174.1358 176 V 5.1400 8.2127 118.8290 62.0173 34.2569 171.9392 177 D 5.5531 9.6005 123.0796 53.2625 43.6383 175.5210 178 I 5.0643 9.0191 121.6932 59.8533 41.1251 174.8800 179 I 4.5037 8.5011 126.8003 59.7034 40.8154 174.7267 *181 T 4.3766 8.1364 119.4361 63.1624 69.5326 173.8507 182 D 4.5424 8.8022 121.2270 57.6000 40.9350 177.6431 183 K 4.3459 7.9686 115.6270 57.8835 33.0980 176.7306 184 T 5.0220 7.5154 106.1921 59.9683 72.1773 173.3086 185 I 4.7313 8.4795 116.2671 59.1658 40.5644 173.7912 186 E 5.2308 9.6111 126.9443 54.5353 32.2577 174.5981 187 I 4.7212 8.6969 127.9981 60.8649 38.4782 174.7154 188 D 4.5588 9.0732 124.0122 53.6779 45.5594 175.0925 189 G 4.1588 8.9912 109.8715 46.4203 0.0000 172.9711 190 F 4.9012 8.6124 121.9839 58.3350 40.0522 174.4887 191 G 3.8687 8.3425 110.4402 45.3331 0.0000 172.5121 192 V 4.7477 7.6891 115.2553 58.6410 35.4614 175.6015 193 L 3.9632 8.0495 123.8132 55.2083 42.6647 178.5012 194 E 3.9144 8.9252 120.7920 59.7768 29.5771 179.3799 195 E 3.9239 8.2141 115.8354 58.1509 29.3209 177.4004 196 F 4.7034 7.9366 116.5562 57.2010 39.5791 177.0663 197 Q 3.8387 7.8918 120.4753 58.0403 28.6143 176.2568 198 H 4.9621 7.6128 115.0126 55.8111 29.6384 174.2928 199 Q 4.4747 8.3285 118.4113 55.1226 31.1251 176.7826 200 G 4.2979 8.5880 104.8345 46.0980 0.0000 175.2817 201 I 3.7820 8.2532 121.3725 64.5801 36.8243 178.0061 202 G 4.3893 8.2221 105.6883 48.6103 0.0000 175.4620 203 S 4.3177 8.0092 116.7187 60.9072 63.0662 176.1906 204 E 4.0432 8.7348 122.7444 59.0333 29.2524 178.8975 205 I 3.7498 7.8721 119.9467 64.4359 37.1745 177.9406 206 Q 3.9580 7.7339 118.4121 59.3193 28.5755 179.2182 207 A 4.0335 7.9295 120.8626 55.5323 18.1375 179.1009 208 Y 3.9044 7.8590 116.8481 60.8032 38.9844 177.9074 209 V 3.9681 8.1859 118.5047 65.9186 31.6802 177.7010 210 G 3.9262 8.2476 104.7361 47.9886 0.0000 176.6528 211 R 3.7606 7.9830 121.1647 56.1742 31.3738 178.3965 *213 A 4.2649 8.0909 122.9181 50.5130 22.1962 180.6851 214 N 4.2031 8.0864 113.1037 54.6652 37.1583 175.0835 215 E 4.4691 9.1787 127.4818 56.4787 30.9487 174.8655 216 R 4.1852 7.9102 118.8059 56.3408 31.2246 174.7133 217 P 4.6581 0.0000 0.0000 62.8652 33.1362 175.1527 218 V 5.6648 8.6939 120.9257 59.2256 33.9155 174.6172 219 I 5.3779 8.2005 117.0910 59.3600 41.4620 173.7996 220 L 4.7258 8.6099 121.4522 55.1413 43.9628 174.0793 221 V 4.9647 8.3666 113.0087 59.9970 33.5318 175.3188 222 A 4.9672 9.4016 125.5503 49.7444 22.8415 174.9681 223 D 4.7122 8.9930 120.1335 54.3210 42.0427 177.2296 224 G 3.8374 9.0085 115.6922 49.0186 0.0000 174.4470 225 K 4.3460 7.9228 116.2732 56.0531 31.9139 176.7658 226 D 4.5346 7.9358 119.2939 54.7258 41.8333 176.3770 227 T 4.0800 8.5360 119.1656 66.4594 69.1995 177.8524 228 A 3.4698 7.6085 123.0490 55.0160 18.9456 178.3266 229 K 3.7941 7.8457 115.8913 60.1367 32.1951 177.4381 230 D 4.0847 8.2650 116.9050 56.1594 41.9867 178.4495 *232 Y 4.9641 7.9203 118.8771 58.2034 39.8601 177.4467 233 L 4.1546 7.9222 119.4634 57.9486 41.9282 179.8194 234 R 4.0228 7.6252 115.5266 59.1828 30.1476 178.2590 235 Q 4.0905 8.1307 115.9588 57.7636 28.9306 176.8072 236 G 4.2684 7.8004 106.4516 45.3844 0.0000 173.2615 237 Y 4.2059 8.2665 117.5936 57.8563 38.6934 175.8740 238 V 4.4225 9.6429 118.2952 60.1893 33.6960 174.8023 239 Y 4.1957 8.9433 127.0668 57.8932 38.6517 174.5537 240 Q 4.0594 8.9705 128.0159 55.2200 31.2460 175.8086 241 G 3.5922 5.5030 104.3844 45.2181 0.0000 170.0903 242 F 5.8087 7.8924 113.6923 55.2998 42.2188 173.8760 243 K 4.9274 9.2588 117.8877 54.8943 36.2159 175.7242 244 Y 4.9364 9.0199 122.0904 58.1820 39.5510 174.1224 245 H 5.9114 9.5424 117.9973 54.3698 32.9837 172.0085 246 I 5.4255 9.3281 111.9827 59.6833 41.5337 173.7568 247 L 5.4821 9.3356 125.0228 53.5432 46.1044 174.6272 248 K 4.5439 9.2774 127.2493 54.6411 33.9532 176.6680 249 E 3.8739 8.9502 127.8150 58.2548 29.8231 176.7242 250 N 5.1108 7.7439 115.3204 51.0014 40.8370 174.2911 251 I 3.8339 8.4959 123.7101 61.7019 37.0939 176.0940 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 0 A 8.25 4.20 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 *2 S 8.06 4.46 0.00 4.03 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 3 K 8.14 4.13 0.00 1.75 1.88 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.46 7.81 4 I 7.46 4.63 1.81 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.65 0.88 0.00 0.00 5 T 8.76 4.63 4.27 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 