NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 L 4.8944 8.2681 122.5657 53.8022 43.9074 174.9902 5 S 5.0223 7.8004 113.9640 56.0702 64.7518 168.3334 6 V 3.9268 8.5885 126.5073 61.3618 32.5683 175.2823 7 P 4.3839 0.0000 0.0000 62.8035 31.7402 177.1138 8 A 3.9858 8.7158 124.3886 55.2877 18.5096 178.7597 9 E 4.1101 8.0272 112.2858 57.6597 30.1802 176.6131 10 V 3.9683 7.4774 121.2916 62.9661 31.9358 175.3189 11 T 4.6660 8.6883 115.4900 61.1033 70.2853 174.0027 12 V 4.7637 7.6348 122.1224 61.3644 35.5084 173.5624 13 I 4.8139 8.8527 128.1309 59.4611 39.7712 174.0416 14 L 5.3302 9.2418 129.8263 53.4194 44.3119 174.7650 15 L 5.2983 9.3786 126.6233 53.0589 44.3696 176.0111 16 D 5.2766 8.9569 123.6244 54.0421 42.0480 174.3428 17 I 4.3763 8.4822 118.9748 61.6887 39.6109 175.2142 18 E 4.1708 7.9009 118.7944 57.8043 30.1358 178.4425 19 G 4.2860 9.3262 114.0391 46.8266 0.0000 172.9490 20 T 4.5799 7.5659 113.0469 64.7054 70.9962 175.9948 21 T 4.3381 8.5457 110.5883 62.2925 70.3519 174.6873 22 T 4.0890 7.4144 118.4731 60.3114 72.4971 171.4491 23 P 4.8030 0.0000 0.0000 62.5222 32.2892 177.2890 24 I 3.7291 8.7075 121.4556 64.7631 36.9574 178.4165 25 A 4.0386 8.0777 120.9852 55.0511 18.1087 179.3363 26 F 3.9739 8.0672 118.6266 61.3159 39.5530 177.5529 27 V 3.3092 7.6893 117.2551 66.0221 31.2979 177.8119 28 K 4.0645 8.3229 118.2905 58.6550 32.1749 176.9674 29 D 4.8363 8.1252 116.3407 54.2256 42.4016 175.9832 30 I 4.3031 7.2099 117.1859 62.4901 39.6755 177.2336 31 L 3.5947 7.4938 120.7488 58.2909 42.1080 178.9350 32 F 4.3987 8.1330 117.4083 60.0647 38.9928 176.1918 33 P 4.5586 0.0000 0.0000 65.5169 31.2016 177.7843 34 Y 4.0312 8.0724 118.5427 60.7171 38.5899 178.3957 35 I 3.5656 8.0258 120.5935 64.4796 37.0286 178.2310 36 E 3.9701 8.0949 117.4315 59.5516 29.4175 178.9589 37 E 4.0662 8.0402 117.4495 58.2393 29.7372 177.9028 38 N 4.7789 7.4611 114.1818 52.6627 39.8003 176.8685 39 V 3.6087 7.6586 121.8766 64.5873 31.2942 178.2859 40 K 3.9105 7.9456 119.7637 59.2164 32.1155 178.1895 41 E 4.3105 8.0826 120.4225 58.8344 29.5324 177.8444 42 Y 3.9968 8.2742 119.6277 60.8921 38.8043 178.2134 43 L 4.2564 8.4283 119.9771 57.9961 41.6005 179.5911 44 Q 3.9625 8.4571 118.3407 59.2577 28.4019 179.0036 45 T 3.8697 8.0590 116.1807 65.9689 68.7454 175.2713 46 H 4.7955 7.8296 115.6419 55.0444 29.3739 175.7118 47 W 4.2957 8.1131 131.8447 60.8204 30.3665 177.4119 48 E 4.1418 8.2410 115.1764 58.3701 29.4590 177.7761 49 E 4.0387 8.0532 119.8750 56.1749 30.9914 177.5054 50 E 4.1477 8.7454 124.4547 59.0003 29.5492 179.3068 51 E 4.1531 8.0274 119.9645 58.8392 29.6272 178.2994 52 C 4.1070 7.9157 118.2331 62.5177 31.2270 175.2908 53 Q 3.5609 7.9840 119.6984 58.9576 27.8149 178.9785 54 Q 3.9678 8.1955 119.0781 58.9866 28.7711 178.4761 55 D 4.3725 8.3033 120.1610 57.4747 40.9095 179.1292 56 V 3.6171 7.9953 118.9905 66.0304 31.4425 178.2142 57 S 4.1724 8.1588 115.0019 61.5687 62.6380 176.7136 58 L 4.0104 7.9235 121.6523 57.8301 41.3171 179.6057 59 L 4.0596 8.0693 118.9935 57.5870 41.5678 179.5103 60 R 3.9378 8.5371 119.1826 59.3629 30.1173 178.7575 61 K 3.9929 8.2505 118.3721 59.5203 32.0534 179.1315 62 Q 4.0005 8.3457 119.6534 59.1690 28.7626 178.1244 63 A 4.1473 8.2997 121.2935 55.2177 18.5240 179.1910 64 E 4.1015 8.1541 117.1433 59.6240 29.3296 179.3868 65 E 4.0992 8.1090 117.5528 58.8070 29.7711 178.0725 66 D 4.7630 8.2091 116.9124 54.1736 41.0919 177.9004 67 A 3.9308 7.5748 123.6344 55.3192 18.4331 178.5839 68 H 4.4908 8.1623 109.1252 56.9647 29.4648 175.7048 69 L 4.1784 7.7963 122.1472 54.0028 42.1688 175.8164 70 D 4.4941 8.5382 122.8197 55.7096 41.4888 176.5045 71 G 3.8214 8.8495 114.7341 44.8159 0.0000 173.2948 72 A 2.0000 7.0826 122.7530 51.4058 18.7634 177.1216 73 V 3.9148 6.5094 121.7185 60.1860 32.6547 174.0057 74 P 4.5452 0.0000 0.0000 62.5592 