NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3220 0.0000 0.0000 62.0652 31.9380 175.8495 3 V 3.4376 8.3332 124.2723 62.4320 31.9014 174.6427 4 R 4.5378 8.5856 126.4622 54.9721 33.4752 176.6813 5 K 3.8870 8.6997 123.8548 59.9503 32.0740 179.1355 6 Q 4.0763 8.1820 117.1628 59.5809 28.2322 178.1914 7 D 4.9620 8.2040 120.4077 57.5476 41.1854 178.5353 8 T 4.2840 7.9725 110.0650 65.3161 68.4158 176.2904 9 Q 4.1016 8.3678 120.6171 59.0541 28.8991 178.4774 10 R 3.8676 9.1213 120.6193 59.4217 29.9946 178.3877 11 A 4.4302 9.2026 121.1212 54.8115 18.4335 179.3867 12 L 3.8131 7.9488 118.9548 58.3988 42.1699 178.3548 13 H 4.0630 8.5350 118.3921 59.1943 29.8748 177.0098 14 L 3.8896 8.2627 120.5671 57.9719 41.4181 179.4048 15 L 4.0372 7.9423 118.6803 58.2691 42.1751 178.6729 16 E 4.0431 8.0088 118.0666 59.3803 29.4943 178.1460 17 E 3.6707 8.0562 119.0753 60.0080 29.3563 178.4039 18 Y 4.4100 7.5116 116.3609 60.1727 38.0573 178.1620 19 R 4.1079 7.6477 119.8932 58.8630 30.4723 178.0074 20 S 4.3316 8.0097 114.2836 60.9941 62.8602 176.3655 21 K 4.5641 7.7901 118.6591 56.3157 31.3504 176.3127 22 L 4.8282 7.9021 117.7795 53.1415 44.7830 174.5873 23 S 4.5767 8.1751 111.3455 58.8391 65.1005 174.4336 24 Q 5.0991 7.4959 118.3886 56.8127 34.0614 174.2683 25 T 4.2082 8.0296 113.7502 62.3598 68.0272 173.8124 26 E 3.9407 9.0274 125.7629 57.1254 28.7280 174.5367 27 D 4.7097 7.6682 113.1484 53.6209 40.9230 176.3810 28 R 4.1741 8.0460 118.7827 58.0376 30.5334 175.8391 29 Q 4.3437 7.7947 113.7742 57.7686 31.4012 177.0822 30 L 3.9987 7.9470 118.4050 57.9028 41.6981 179.0439 31 R 3.9540 7.8293 117.7794 58.8884 30.2997 178.6269 32 S 4.0290 8.0494 110.5726 60.7456 62.3145 175.5323 33 S 4.3163 8.2899 115.9803 61.0617 62.6617 175.9962 34 I 3.5900 7.6446 122.0012 63.6598 36.6581 178.1672 35 E 3.8228 8.3953 121.1109 59.2017 29.5121 178.3768 36 R 3.8525 7.5295 118.3324 59.6500 30.2087 178.9714 37 V 3.5870 7.6199 116.8468 66.1399 31.4336 177.5202 38 I 3.5482 7.4618 119.2855 64.6892 36.9029 177.2654 39 N 4.1643 8.7207 117.5229 57.2863 38.4890 176.4963 40 I 3.5219 8.0052 120.8351 64.6475 37.4196 178.0490 41 F 3.5132 8.3782 117.3401 60.3880 38.8832 177.4238 42 Q 4.2565 8.3829 115.4371 57.1789 29.3484 176.3169 43 S 4.2383 7.6366 116.2245 58.9104 63.3427 174.9337 44 N 4.4386 8.9427 123.1922 56.2521 38.4820 177.2263 45 L 3.8077 8.0305 121.2927 58.2605 42.2592 178.3423 46 F 3.9504 8.3606 119.7599 61.6654 38.9345 176.5796 47 Q 3.8896 8.0057 118.0688 59.3345 28.7343 178.4683 48 A 3.2645 7.3514 121.5910 54.5121 18.1551 179.6505 49 L 3.8106 7.5054 117.4218 58.0024 41.6071 179.6438 50 I 3.5088 7.0986 119.2760 64.4329 36.8760 178.3114 51 D 4.4983 7.7834 119.3418 57.3961 40.7330 178.7734 52 I 3.9059 7.8227 120.2237 64.5511 37.2806 177.9839 53 Q 3.9906 8.3431 120.6328 59.5351 28.5883 178.4583 54 E 3.8953 8.2628 119.0062 59.1983 29.7662 178.3222 55 F 4.1572 8.4860 117.2185 59.3078 39.0427 175.9999 56 Y 4.5890 8.1719 114.4233 57.6834 38.3316 176.7161 57 E 3.7664 7.8546 114.9577 57.7245 26.2825 173.9748 58 V 4.4666 7.9964 121.2095 61.8151 32.8676 175.3655 59 T 4.8106 9.2831 122.4485 61.7439 72.6370 175.1617 60 L 4.4809 8.5020 123.3130 57.4322 42.1815 179.5655 61 L 4.0626 7.9451 119.7612 57.8388 42.4510 177.5326 62 D 4.5452 8.0691 116.7955 56.6538 40.8188 176.2390 63 N 4.9503 9.2719 117.8331 50.0477 38.7371 172.9972 64 P 4.8022 0.0000 0.0000 63.8667 31.9822 178.0840 65 K 4.1639 7.9414 118.2106 58.5706 31.9426 178.6255 66 L 3.9582 7.6621 118.8952 57.3206 41.5782 178.4356 67 E 4.1004 8.0735 119.3859 59.7282 29.1540 179.3286 68 V 3.8023 7.1824 110.2267 63.4842 31.6560 177.5538 69 L 4.2092 8.0307 117.7682 55.6879 41.5869 176.9336 70 F 4.9894 7.3071 116.9686 57.1492 39.1603 175.4037 71 Q 4.4610 7.7697 117.6713 55.4805 32.5673 175.1689 72 G 3.6896 8.5547 106.7823 43.7315 0.0000 170.6089 73 P 3.7087 0.0000 0.0000 66.0241 30.7075 177.0389 74 G 3.8442 8.5271 114.9388 45.7563 0.0000 173.3300 75 S 4.3030 7.9185 112.7711 58.9792 63.8655 174.0059 76 D 4.4714 8.7292 115.2001 54.6238 41.5072 177.7893 77 T 3.4703 7.5093 113.1767 63.3004 67.8914 174.1244 78 G 4.0796 9.7462 110.9995 45.5906 0.0000 175.2332 79 L 3.8924 8.0617 120.7724 58.5732 41.5566 178.1324 80 Y 4.0893 8.1561 118.8715 60.7551 