1.20 0.00 0.00 6 F 8.73 4.17 0.00 3.18 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 7 K 7.95 4.15 0.00 1.81 1.92 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.48 7.81 8 D 7.85 4.62 0.00 2.78 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 9 I 7.29 4.38 1.92 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.51 0.85 0.00 0.00 10 Y 9.35 4.19 0.00 2.86 3.05 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 11 I 7.51 4.02 1.49 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.66 0.46 0.00 0.00 12 D 8.16 4.43 0.00 2.85 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 13 G 7.45 3.90 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 0.00 0.00 0.00 14 N 8.72 4.63 0.00 2.82 2.72 0.00 0.00 7.09 6.76 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 15 K 8.61 3.53 0.00 1.56 1.57 0.00 1.92 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.08 0.70 7.81 16 I 8.35 4.00 1.69 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 1.22 0.87 0.82 0.00 0.00 17 T 6.88 4.36 4.09 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 0.00 0.00 0.94 0.00 0.00 18 E 8.13 4.90 0.00 1.71 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 19 D 8.37 4.71 0.00 2.82 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.58 4.29 0.00 4.01 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.17 4.32 0.00 2.22 2.21 0.00 3.31 0.00 0.00 3.41 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.48 0.00 22 K 8.06 4.83 0.00 1.66 1.94 0.00 1.21 0.00 0.00 1.65 0.00 0.00 2.13 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.91 0.47 7.81 23 A 8.82 4.99 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 I 8.21 4.17 1.47 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.20 0.74 0.00 0.00 25 Y 8.79 5.57 0.00 2.86 2.94 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 26 L 8.31 5.02 0.00 1.70 1.43 1.01 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 27 L 10.17 5.18 0.00 1.77 1.44 0.88 0.90 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 28 P 0.00 4.23 0.00 2.06 2.08 0.00 3.71 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.22 0.00 29 P 0.00 4.48 0.00 2.15 2.15 0.00 3.57 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 30 Q 8.02 4.42 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.90 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 31 P 0.00 4.39 0.00 2.12 2.05 0.00 3.64 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.88 0.00 32 L 7.43 4.11 0.00 1.32 1.53 0.87 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.47 4.03 0.00 1.76 1.65 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.37 7.81 34 Y 8.04 4.21 0.00 3.02 2.86 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 35 A 8.13 4.09 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 36 S 7.79 4.61 0.00 3.87 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 N 7.72 5.26 0.00 2.62 2.67 0.00 0.00 6.64 8.59 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 38 T 8.97 4.67 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 1.34 0.00 0.00 39 W 8.48 5.05 0.00 2.82 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 40 I 8.53 4.74 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.09 0.94 0.00 0.00 41 Y 8.72 4.73 0.00 2.93 3.06 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 42 K 9.39 4.35 0.00 1.75 1.96 0.00 1.55 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.49 1.46 7.81 43 T 7.83 4.50 4.27 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 1.30 0.00 0.00 *45 P 0.00 4.30 0.00 2.21 1.96 0.00 3.46 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.88 0.00 46 T 7.65 4.32 4.25 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 1.21 0.00 0.00 *48 N 9.02 4.59 0.00 2.87 2.91 0.00 0.00 6.53 6.69 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 49 Q 8.00 4.08 0.00 2.28 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.47 2.76 0.00 50 W 8.56 4.25 0.00 3.34 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 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2.00 1.82 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.66 7.81 *61 H 8.03 4.70 0.00 3.40 3.46 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 L 8.10 4.20 0.00 1.89 1.78 1.16 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 63 N 8.10 4.47 0.00 2.84 2.88 0.00 0.00 7.11 6.67 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 64 Q 7.62 4.46 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.33 