32.1989 176.3372 75 I 4.3998 7.7566 120.4061 58.0850 37.1552 173.7650 76 P 4.3443 0.0000 0.0000 62.1423 32.1066 176.2454 77 A 4.2171 8.2431 122.3325 51.5720 19.0902 177.7616 78 A 4.2432 8.3537 123.6619 52.2656 19.1290 178.1625 79 S 4.3992 8.5619 114.8126 60.5506 64.1478 174.1971 80 G 4.1156 7.2337 106.7793 45.3807 0.0000 172.4663 81 N 4.9936 8.7680 117.3417 52.1655 37.9366 175.1222 82 G 3.9881 8.4326 105.9534 44.5374 0.0000 175.0538 83 V 3.5892 8.1458 113.1139 63.9909 31.4863 178.7503 84 D 4.2640 7.9324 118.8376 56.5881 39.2670 178.2073 85 D 4.3162 7.9175 118.9546 56.7756 40.9283 178.0348 86 L 3.7770 7.7833 120.1348 57.8699 42.3496 178.2905 87 Q 4.0180 8.0631 119.6776 59.2763 28.8955 179.5647 88 Q 3.9797 7.6090 115.9332 56.4691 28.5133 178.3279 *90 I 3.9562 7.7319 122.9478 61.4233 39.3261 177.9273 91 Q 3.9635 8.0446 120.4599 59.0160 28.6767 178.2237 92 A 4.0173 8.0034 121.9955 55.0638 18.3520 179.8134 93 V 3.6021 7.7768 116.3669 65.9929 31.6361 178.2190 94 V 3.6112 8.2292 118.4056 66.3173 31.3811 177.7558 95 D 4.3871 8.5776 118.9742 57.3703 40.5132 178.4431 96 N 4.5047 8.5113 117.8006 56.6119 38.7780 177.1833 97 V 3.6348 8.0333 119.0911 66.3050 31.7243 177.5158 98 C 4.3271 8.2180 115.5411 62.3898 28.2301 175.6172 99 W 4.4377 8.5383 130.0926 60.5340 30.1052 179.1839 100 Q 3.1097 8.0347 114.9156 56.3397 28.3962 177.8121 *102 S 4.4194 8.0508 116.6279 58.0330 65.0974 173.7281 103 L 4.4014 7.0625 119.9994 53.2264 45.0993 175.5793 104 D 4.1527 8.7706 116.9331 57.6383 39.9522 180.5352 *106 K 4.1198 8.9258 109.6096 56.2971 32.8897 175.6591 107 T 4.1775 7.4727 113.1390 61.4945 71.2643 175.5690 108 T 3.8922 8.4226 118.1676 66.6016 68.3418 176.8641 109 A 3.9644 7.9281 122.3868 54.9725 18.4398 179.2979 110 L 3.8811 7.8273 118.5423 58.3564 42.1554 179.3600 111 K 4.2171 8.1392 119.7873 58.7422 31.9255 179.1252 112 Q 3.8182 8.2640 120.1113 59.1074 28.8141 178.1261 113 L 3.8365 7.2587 119.8969 58.1263 41.8688 178.4257 114 Q 3.5026 7.9810 118.1933 58.7951 28.5700 179.2931 115 G 3.9024 8.0683 106.7527 47.9929 0.0000 175.0586 116 H 4.6607 7.6822 117.1460 55.9634 29.0995 177.5382 *118 W 4.8800 8.0529 122.9450 56.8421 31.2815 177.7767 119 R 4.0705 8.3390 117.9602 59.5456 29.4090 178.4961 120 A 4.0386 7.9686 119.9753 54.9695 18.3843 179.3798 121 A 3.7947 7.9465 118.7971 55.4334 18.4269 179.8003 122 F 4.0578 8.3438 116.5601 60.9344 38.8296 178.3564 123 T 3.9372 8.1478 114.3933 66.0334 68.3067 175.6667 124 A 4.4674 7.9167 120.2214 51.4835 18.8869 177.6624 125 G 3.8721 7.7378 105.3649 46.5670 0.0000 175.2126 126 R 4.0348 7.9315 116.9396 57.2099 30.2734 176.7530 *128 K 4.5539 7.6743 116.5990 56.0962 33.6925 175.0844 129 A 3.6064 8.8951 125.4311 51.0810 19.8008 176.2935 130 E 4.0860 6.3821 124.4378 55.5042 30.2977 175.8712 131 F 4.4795 8.1014 125.4015 55.0200 42.3217 175.3334 132 F 4.1721 8.3582 122.8054 57.1807 39.2614 176.6948 133 A 4.0526 8.7246 127.1848 55.0354 18.0317 178.5116 134 D 4.4791 8.0015 114.3090 55.1705 40.4259 178.7003 135 V 3.2136 7.6639 120.4711 65.9448 31.5023 177.8456 136 V 3.4533 7.5324 117.5243 65.4257 31.5495 176.1092 137 P 4.1474 0.0000 0.0000 65.7202 31.0264 178.2650 138 A 3.6226 7.4551 119.8649 54.6452 18.2268 179.6846 139 V 2.9284 7.1628 116.6303 66.0501 31.5742 178.4142 140 R 3.8862 7.8329 117.6569 59.2784 29.8968 179.2717 141 K 4.0605 7.7446 117.9877 59.0948 31.7846 179.5361 142 W 4.4089 8.0201 118.9445 59.9096 29.2745 178.4985 143 R 4.1626 8.3842 118.1411 59.3156 29.2889 178.8817 144 E 4.1449 8.2034 117.2627 59.0811 29.5105 178.3452 145 A 4.5376 7.7326 118.0939 51.2991 19.7627 176.6658 146 G 3.5410 8.1654 108.1050 45.7929 0.0000 173.1648 *148 K 4.3043 7.7417 123.1395 56.4614 34.7105 174.6008 149 V 4.9881 9.4045 121.8954 61.6616 34.5563 173.9921 150 Y 5.1733 9.3527 124.8867 56.2969 42.1360 174.4722 151 I 5.1850 8.6213 