38.3110 177.6368 81 E 3.5786 8.1794 119.1757 60.6003 29.4233 178.9637 82 L 3.5040 7.7882 113.8038 58.0317 41.7720 178.7491 83 L 3.8665 7.8293 117.9107 58.2935 41.8519 179.9503 84 A 3.9399 7.1859 118.7730 54.9081 18.2449 178.8416 85 A 4.1742 8.4207 117.6764 52.6060 18.1416 179.2007 86 L 3.7345 7.1935 120.7023 57.7784 41.7444 177.3478 87 P 3.6617 0.0000 0.0000 65.1350 30.5901 178.5767 88 A 4.1800 7.1049 118.3442 55.4031 18.6927 179.2497 89 Q 4.0460 7.1378 114.7431 58.8791 29.0518 178.5098 90 L 4.1384 8.0939 119.5652 56.4517 41.5173 178.6588 91 Q 3.9639 7.3939 119.1887 58.9044 28.9216 176.7177 92 P 4.3412 0.0000 0.0000 66.0770 31.5836 178.2065 93 H 4.4230 7.8322 112.3866 56.8998 28.8147 175.8269 94 V 3.5410 7.0889 121.4961 62.6091 31.5222 175.5367 95 D 4.9989 8.7014 128.0157 53.8925 41.7093 175.9957 96 S 4.5845 7.8938 113.6211 55.6858 64.7590 174.1827 97 Q 4.2531 8.9417 126.1016 57.8335 28.6753 176.9521 98 E 4.3788 7.8988 121.7470 58.8282 30.3207 177.4643 99 D 4.5479 8.0160 118.4152 57.1353 41.0530 178.0502 100 L 4.1129 8.1853 121.2542 58.6589 42.0643 179.2496 101 T 4.0457 8.0582 109.0005 64.7786 68.6567 175.8736 102 F 4.1981 8.2225 123.0671 61.0421 39.4837 177.0691 103 L 3.9185 8.9157 119.1668 57.7812 41.2677 179.7055 104 W 4.0715 8.1302 117.2675 59.3922 28.9199 178.2774 105 D 4.4968 7.7912 118.5715 57.6728 40.4231 178.2467 106 M 3.9161 7.3793 117.6798 57.1413 32.9107 178.6572 107 F 4.5047 7.1918 122.2256 55.9634 38.1442 175.7558 *111 S 4.4981 7.9732 116.2875 57.9268 65.4421 176.6455 112 L 3.9730 7.8895 122.5174 57.7323 41.8190 178.6730 113 H 4.2979 8.2859 115.4318 59.1934 28.6731 177.7794 114 S 4.2948 8.1608 116.3346 61.4478 62.7335 175.9867 115 L 3.9841 7.9942 123.0425 58.5591 41.8578 179.2570 116 V 3.8373 8.4472 118.2550 66.0849 31.5192 178.2407 117 K 4.1780 8.4307 118.3649 59.4805 31.8640 179.3737 118 I 3.6818 8.1908 120.2629 64.5339 36.9460 177.8936 119 H 4.1665 8.4965 119.1313 59.5176 29.3237 177.2639 120 E 4.1120 8.4473 120.1488 58.8813 28.7367 179.2839 121 K 3.9586 7.9066 119.7766 59.2269 32.2831 178.9368 122 L 4.2564 8.2237 119.5586 58.1486 41.3909 178.7871 123 H 4.0686 8.6296 118.6416 59.4235 29.4134 176.6532 124 Y 4.0170 7.3872 119.4091 60.7191 38.8312 177.3716 125 Y 4.0570 7.4818 116.9746 61.1983 38.1095 177.7896 126 E 3.5148 8.5521 120.5164 59.6203 29.3203 179.0164 127 K 4.0957 7.5455 116.8530 58.2824 32.0972 178.1419 128 Q 4.3722 8.1971 117.9217 54.5629 29.2844 175.6655 129 S 4.2176 7.2956 115.4058 58.0279 62.9501 172.3456 130 P 4.6432 0.0000 0.0000 61.7362 32.2411 175.7851 131 V 3.8762 8.0503 120.1213 61.1380 32.2383 174.1807 132 P 4.1529 0.0000 0.0000 62.3435 31.8899 176.2837 133 I 3.8183 8.5230 122.7594 64.1044 37.1068 175.5895 134 L 4.5801 7.4825 116.1249 55.4849 42.9897 174.5568 135 H 4.7964 8.8005 113.4338 55.7512 29.9636 175.6214 136 G 4.1666 7.5927 107.7849 43.3270 0.0000 173.2554 137 A 3.9883 9.8449 124.9077 55.1673 18.7597 179.3164 138 A 3.8883 8.3651 118.3716 55.2813 18.7255 179.4165 139 A 4.0308 7.9928 118.6250 55.2279 18.4967 178.9403 140 L 3.7738 7.9338 118.1895 58.7540 42.1148 179.0601 141 A 3.9475 8.7615 120.6230 55.5862 18.0917 179.3374 142 D 4.3545 8.4813 117.5871 57.4056 41.1120 178.7256 143 D 4.3701 7.8917 119.0875 57.0773 40.8945 178.4176 144 L 3.9360 8.2619 121.0283 58.1089 42.3407 178.7919 145 A 4.0996 8.0267 120.0529 54.1395 18.0106 179.2760 146 E 3.9382 7.7307 117.5261 59.3149 30.1030 178.0503 147 E 4.0769 7.9462 118.1602 59.6810 29.1181 179.1638 148 L 3.9797 8.0542 118.8565 58.1651 41.5821 179.7343 149 Q 4.1970 7.5956 114.6557 58.1827 28.7083 175.9041 150 N 4.8816 7.9227 118.1129 53.0556 39.0994 174.6993 151 K 4.6760 7.4144 114.5835 53.8833 36.5976 174.6882 152 P 4.1936 0.0000 0.0000 62.6024 31.5280 176.4787 153 L 3.9737 8.4644 122.9884 55.0721 41.5762 176.8844 154 N 4.7856 8.3816 122.1137 52.5186 41.4139 175.4283 155 S 4.3339 8.4081 118.9114 60.5555 63.0280 176.3056 156 E 4.1492 8.3316 121.5809 58.7416 29.5760 178.6841 157 I 3.7402 7.5494 119.4674 64.2185 37.0372 178.5625 158 R 3.9463 7.9275 118.9299 59.1562 29.8562 178.5368 159 E 4.0190 7.9482 118.4137 58.3893 29.5603 178.6066 160 L 3.9859 8.0643 120.8448 58.1457 42.1192 178.7870 161 L 4.0099 7.7182 117.2316 57.5774 41.5518 179.4532 162 K 