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 65 S 7.62 3.68 0.00 3.97 3.96 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 66 S 7.50 4.26 0.00 3.72 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 8.33 5.17 0.00 3.02 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 68 H 8.28 5.63 0.00 3.16 3.42 0.00 5.47 0.00 0.00 0.00 0.00 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0.00 0.00 0.87 0.00 0.00 102 I 8.50 4.48 0.81 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 1.18 0.30 0.00 0.00 103 E 8.55 4.33 0.00 2.03 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 104 A 8.22 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.06 4.08 0.00 1.78 1.78 0.00 1.70 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.61 1.48 7.81 106 A 7.68 4.22 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 0.00 107 L 7.68 3.97 0.00 1.77 1.71 0.88 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 108 K 7.96 3.59 0.00 1.79 1.77 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.59 1.58 7.81 109 E 7.85 3.64 0.00 2.29 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 2.31 2.33 0.00 110 L 8.48 4.76 0.00 1.58 1.62 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 111 S 8.74 3.88 0.00 3.92 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 0.00 112 R 8.59 4.18 0.00 1.89 2.18 0.00 3.25 0.00 0.00 3.82 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 113 K 7.73 4.48 0.00 1.76 1.72 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.38 7.81 114 R 7.98 4.55 0.00 1.83 1.07 0.00 3.45 0.00 0.00 3.25 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 115 D 9.23 4.52 0.00 2.91 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 0.00 116 V 7.71 4.59 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 0.82 0.00 0.00 1.02 0.00 0.00 117 D 9.38 5.02 0.00 2.80 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 8.45 5.04 1.78 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 1.29 0.81 0.12 0.00 0.00 119 Q 8.77 4.69 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.96 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 120 L 8.65 4.56 0.00 1.57 1.65 1.03 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 121 V 8.46 4.15 1.95 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 0.43 0.00 0.00 0.87 0.00 0.00 122 S 10.05 4.90 0.00 3.97 3.96 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 0.00 123 S 8.62 4.54 0.00 4.07 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 0.00 124 N 7.78 4.66 0.00 2.72 2.92 0.00 0.00 6.71 7.87 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 0.00 125 N 8.26 5.04 0.00 3.07 3.06 0.00 0.00 6.42 6.83 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 0.00 126 I 7.91 3.39 1.06 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.05 0.88 0.00 0.00 127 N 8.17 4.50 0.00 2.89 2.89 0.00 0.00 7.14 8.08 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 0.00 128 D 8.11 4.34 0.00 2.91 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 Y 7.93 3.95 0.00 3.11 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 0.00 130 L 8.29 4.11 0.00 2.15 1.77 1.10 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 131 H 8.50 4.06 0.00 3.17 3.45 0.00 5.76 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 V 7.67 3.50 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.71 0.00 0.00 133 Y 7.68 3.51 0.00 3.09 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 0.00 134 D 8.13 4.40 0.00 2.92 2.63 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 0.00 135 A 7.32 4.25 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 0.00 136 F 6.99 4.31 0.00 2.85 2.65 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 0.00 137 A 8.41 4.21 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 0.00 138 R 7.95 4.68 0.00 1.83 1.85 0.00 3.18 0.00 0.00 3.61 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.62 0.00 139 P 0.00 4.01 0.00 1.08 1.80 0.00 3.34 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.60 0.00 140 F 7.40 4.73 0.00 2.30 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 0.00 141 G 7.99 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 D 8.79 4.40 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 0.00 143 S 8.09 4.31 0.00 3.92 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 0.00 144 Y 8.12 4.04 0.00 3.26 3.32 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 0.00 145 A 8.40 4.51 1.58 