121.9700 59.9463 40.4378 174.3592 152 Y 5.6400 9.5183 126.9561 56.3518 41.6521 173.9160 153 S 4.9695 9.2293 121.0210 56.7136 66.1690 174.9380 154 S 4.3236 8.8990 118.5563 59.8638 63.4016 174.9781 155 G 3.8744 8.0622 111.5679 44.9885 0.0000 174.3982 156 S 4.5379 8.7234 117.9874 58.2678 64.8856 175.7710 157 V 3.6009 8.8052 123.2438 66.2260 30.8970 178.1148 158 E 3.8966 8.2519 118.3456 59.3488 29.5160 178.5992 159 A 4.1290 8.2255 120.7890 55.1776 18.4627 179.5217 160 Q 4.0651 8.4708 117.0659 59.2371 28.7242 179.3575 161 K 4.0045 8.2716 119.5770 59.3535 31.8964 179.4269 162 L 3.9783 7.5602 118.9193 57.6313 41.2733 179.4874 163 L 3.4497 7.3683 117.8827 57.8080 41.7893 179.3922 164 F 4.0907 8.5695 117.7553 59.9814 38.6815 177.6311 165 G 3.6855 8.2520 103.8314 46.1203 0.0000 173.2288 166 H 4.8800 7.8153 118.7708 54.6151 29.7983 172.7348 167 S 4.9310 7.7830 115.3280 57.1282 64.6242 175.6710 168 T 3.8824 8.3640 110.7678 63.7468 68.3593 174.8971 169 E 4.3489 8.4597 121.3889 55.8620 30.3726 177.2010 170 G 3.5833 7.9826 107.9949 44.3573 0.0000 172.3838 171 D 4.7665 8.3625 121.3954 53.8822 40.8213 176.7298 172 I 4.4468 8.3858 121.6174 60.4458 38.2014 177.9660 173 L 4.0392 8.3730 124.7310 58.5173 41.4954 179.3597 174 E 4.0388 8.0335 114.9461 58.4546 29.5418 177.5218 175 L 4.1830 7.6825 118.4328 55.4733 42.0697 176.6234 176 V 4.2973 7.4352 119.1087 60.9893 33.1942 174.9826 177 D 4.2951 8.6480 127.0666 55.9828 41.5974 176.3706 178 G 3.9335 6.4083 103.4529 46.0611 0.0000 171.9543 179 H 5.5245 8.5549 116.1801 53.8575 32.7107 173.3337 180 F 5.0250 9.4161 119.3546 56.1111 43.5352 174.1671 181 D 5.8500 8.7786 120.3032 51.2347 42.1273 175.7988 182 T 4.5370 8.4912 106.8617 63.5649 68.8792 176.1384 183 K 3.9726 8.3544 121.9613 59.2449 32.0989 177.6317 184 I 3.9111 7.9145 116.8738 60.9572 38.2692 174.3733 185 G 4.5468 7.2144 104.5956 44.8119 0.0000 172.8966 186 H 4.6351 8.8207 118.0208 54.8015 29.4173 177.4573 187 K 4.0905 8.6780 121.9441 59.0751 32.0167 178.2217 188 V 4.3813 7.8488 110.2900 60.8539 32.0178 174.8077 189 E 4.7539 8.1816 121.5856 54.2148 31.3392 177.2827 190 S 4.6157 8.8323 118.3676 60.7621 63.5169 176.1234 191 E 3.9414 8.3134 121.0331 59.1990 29.2374 178.7804 192 S 4.0365 7.9163 115.1447 61.7842 62.8220 176.2863 193 Y 3.6656 7.6067 118.9656 60.6588 37.6449 178.4792 194 R 3.9054 7.7748 118.8436 59.0836 30.2049 179.0032 195 K 3.9388 8.0249 118.3599 59.1068 31.8912 179.5478 196 I 2.7467 7.2883 120.0417 63.8921 36.8235 178.1834 197 A 3.7950 7.6436 121.5437 55.2851 17.9350 179.4641 198 D 4.2554 7.4926 115.8598 57.4620 40.9364 178.6514 199 S 4.2562 8.1415 113.2046 61.4634 62.5081 175.9977 200 I 3.7694 7.6873 122.0953 62.2252 37.0349 176.9228 201 G 3.9452 9.2006 107.5850 45.9361 0.0000 172.0719 202 C 4.7525 7.4622 113.5887 56.6825 33.0342 172.8900 203 S 4.7402 8.1815 114.3757 57.2343 64.5477 175.4715 204 T 3.8378 8.3167 112.7367 64.8247 68.5441 175.6981 205 N 4.5718 8.0016 116.5605 53.9194 37.7291 174.9323 206 N 5.0295 8.0961 116.0224 53.0439 39.4421 174.0346 207 I 4.8821 7.6889 120.6955 59.3112 40.0723 174.2873 208 L 5.0981 8.8350 128.8015 53.3614 44.4624 174.5675 209 F 5.5785 9.3886 130.1759 56.9179 41.3501 174.1408 210 L 4.8963 8.8894 126.9827 53.3675 43.5324 175.5843 211 T 4.8220 8.2803 117.0409 60.7083 70.9256 173.7464 212 D 4.7503 8.6772 122.7974 53.1930 40.8977 176.1030 213 V 4.2401 7.4346 120.5880 61.6341 32.8576 176.3136 214 T 3.6316 8.4088 117.4840 64.9295 68.1953 176.5750 215 R 4.2100 7.9608 120.2829 58.8345 30.0799 178.6131 216 E 4.3729 8.1769 118.0516 59.1430 29.6684 178.7133 217 A 4.0393 7.8541 121.0653 55.2343 18.4481 179.9053 218 S 4.1920 8.8017 112.9378 61.4431 62.7691 176.6045 219 A 4.1904 7.8940 123.7828 54.9379 18.1743 179.4960 220 A 3.1736 7.8457 119.2751 55.0115 18.2942 179.6981 221 E 4.2143 8.3586 118.7262 