4.1544 7.8658 118.8337 59.1676 31.9363 179.4105 163 L 4.0031 7.5903 119.4250 57.8192 41.4272 179.4924 164 L 4.0469 7.9474 117.1991 56.8794 41.5299 178.6398 165 S 4.6326 7.1951 113.1626 57.3832 63.7329 174.8954 166 K 4.2559 7.6282 123.3016 55.2389 33.8920 176.1312 167 P 4.2333 0.0000 0.0000 66.0825 31.1561 178.6323 168 N 4.5551 7.9710 117.6806 55.1073 37.3772 177.3859 169 V 3.4671 7.6023 120.1113 65.7204 31.8269 177.7714 170 K 3.8427 8.2490 118.2202 59.6354 31.6584 179.1493 171 A 3.9440 8.0197 120.8491 54.8422 18.3443 179.2288 172 L 3.9253 7.7726 118.9128 58.3452 42.1275 179.3361 173 L 3.9490 7.9531 118.6374 57.7697 41.5970 179.3339 174 S 4.0741 8.1146 113.0129 61.5750 62.3201 176.3876 175 V 3.5995 8.7401 121.9807 66.0188 31.1062 177.0476 176 H 4.1105 8.5995 118.5138 59.7295 29.5546 176.8375 177 D 4.3308 8.2753 120.1493 57.6015 40.7022 178.6465 178 T 3.9977 7.8836 116.2954 67.0322 68.1946 176.7619 179 V 3.7175 8.1517 119.6684 65.6140 31.3029 177.9507 180 A 3.7405 8.0344 120.2318 55.1418 18.3936 179.1273 181 Q 4.0555 8.5929 114.1281 55.5759 29.3451 176.1057 182 K 3.9248 7.6537 118.2478 57.9001 30.1608 176.0869 183 N 4.9467 8.0541 115.6209 51.0326 39.0238 172.5238 184 Y 4.3215 7.9511 122.8546 57.5963 40.0444 174.9720 185 D 3.8113 7.4780 122.8367 53.1347 43.6066 175.5352 186 L 3.4025 8.0091 129.1281 57.7683 42.6302 178.5577 187 E 4.0831 8.4191 118.3644 59.4174 29.6675 178.6621 188 V 4.1590 8.4870 119.5731 64.2106 31.4860 177.7763 189 L 4.0687 7.9210 120.8518 58.6128 41.8027 178.7207 190 F 4.3950 7.2327 114.4288 60.0555 38.9178 177.1539 191 Q 4.3245 7.8690 116.4188 57.7605 28.4354 177.9558 192 G 3.8949 8.2215 108.1035 47.5732 0.0000 173.5701 193 P 4.5937 0.0000 0.0000 64.1727 31.1819 177.6252 194 A 4.2350 7.9882 121.0033 54.5315 18.3014 179.4364 195 L 3.7298 7.8505 117.1448 55.6000 42.3703 179.2297 196 G 3.7568 7.5278 106.0584 45.4529 0.0000 173.0625 197 E 3.3625 8.5501 120.8237 56.0115 30.6198 176.7088 198 P 4.2918 0.0000 0.0000 65.6797 31.4170 178.8484 199 V 3.5960 8.3728 117.5007 65.7341 31.4123 178.0918 200 R 3.8590 7.6251 118.2774 59.1268 29.8188 178.1410 201 L 3.8686 7.7450 119.9216 58.3518 42.1366 178.7049 202 E 3.8840 8.1417 118.9488 59.1549 29.5438 178.8812 203 R 4.0466 8.0211 118.2203 58.9106 30.2721 178.5462 204 D 4.3802 8.6967 119.2085 57.3002 40.8035 178.8773 205 I 3.7249 8.0756 120.7337 64.5424 37.0981 178.2829 206 C 4.1568 7.9183 117.2502 62.8120 27.9581 176.1806 207 R 3.8947 7.9754 119.6441 59.1491 29.5971 178.4648 208 A 4.0028 7.9563 120.8663 55.1666 18.3184 179.6800 209 I 3.6815 7.8118 118.3438 64.3805 37.0455 178.3907 210 E 4.0914 8.2968 119.4174 59.6846 29.4512 179.5204 211 L 3.9642 8.0328 118.6565 57.4774 41.1659 179.6185 212 L 3.9353 7.8259 120.6213 58.1911 42.0120 178.8425 213 E 4.2830 8.3155 120.0575 58.5511 29.5045 179.1367 214 K 3.8779 8.2558 119.8722 59.7259 32.1148 178.9056 215 L 4.0526 7.6213 117.3943 57.6518 41.3305 179.4402 216 Q 4.1305 7.7593 117.0182 59.0385 28.5668 178.5768 217 R 3.9653 8.0840 118.2019 58.2441 30.7366 178.1189 218 S 4.9820 8.2357 114.0711 62.7434 63.6641 177.7224 219 G 3.9066 7.2622 110.1071 47.3550 0.0000 174.4982 220 E 4.5997 8.1601 118.6524 56.5014 33.0676 175.9971 221 V 4.1703 7.6232 117.7466 63.2738 32.8400 175.5197 222 P 5.0451 0.0000 0.0000 62.9797 31.6640 171.8694 223 P 4.1135 0.0000 0.0000 62.1678 33.0692 176.6783 224 Q 4.3732 8.4541 117.0318 56.6644 29.0539 178.4082 225 K 3.9471 7.7964 120.3043 59.3171 32.2006 178.8974 226 L 3.9431 7.8240 118.7203 57.7566 41.5926 178.9705 227 Q 3.8991 8.1123 118.6614 59.2716 28.9525 178.0469 228 A 3.9769 8.6141 122.3248 55.3217 18.3657 179.4294 229 L 3.8851 8.4102 119.1277 58.2379 42.1704 178.9187 230 Q 3.9437 8.5136 120.0913 59.1876 29.0805 178.4503 231 R 4.0385 8.4063 119.9478 58.8718 29.8640 179.3311 232 V 3.7082 7.7278 118.6492 64.8011 31.5933 178.3038 233 L 4.1167 8.0488 118.7908 56.9573 41.5458 178.5795 234 Q 4.2897 7.7530 115.6664 55.3153 29.5377 175.9801 235 S 4.0584 7.3659 114.7935 58.8480 62.7588 174.8486 236 E 4.1648 8.8915 124.9890 58.1467 29.5762 178.6876 237 F 4.1959 7.9857 122.3588 61.3084 39.4387 176.8058 238 C 4.0270 8.2007 117.8487 62.4776 31.5203 175.1323 239 N 4.2963 8.4419 118.1575 56.1034 38.1143 177.2192 240 A 3.9036 