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 0.00 146 N 8.68 4.65 0.00 2.85 2.86 0.00 0.00 6.66 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 *148 V 7.80 3.97 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 1.16 0.00 0.00 1.00 0.00 0.00 149 K 8.27 3.69 0.00 1.96 1.84 0.00 1.78 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.69 7.81 150 Q 8.15 4.08 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 151 H 8.17 4.28 0.00 3.28 3.43 0.00 5.92 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 I 7.72 3.74 1.99 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.83 0.86 0.00 0.00 153 Y 8.49 4.13 0.00 2.99 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 0.00 154 S 7.89 4.57 0.00 4.11 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 S 7.62 4.51 0.00 3.91 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 0.00 156 Y 8.10 4.27 0.00 3.07 3.25 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 0.00 157 N 6.71 3.76 0.00 1.44 2.19 0.00 0.00 6.95 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 0.00 158 L 7.38 4.18 0.00 1.51 1.61 0.82 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 159 D 7.96 4.63 0.00 2.90 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 0.00 160 D 8.49 4.89 0.00 2.59 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 0.00 161 I 7.48 4.40 1.85 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.39 0.93 0.00 0.00 162 E 8.92 4.39 0.00 2.00 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 2.36 2.37 0.00 163 R 8.46 5.23 0.00 1.51 1.59 0.00 2.71 0.00 0.00 2.40 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.56 0.00 164 L 8.96 5.44 0.00 1.56 1.36 0.73 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 165 V 8.57 4.91 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 0.87 0.00 0.00 0.47 0.00 0.00 166 A 9.06 5.01 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 0.00 167 Y 9.93 5.75 0.00 2.70 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 0.00 168 V 7.83 4.53 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 0.88 0.00 0.00 1.01 0.00 0.00 169 N 9.14 4.14 0.00 2.95 3.07 0.00 0.00 7.17 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 H 8.37 4.12 0.00 3.30 3.37 0.00 5.85 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 Q 7.48 4.75 0.00 2.08 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.00 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 172 P 0.00 3.96 0.00 1.87 1.56 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.03 0.00 173 V 7.73 4.05 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 0.67 0.00 0.00 -0.38 0.00 0.00 174 G 7.21 4.14 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 0.00 0.00 0.00 175 I 8.38 5.85 1.73 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.99 0.51 0.00 0.00 176 V 8.21 5.14 2.42 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 0.92 0.00 0.00 1.14 0.00 0.00 177 D 9.60 5.55 0.00 2.86 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 0.00 178 I 9.02 5.06 1.91 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 1.29 0.87 0.94 0.00 0.00 179 I 8.50 4.50 1.78 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.28 0.57 0.00 0.00 *181 T 8.14 4.38 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 1.23 0.00 0.00 182 D 8.80 4.54 0.00 2.61 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 0.00 183 K 7.97 4.35 0.00 1.78 1.83 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.36 7.81 184 T 7.52 5.02 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 1.20 0.00 0.00 185 I 8.48 4.73 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.72 0.91 0.00 0.00 186 E 9.61 5.23 0.00 1.98 1.82 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 195 E 8.21 3.92 0.00 1.51 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 2.11 2.19 0.00 196 F 7.94 4.70 0.00 2.95 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 Q 7.89 3.84 0.00 2.20 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.48 7.42 0.00 0.00 0.00 0.00 0.00 2.28 2.46 0.00 198 H 7.61 4.96 0.00 3.03 3.25 0.00 5.60 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 Q 8.33 4.47 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.01 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 200 G 8.59 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 0.00 201 I 8.25 3.78 1.92 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.84 0.93 0.00 0.00 202 G 8.22 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 