59.1212 29.3423 179.4389 222 E 4.0327 8.2595 117.1601 58.4700 29.4875 178.1131 223 A 4.4478 7.6049 119.1183 50.9206 19.3672 176.0427 224 D 4.2749 8.0461 116.5015 56.0006 39.7410 173.5251 225 V 4.5790 7.3731 115.9936 61.0954 34.4375 174.2692 226 H 4.6298 8.7842 123.9753 55.7271 29.9214 174.6044 227 V 5.0904 8.3436 120.2502 61.3001 35.2598 174.2554 228 A 4.8166 8.6132 125.9608 50.2548 23.0435 174.9643 229 V 4.5105 8.6924 121.7120 61.3157 33.2361 174.7440 230 V 4.6002 8.6041 128.7159 61.7733 32.9076 174.4701 231 V 4.6358 8.5884 127.9689 61.3170 33.4926 174.8426 232 R 4.4322 8.2792 125.6707 52.9209 34.0361 172.8136 233 P 4.4107 0.0000 0.0000 64.5877 31.3394 176.8295 234 G 4.0038 8.9931 111.4730 45.0139 0.0000 173.1364 235 N 4.5688 7.6760 116.5161 52.3096 39.2607 174.9139 236 A 4.1150 8.3474 123.2979 52.0788 19.0723 178.1902 237 G 3.8100 8.4231 110.1070 45.4557 0.0000 173.0483 238 L 4.7309 8.0589 120.5182 53.1931 43.5472 177.6107 239 T 4.2584 8.8184 113.2132 61.2414 71.0866 175.6583 240 D 4.3851 8.5834 121.4232 57.9260 40.8001 178.9697 241 D 4.4351 8.0977 118.6680 57.3119 40.7567 178.6114 242 E 4.1410 8.2606 119.2955 59.4508 29.3080 179.4808 243 K 4.0629 8.1332 117.4855 59.6409 32.0976 179.2571 244 T 4.1203 7.6013 115.2273 66.4547 68.5623 176.2375 245 Y 3.9129 8.0536 120.5836 59.9566 39.2851 175.6795 246 Y 4.3919 7.3762 116.0123 57.3382 39.1263 175.2003 247 S 4.4694 8.5974 118.9095 58.3505 64.0927 173.0746 248 L 5.3750 8.5851 124.9194 52.9927 43.9544 175.9634 249 I 4.9633 8.4854 115.6006 59.5307 40.8202 175.8383 250 T 4.5844 9.1709 113.4691 60.7535 69.6495 174.2545 251 S 4.7726 7.5909 114.5502 57.3756 65.9135 175.4007 252 F 4.6650 10.1381 126.0940 60.3069 38.8851 177.9045 253 S 4.3520 7.9267 114.5050 61.0148 62.9085 175.1861 254 E 4.2131 8.4265 119.8117 57.3775 29.4650 175.5781 255 L 4.7792 7.9271 122.4923 54.3444 43.1661 174.9608 256 Y 4.7107 10.0216 128.1647 55.8218 41.1391 175.3837 257 L 4.0426 7.7266 125.1111 54.6747 41.6279 176.4612 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 4 L 8.27 4.89 0.00 1.80 1.61 0.99 0.53 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 5 S 7.80 5.02 0.00 4.15 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 6 V 8.59 3.93 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.78 0.00 0.00 7 P 0.00 4.38 0.00 2.03 2.06 0.00 3.60 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 1.80 1.52 0.00 8 A 8.72 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 9 E 8.03 4.11 0.00 2.16 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 2.34 2.45 0.00 10 V 7.48 3.97 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 0.81 0.00 0.00 0.84 0.00 0.00 11 T 8.69 4.67 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 1.20 0.00 0.00 12 V 7.63 4.76 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 1.22 0.00 0.00 0.97 0.00 0.00 13 I 8.85 4.81 1.94 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.25 0.68 0.00 0.00 14 L 9.24 5.33 0.00 1.85 1.81 1.14 0.13 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 15 L 9.38 5.30 0.00 1.91 1.91 1.42 1.04 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 16 D 8.96 5.28 0.00 2.86 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 17 I 8.48 4.38 1.96 0.00 0.00 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 1.49 1.87 0.85 0.00 0.00 18 E 7.90 4.17 0.00 2.05 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 0.00 2.42 2.36 0.00 19 G 9.33 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.57 4.58 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 1.57 0.00 0.00 21 T 8.55 4.34 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 22 T 7.41 4.09 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 0.99 0.00 0.00 23 P 0.00 4.80 0.00 2.19 2.03 0.00 3.22 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.77 0.00 24 