7.5516 122.3153 55.0772 18.2056 179.7367 241 V 3.3561 7.3831 116.6971 66.2638 31.5138 178.5032 242 R 4.0369 7.6899 117.4494 58.7618 29.9430 178.9319 243 E 3.9286 7.9170 118.2627 59.5421 29.4414 179.4701 244 V 3.6029 7.7824 118.0417 65.9950 31.3205 177.4319 245 Y 4.1675 7.6845 119.4360 60.2760 38.1250 176.7797 246 E 3.6924 8.1758 120.3539 59.7284 29.6783 178.6749 247 H 4.3382 7.8857 116.6897 58.4530 28.8694 178.0447 248 V 3.5539 7.5261 119.9044 66.0671 31.0812 177.3691 249 Y 3.9217 7.7618 118.4699 59.7422 38.7936 177.3447 250 E 4.0618 7.5529 118.9420 59.2672 29.8149 178.8880 251 T 4.0199 7.6529 108.0298 62.8610 69.0964 174.6317 252 V 4.1699 6.9837 120.3881 60.4756 34.2697 174.1548 253 D 4.1918 8.6489 126.5909 54.4785 40.6685 175.0851 254 I 3.9207 7.7202 127.1836 63.3276 38.4240 176.2784 255 S 4.4225 7.9398 119.7369 58.9473 62.6916 174.3411 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 P 0.00 4.32 0.00 2.16 2.15 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.95 0.00 3 V 8.33 3.44 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.92 0.00 0.00 4 R 8.59 4.54 0.00 2.10 1.82 0.00 3.19 0.00 0.00 3.26 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 5 K 8.70 3.89 0.00 1.91 1.85 0.00 1.63 0.00 0.00 1.77 0.00 0.00 3.16 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.58 7.81 6 Q 8.18 4.08 0.00 2.34 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 7 D 8.20 4.96 0.00 3.00 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 8 T 7.97 4.28 4.57 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 1.33 0.00 0.00 9 Q 8.37 4.10 0.00 2.35 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.83 0.00 0.00 0.00 0.00 0.00 2.74 2.55 0.00 10 R 9.12 3.87 0.00 1.70 2.03 0.00 2.69 0.00 0.00 2.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.42 0.00 11 A 9.20 4.43 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 0.00 0.00 0.00 0.00 0.00 12 L 7.95 3.81 0.00 2.19 1.98 1.05 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 13 H 8.53 4.06 0.00 3.25 3.44 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.26 3.89 0.00 1.93 1.95 1.09 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.94 4.04 0.00 1.78 1.56 0.73 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.01 4.04 0.00 2.29 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 2.28 2.26 0.00 17 E 8.06 3.67 0.00 1.88 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 1.99 2.15 0.00 18 Y 7.51 4.41 0.00 3.00 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 19 R 7.65 4.11 0.00 1.91 2.11 0.00 3.21 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 20 S 8.01 4.33 0.00 4.09 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 21 K 7.79 4.56 0.00 1.83 1.91 0.00 1.80 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.45 7.81 22 L 7.90 4.83 0.00 1.71 1.64 0.87 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.18 4.58 0.00 3.77 3.72 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 24 Q 7.50 5.10 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.63 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 25 T 8.03 4.21 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 26 E 9.03 3.94 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 27 D 7.67 4.71 0.00 2.94 2.81 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 28 R 8.05 4.17 0.00 1.78 1.97 0.00 3.17 0.00 0.00 3.21 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 29 Q 7.79 4.34 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.62 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 30 L 7.95 4.00 0.00 1.70 1.63 0.88 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 31 R 7.83 3.95 0.00 2.03 1.90 0.00 3.25 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 32 S 8.05 4.03 0.00 3.90 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 33 S 8.29 4.32 0.00 3.94 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 34 I 7.64 3.59 1.81 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.87 0.85 0.00 0.00 35 E 8.40 3.82 0.00 2.11 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 2.28 2.36 0.00 36 R 7.53 3.85 0.00 1.81 1.96 0.00 3.33 0.00 0.00 3.07 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.78 0.00 37 V 7.62 3.59 1.81 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 