S 8.01 4.32 0.00 4.01 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 E 8.73 4.04 0.00 2.20 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 2.37 2.48 0.00 205 I 7.87 3.75 2.14 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.85 0.96 0.00 0.00 206 Q 7.73 3.96 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.67 2.63 0.00 207 A 7.93 4.03 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 Y 7.86 3.90 0.00 3.02 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 0.00 209 V 8.19 3.97 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 0.91 0.00 0.00 1.02 0.00 0.00 210 G 8.25 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 0.00 211 R 7.98 3.76 0.00 1.94 1.79 0.00 3.11 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 *213 A 8.09 4.26 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 0.00 214 N 8.09 4.20 0.00 2.82 2.32 0.00 0.00 6.78 7.59 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 0.00 215 E 9.18 4.47 0.00 1.88 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 2.18 2.28 0.00 216 R 7.91 4.19 0.00 1.94 1.90 0.00 3.24 0.00 0.00 3.35 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.58 0.00 217 P 0.00 4.66 0.00 2.09 2.15 0.00 3.77 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 218 V 8.69 5.66 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 0.62 0.00 0.00 1.00 0.00 0.00 219 I 8.20 5.38 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.13 0.90 0.00 0.00 220 L 8.61 4.73 0.00 1.71 1.80 0.23 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 221 V 8.37 4.96 2.22 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 0.77 0.00 0.00 1.02 0.00 0.00 222 A 9.40 4.97 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 0.00 223 D 8.99 4.71 0.00 2.88 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 G 9.01 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 K 7.92 4.35 0.00 2.02 1.84 0.00 1.61 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.42 7.81 226 D 7.94 4.53 0.00 2.87 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 0.00 227 T 8.54 4.08 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 1.17 0.00 0.00 228 A 7.61 3.47 1.01 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 0.00 229 K 7.85 3.79 0.00 1.82 1.79 0.00 1.79 0.00 0.00 1.93 0.00 0.00 3.20 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.48 1.66 7.81 230 D 8.27 4.08 0.00 2.80 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 *232 Y 7.92 4.96 0.00 2.77 2.41 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 0.00 233 L 7.92 4.15 0.00 2.00 1.77 1.15 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 234 R 7.63 4.02 0.00 1.87 2.02 0.00 3.18 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 235 Q 8.13 4.09 0.00 2.51 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.61 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 236 G 7.80 4.27 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 0.00 0.00 0.00 237 Y 8.27 4.21 0.00 3.06 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 0.00 238 V 9.64 4.42 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 0.75 0.00 0.00 0.99 0.00 0.00 239 Y 8.94 4.20 0.00 3.14 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 Q 8.97 4.06 0.00 1.83 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.81 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 241 G 5.50 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 0.00 242 F 7.89 5.81 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 0.00 243 K 9.26 4.93 0.00 1.34 1.59 0.00 1.09 0.00 0.00 1.48 0.00 0.00 2.34 0.00 0.00 2.18 0.00 0.00 0.00 0.00 1.02 0.21 7.81 244 Y 9.02 4.94 0.00 3.03 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 0.00 245 H 9.54 5.91 0.00 3.42 3.47 0.00 5.21 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 I 9.33 5.43 2.17 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.23 0.95 0.00 0.00 247 L 9.34 5.48 0.00 1.85 1.57 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 248 K 9.28 4.54 0.00 0.79 1.11 0.00 1.20 0.00 0.00 1.32 0.00 0.00 2.95 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.22 1.09 7.81 249 E 8.95 3.87 0.00 1.96 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 1.91 2.02 0.00 250 N 7.74 5.11 0.00 2.64 2.71 0.00 0.00 6.92 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 251 I 8.50 3.83 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.66 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.