I 8.71 3.73 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.69 0.93 0.00 0.00 25 A 8.08 4.04 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 26 F 8.07 3.97 0.00 3.27 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 27 V 7.69 3.31 2.40 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 1.23 0.00 0.00 1.07 0.00 0.00 28 K 8.32 4.06 0.00 1.76 1.89 0.00 1.81 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.46 7.81 29 D 8.13 4.84 0.00 2.87 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 30 I 7.21 4.30 1.58 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.22 0.86 0.00 0.00 31 L 7.49 3.59 0.00 0.62 1.40 -0.02 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 32 F 8.13 4.40 0.00 3.32 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 33 P 0.00 4.56 0.00 2.20 2.14 0.00 3.77 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 34 Y 8.07 4.03 0.00 3.26 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 8.03 3.57 2.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.33 0.74 0.00 0.00 36 E 8.09 3.97 0.00 2.05 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 2.34 2.44 0.00 37 E 8.04 4.07 0.00 1.85 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 2.30 2.54 0.00 38 N 7.46 4.78 0.00 2.19 2.57 0.00 0.00 6.60 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 39 V 7.66 3.61 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 0.72 0.00 0.00 0.96 0.00 0.00 40 K 7.95 3.91 0.00 1.84 1.83 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.47 7.81 41 E 8.08 4.31 0.00 2.06 1.94 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 2.38 2.22 0.00 42 Y 8.27 4.00 0.00 3.25 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.43 4.26 0.00 2.01 2.06 1.12 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Q 8.46 3.96 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.59 0.00 45 T 8.06 3.87 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 0.92 0.00 0.00 46 H 7.83 4.80 0.00 2.77 3.23 0.00 5.65 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 W 8.11 4.30 0.00 3.52 3.19 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 48 E 8.24 4.14 0.00 2.03 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 2.45 2.34 0.00 49 E 8.05 4.04 0.00 2.09 1.83 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 2.31 2.43 0.00 50 E 8.75 4.15 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.21 0.00 51 E 8.03 4.15 0.00 1.97 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 2.32 2.13 0.00 52 C 7.92 4.11 0.00 3.01 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 53 Q 7.98 3.56 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 1.98 2.45 0.00 54 Q 8.20 3.97 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 55 D 8.30 4.37 0.00 2.85 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 56 V 8.00 3.62 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 0.90 0.00 0.00 0.71 0.00 0.00 57 S 8.16 4.17 0.00 4.04 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 58 L 7.92 4.01 0.00 1.92 1.72 0.99 0.42 0.00 0.00 0.00 0.00 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4.42 0.00 4.00 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 0.00 103 L 7.06 4.40 0.00 1.31 1.39 0.53 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.77 4.15 0.00 2.53 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 0.00 0.00 0.00 *106 K 8.93 4.12 0.00 1.82 1.85 0.00 1.78 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.54 7.81 107 T 7.47 4.18 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 1.26 0.00 0.00 108 T 8.42 3.89 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 109 A 7.93 3.96 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 0.00 110 L 7.83 3.88 0.00 1.80 1.82 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 111 K 8.14 4.22 0.00 1.88 1.91 