0.65 0.00 0.00 0.72 0.00 0.00 38 I 7.46 3.55 2.28 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 1.62 0.70 0.92 0.00 0.00 39 N 8.72 4.16 0.00 2.83 3.09 0.00 0.00 7.32 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 40 I 8.01 3.52 1.88 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 1.47 0.80 0.26 0.00 0.00 41 F 8.38 3.51 0.00 3.14 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 42 Q 8.38 4.26 0.00 2.27 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.76 0.00 0.00 0.00 0.00 0.00 2.69 2.41 0.00 43 S 7.64 4.24 0.00 3.99 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 8.94 4.44 0.00 2.89 2.92 0.00 0.00 6.61 6.74 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 45 L 8.03 3.81 0.00 1.81 1.85 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 46 F 8.36 3.95 0.00 2.95 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 47 Q 8.01 3.89 0.00 2.39 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.55 2.53 0.00 48 A 7.35 3.26 0.68 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 0.00 0.00 49 L 7.51 3.81 0.00 1.49 1.54 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 50 I 7.10 3.51 1.83 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 -0.01 0.84 0.00 0.00 51 D 7.78 4.50 0.00 3.01 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.82 3.91 1.89 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 1.45 0.84 0.96 0.00 0.00 53 Q 8.34 3.99 0.00 2.08 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.83 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 54 E 8.26 3.90 0.00 1.99 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 1.94 2.18 0.00 55 F 8.49 4.16 0.00 3.13 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 56 Y 8.17 4.59 0.00 3.13 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 57 E 7.85 3.77 0.00 2.07 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 2.25 2.27 0.00 58 V 8.00 4.47 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 0.84 0.00 0.00 0.98 0.00 0.00 59 T 9.28 4.81 4.58 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 1.27 0.00 0.00 60 L 8.50 4.48 0.00 1.75 1.81 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 61 L 7.95 4.06 0.00 1.59 1.69 0.93 1.21 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 62 D 8.07 4.55 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 63 N 9.27 4.95 0.00 2.84 2.90 0.00 0.00 6.77 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.80 0.00 2.27 2.31 0.00 3.91 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 2.07 1.91 0.00 65 K 7.94 4.16 0.00 1.79 1.87 0.00 1.61 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.50 7.81 66 L 7.66 3.96 0.00 1.75 1.60 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.07 4.10 0.00 2.32 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.63 0.00 68 V 7.18 3.80 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 0.82 0.00 0.00 0.91 0.00 0.00 69 L 8.03 4.21 0.00 1.05 1.40 0.78 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 70 F 7.31 4.99 0.00 3.21 2.99 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 71 Q 7.77 4.46 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.49 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 72 G 8.55 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 3.71 0.00 0.74 1.38 0.00 3.49 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 74 G 8.53 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 75 S 7.92 4.30 0.00 4.12 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 76 D 8.73 4.47 0.00 2.79 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 77 T 7.51 3.47 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 1.33 0.00 0.00 78 G 9.75 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.06 3.89 0.00 1.76 1.79 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 80 Y 8.16 4.09 0.00 3.14 3.02 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.12 0.00 0.00 117 K 8.43 4.18 0.00 2.38 2.13 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.63 1.97 7.81 118 I 8.19 3.68 2.13 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.93 0.89 0.00 0.00 119 H 8.50 4.17 0.00 3.51 3.68 0.00 5.78 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 0.00 120 E 8.45 4.11 0.00 2.43 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 2.39 2.41 0.00 121 K 7.91 3.96 0.00 1.98 1.85 0.00 1.70 0.00 0.00 1.37 0.00 0.00 2.42 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.81 7.81 122 L 8.22 4.26 0.00 1.76 1.76 0.93 1.31 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 0.00 123 H 8.63 4.07 0.00 3.15 3.32 0.00 5.78 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 Y 7.39 4.02 0.00 2.92 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 0.00 125 Y 7.48 4.06 0.00 3.23 2.80 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 0.00 126 E 8.55 3.51 0.00 2.03 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 127 K 7.55 4.10 0.00 1.73 1.76 0.00 1.70 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.49 7.81 128 Q 8.20 4.37 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.84 0.00 0.00 0.00 0.00 0.00 2.20 2.06 0.00 129 S 7.30 4.22 0.00 3.92 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 0.00 130 P 0.00 4.64 0.00 2.27 2.20 0.00 3.89 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 2.20 2.10 0.00 131 V 8.05 3.88 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.91 0.00 0.00 132 P 0.00 4.15 0.00 1.99 0.49 0.00 3.51 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.34 0.00 133 I 8.52 3.82 1.91 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 1.53 0.99 0.92 0.00 0.00 134 L 7.48 4.58 0.00 1.70 1.62 1.02 0.64 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 0.00 135 H 8.80 4.80 0.00 3.07 3.35 0.00 5.84 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 0.00 136 G 7.59 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 0.00 0.00 0.00 137 A 9.84 3.99 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 0.00 138 A 8.37 3.89 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 0.00 139 A 7.99 4.03 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 7.93 3.77 0.00 1.87 1.89 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 141 A 8.76 3.95 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 0.00 142 D 8.48 4.35 0.00 2.97 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 0.00 143 D 7.89 4.37 0.00 2.81 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 0.00 144 L 8.26 3.94 0.00 1.74 1.89 0.92 1.22 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 0.00 145 A 8.03 4.10 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 0.00 146 E 7.73 3.94 0.00 1.98 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 2.32 2.38 0.00 147 E 7.95 4.08 0.00 2.29 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 2.33 2.59 0.00 148 L 8.05 3.98 0.00 1.69 1.74 0.92 0.75 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 0.00 149 Q 7.60 4.20 0.00 2.32 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.55 0.00 0.00 0.00 0.00 0.00 2.67 2.46 0.00 150 N 7.92 4.88 0.00 2.91 2.86 0.00 0.00 6.74 7.17 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 0.00 151 K 7.41 4.68 0.00 1.78 1.65 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.60 7.81 152 P 0.00 4.19 0.00 2.03 2.00 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 153 L 8.46 3.97 0.00 1.63 1.65 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 154 N 8.38 4.79 0.00 2.74 2.74 0.00 0.00 7.16 7.22 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 0.00 155 S 8.41 4.33 0.00 3.90 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 E 8.33 4.15 0.00 2.08 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 2.29 2.38 0.00 157 I 7.55 3.74 2.09 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.81 0.91 0.00 0.00 158 R 7.93 3.95 0.00 1.89 1.96 0.00 3.11 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 159 E 7.95 4.02 0.00 2.18 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 2.30 2.30 0.00 160 L 8.06 3.99 0.00 1.89 1.64 0.91 0.46 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 0.00 161 L 7.72 4.01 0.00 1.72 1.72 0.92 0.85 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 0.00 162 K 7.87 4.15 0.00 1.87 1.84 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.54 7.81 163 L 7.59 4.00 0.00 1.94 1.70 0.96 0.60 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 0.00 164 L 7.95 4.05 0.00 1.61 1.73 0.91 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 165 S 7.20 4.63 0.00 3.79 