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.24 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.51 7.81 112 Q 8.26 3.82 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.27 0.00 113 L 7.26 3.84 0.00 1.56 1.71 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 114 Q 7.98 3.50 0.00 1.79 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 1.89 2.29 0.00 115 G 8.07 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 0.00 116 H 7.68 4.66 0.00 3.24 3.36 0.00 5.65 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 *118 W 8.05 4.88 0.00 3.71 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 R 8.34 4.07 0.00 2.16 2.22 0.00 3.15 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 120 A 7.97 4.04 1.52 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 0.00 0.00 121 A 7.95 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 F 8.34 4.06 0.00 3.04 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 0.00 123 T 8.15 3.94 4.35 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 1.26 0.00 0.00 124 A 7.92 4.47 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 0.00 125 G 7.74 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 0.00 126 R 7.93 4.03 0.00 1.83 2.00 0.00 3.34 0.00 0.00 3.33 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.61 0.00 *128 K 7.67 4.55 0.00 1.68 1.79 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.50 7.81 129 A 8.90 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 E 6.38 4.09 0.00 1.44 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 1.92 2.11 0.00 131 F 8.10 4.48 0.00 2.69 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 0.00 132 F 8.36 4.17 0.00 3.01 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 0.00 133 A 8.72 4.05 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 0.00 134 D 8.00 4.48 0.00 2.93 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 0.00 135 V 7.66 3.21 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 1.02 0.00 0.00 0.47 0.00 0.00 136 V 7.53 3.45 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 0.90 0.00 0.00 0.64 0.00 0.00 137 P 0.00 4.15 0.00 2.23 2.23 0.00 3.62 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 2.16 1.97 0.00 138 A 7.46 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 V 7.16 2.93 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 1.06 0.00 0.00 0.91 0.00 0.00 140 R 7.83 3.89 0.00 1.97 1.91 0.00 3.10 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 141 K 7.74 4.06 0.00 1.90 1.91 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.55 7.81 142 W 8.02 4.41 0.00 3.47 3.09 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 0.00 143 R 8.38 4.16 0.00 2.02 2.00 0.00 3.34 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.00 0.00 144 E 8.20 4.14 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.43 0.00 145 A 7.73 4.54 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 G 8.17 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *148 K 7.74 4.30 0.00 1.93 2.05 0.00 1.83 0.00 0.00 1.84 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.49 1.54 7.81 149 V 9.40 4.99 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 1.16 0.00 0.00 1.17 0.00 0.00 150 Y 9.35 5.17 0.00 3.11 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 0.00 151 I 8.62 5.19 1.99 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.54 1.22 0.00 0.00 152 Y 9.52 5.64 0.00 2.99 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 0.00 153 S 9.23 4.97 0.00 4.05 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 S 8.90 4.32 0.00 4.05 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 0.00 155 G 8.06 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 0.00 156 S 8.72 4.54 0.00 4.15 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 0.00 157 V 8.81 3.60 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 0.97 0.00 0.00 0.98 0.00 0.00 158 E 8.25 3.90 0.00 2.11 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 2.47 2.44 0.00 159 A 8.23 4.13 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 Q 8.47 4.07 0.00 2.26 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.54 2.73 0.00 161 K 8.27 4.00 0.00 1.90 1.83 0.00 1.59 0.00 0.00 1.58 0.00 0.00 2.84 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.27 1.29 7.81 162 L 7.56 3.98 0.00 1.65 1.40 1.21 0.61 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 0.00 163 L 7.37 3.45 0.00 1.78 1.52 0.83 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 164 F 8.57 4.09 0.00 3.12 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 0.00 165 G 8.25 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 0.00 166 H 7.82 4.88 0.00 3.15 3.35 0.00 5.61 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 7.78 4.93 0.00 3.75 3.68 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 0.00 168 T 8.36 3.88 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 169 E 8.46 4.35 0.00 1.68 1.83 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 2.08 2.07 0.00 170 G 7.98 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 D 8.36 4.77 0.00 2.57 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 0.00 172 I 8.39 4.45 1.77 0.00 0.00 -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 1.08 0.68 0.70 0.00 0.00 173 L 8.37 4.04 0.00 1.84 1.73 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 174 E 8.03 4.04 0.00 2.03 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 2.24 2.30 0.00 175 L 7.68 4.18 0.00 1.81 1.76 0.85 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 176 V 7.44 4.30 1.83 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 0.32 0.00 0.00 0.32 0.00 0.00 177 D 8.65 4.30 0.00 1.58 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 0.00 0.00 0.00 0.00 178 G 6.41 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 0.00 179 H 8.55 5.52 0.00 2.85 3.27 0.00 5.65 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 F 9.42 5.03 0.00 3.15 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 0.00 181 D 8.78 5.85 0.00 2.98 3.02 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 0.00 182 T 8.49 4.54 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 1.28 0.00 0.00 183 K 8.35 3.97 0.00 1.97 1.95 0.00 1.73 0.00 0.00 2.03 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.51 1.41 7.81 184 I 7.91 3.91 1.96 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 0.89 0.64 0.69 0.00 0.00 185 G 7.21 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 H 8.82 4.64 0.00 3.43 3.24 0.00 5.63 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 K 8.68 4.09 0.00 1.73 1.90 0.00 1.50 0.00 0.00 1.75 0.00 0.00 2.75 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.35 1.20 7.81 188 V 7.85 4.38 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 0.78 0.00 0.00 0.97 0.00 0.00 189 E 8.18 4.75 0.00 2.15 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 0.00 2.28 2.28 0.00 190 S 8.83 4.62 0.00 4.06 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 0.00 191 E 8.31 3.94 0.00 2.10 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 192 S 7.92 4.04 0.00 3.57 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 Y 7.61 3.67 0.00 3.17 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 R 7.77 3.91 0.00 1.95 1.92 0.00 3.31 0.00 0.00 3.