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 0.00 166 K 7.63 4.26 0.00 1.94 1.92 0.00 1.66 0.00 0.00 1.73 0.00 0.00 3.23 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.58 7.81 167 P 0.00 4.23 0.00 2.25 2.31 0.00 3.69 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 2.06 2.03 0.00 168 N 7.97 4.56 0.00 3.01 3.16 0.00 0.00 6.38 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 0.00 169 V 7.60 3.47 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 1.03 0.00 0.00 0.95 0.00 0.00 170 K 8.25 3.84 0.00 2.04 1.85 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.68 7.81 171 A 8.02 3.94 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 0.00 172 L 7.77 3.93 0.00 1.68 1.77 0.81 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 173 L 7.95 3.95 0.00 1.88 1.70 0.90 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 174 S 8.11 4.07 0.00 3.93 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 0.00 175 V 8.74 3.60 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 0.99 0.00 0.00 0.92 0.00 0.00 176 H 8.60 4.11 0.00 3.39 3.54 0.00 5.84 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 0.00 177 D 8.28 4.33 0.00 2.78 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 0.00 178 T 7.88 4.00 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 179 V 8.15 3.72 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.05 0.00 0.00 180 A 8.03 3.74 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 Q 8.59 4.06 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.77 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 182 K 7.65 3.92 0.00 1.93 1.93 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.52 7.81 183 N 8.05 4.95 0.00 2.65 2.70 0.00 0.00 6.96 6.97 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 0.00 184 Y 7.95 4.32 0.00 3.08 2.89 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 0.00 0.00 0.00 185 D 7.48 3.81 0.00 2.54 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 0.00 0.00 0.00 0.00 186 L 8.01 3.40 0.00 1.70 1.64 0.76 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 187 E 8.42 4.08 0.00 2.07 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 2.41 2.41 0.00 188 V 8.49 4.16 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 1.24 0.00 0.00 0.98 0.00 0.00 189 L 7.92 4.07 0.00 1.79 1.46 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 190 F 7.23 4.40 0.00 3.25 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 Q 7.87 4.32 0.00 2.39 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 192 G 8.22 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 193 P 0.00 4.59 0.00 2.42 2.49 0.00 3.87 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 2.42 2.33 0.00 194 A 7.99 4.23 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 0.00 195 L 7.85 3.73 0.00 1.18 1.16 0.70 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 196 G 7.53 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 0.00 0.00 0.00 197 E 8.55 3.36 0.00 1.98 1.80 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 2.41 2.37 0.00 198 P 0.00 4.29 0.00 2.08 2.02 0.00 3.27 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.48 0.00 199 V 8.37 3.60 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.91 0.00 0.00 200 R 7.63 3.86 0.00 1.87 2.01 0.00 3.19 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 201 L 7.74 3.87 0.00 1.78 1.80 0.88 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 202 E 8.14 3.88 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 203 R 8.02 4.05 0.00 2.12 1.94 0.00 3.17 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 204 D 8.70 4.38 0.00 2.80 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 0.00 205 I 8.08 3.72 2.00 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 1.48 0.73 0.89 0.00 0.00 206 C 7.92 4.16 0.00 2.94 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 R 7.98 3.89 0.00 1.94 2.08 0.00 3.14 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 208 A 7.96 4.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 I 7.81 3.68 2.03 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 1.51 0.79 0.91 0.00 0.00 210 E 8.30 4.09 0.00 2.23 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 2.48 0.00 211 L 8.03 3.96 0.00 1.69 1.72 1.00 0.31 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 0.00 212 L 7.83 3.94 0.00 2.10 1.74 0.91 1.02 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 0.00 213 E 8.32 4.28 0.00 2.16 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 2.57 2.44 0.00 214 K 8.26 3.88 0.00 1.96 1.95 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.48 7.81 215 L 7.62 4.05 0.00 1.68 1.72 0.92 0.99 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 0.00 216 Q 7.76 4.13 0.00 2.35 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 217 R 8.08 3.97 0.00 1.92 2.00 0.00 3.14 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 218 S 8.24 4.98 0.00 4.05 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 0.00 219 G 7.26 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 0.00 0.00 0.00 220 E 8.16 4.60 0.00 1.91 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 2.21 2.61 0.00 221 V 7.62 4.17 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 0.84 0.00 0.00 0.93 0.00 0.00 222 P 0.00 5.05 0.00 2.14 2.03 0.00 3.85 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.96 0.00 223 P 0.00 4.11 0.00 2.06 2.03 0.00 3.66 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.11 0.00 224 Q 8.45 4.37 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 225 K 7.80 3.95 0.00 1.79 1.85 0.00 1.81 0.00 0.00 1.81 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.53 7.81 226 L 7.82 3.94 0.00 1.72 1.71 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 227 Q 8.11 3.90 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.87 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 228 A 8.61 3.98 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 0.00 229 L 8.41 3.89 0.00 1.78 1.79 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 230 Q 8.51 3.94 0.00 2.21 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 231 R 8.41 4.04 0.00 2.04 1.97 0.00 3.30 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 232 V 7.73 3.71 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 0.77 0.00 0.00 0.82 0.00 0.00 233 L 8.05 4.12 0.00 1.62 1.76 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 234 Q 7.75 4.29 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.65 0.00 0.00 0.00 0.00 0.00 2.35 2.59 0.00 235 S 7.37 4.06 0.00 4.08 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 0.00 236 E 8.89 4.16 0.00 2.25 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 2.42 2.42 0.00 237 F 7.99 4.20 0.00 3.19 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 0.00 238 C 8.20 4.03 0.00 3.22 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 0.00 239 N 8.44 4.30 0.00 3.00 2.82 0.00 0.00 6.86 8.00 0.00 0.00 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 7.55 3.90 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 0.00 241 V 7.38 3.36 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 0.91 0.00 0.00 0.36 0.00 0.00 242 R 7.69 4.04 0.00 2.00 1.97 0.00 3.15 0.00 0.00 3.12 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.77 0.00 243 E 7.92 3.93 0.00 2.14 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 2.31 2.50 0.00 244 V 7.78 3.60 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.88 0.00 0.00 245 Y 7.68 4.17 0.00 3.10 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 E 8.18 3.69 0.00 2.01 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 0.00 2.07 2.25 0.00 247 H 7.89 4.34 0.00 3.22 3.29 0.00 5.88 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 V 7.53 3.55 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 0.93 0.00 0.00 0.96 0.00 0.00 249 Y 7.76 3.92 0.00 2.26 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 0.00 250 E 7.55 4.06 0.00 2.17 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 2.39 0.00 251 T 7.65 4.02 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 1.27 0.00 0.00 252 V 6.98 4.17 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 0.67 0.00 0.00 0.86 0.00 0.00 253 D 8.65 4.19 0.00 2.60 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 0.00 254 I 7.72 3.92 1.98 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 1.10 0.70 0.88 0.00 0.00 255 S 7.94 4.42 0.00 4.02 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 * Residues marked with a * may have inaccurate shift predictions.