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 195 K 8.02 3.94 0.00 1.74 1.68 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.51 7.81 196 I 7.29 2.75 1.36 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 -0.30 -0.20 0.06 0.00 0.00 197 A 7.64 3.80 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 0.00 198 D 7.49 4.26 0.00 2.76 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 0.00 199 S 8.14 4.26 0.00 3.90 4.12 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 0.00 200 I 7.69 3.77 1.74 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 -0.14 0.38 0.71 0.00 0.00 201 G 9.20 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 0.00 202 C 7.46 4.75 0.00 2.99 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 S 8.18 4.74 0.00 3.88 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 T 8.32 3.84 4.35 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 1.18 0.00 0.00 205 N 8.00 4.57 0.00 3.16 2.93 0.00 0.00 6.00 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 N 8.10 5.03 0.00 2.89 2.87 0.00 0.00 7.08 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 0.00 207 I 7.69 4.88 1.98 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.85 0.94 0.00 0.00 208 L 8.83 5.10 0.00 1.64 1.38 0.90 0.73 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 0.00 209 F 9.39 5.58 0.00 3.04 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 0.00 210 L 8.89 4.90 0.00 1.54 1.42 0.39 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 211 T 8.28 4.82 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 0.82 0.00 0.00 212 D 8.68 4.75 0.00 2.85 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 V 7.43 4.24 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 1.13 0.00 0.00 0.93 0.00 0.00 214 T 8.41 3.63 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 1.10 0.00 0.00 215 R 7.96 4.21 0.00 1.90 2.06 0.00 3.13 0.00 0.00 3.35 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 216 E 8.18 4.37 0.00 2.32 2.44 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 2.56 2.46 0.00 217 A 7.85 4.04 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 S 8.80 4.19 0.00 4.08 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 A 7.89 4.19 1.62 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 0.00 0.00 220 A 7.85 3.17 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 E 8.36 4.21 0.00 2.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 222 E 8.26 4.03 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 223 A 7.60 4.45 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 0.00 224 D 8.05 4.27 0.00 2.77 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 0.00 225 V 7.37 4.58 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 1.01 0.00 0.00 0.89 0.00 0.00 226 H 8.78 4.63 0.00 3.27 3.16 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 8.34 5.09 2.19 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 0.72 0.00 0.00 1.13 0.00 0.00 228 A 8.61 4.82 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 V 8.69 4.51 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 0.80 0.00 0.00 0.42 0.00 0.00 230 V 8.60 4.60 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 1.02 0.00 0.00 1.00 0.00 0.00 231 V 8.59 4.64 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 0.89 0.00 0.00 0.92 0.00 0.00 232 R 8.28 4.43 0.00 1.93 1.39 0.00 2.21 0.00 0.00 2.87 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.36 0.00 233 P 0.00 4.41 0.00 2.25 2.11 0.00 3.44 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.08 0.00 234 G 8.99 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 0.00 0.00 0.00 235 N 7.68 4.57 0.00 2.73 2.76 0.00 0.00 6.89 7.46 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 0.00 236 A 8.35 4.12 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 0.00 237 G 8.42 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 0.00 0.00 0.00 238 L 8.06 4.73 0.00 1.67 1.65 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 239 T 8.82 4.26 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 1.27 0.00 0.00 240 D 8.58 4.39 0.00 2.72 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 0.00 241 D 8.10 4.44 0.00 2.69 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 0.00 242 E 8.26 4.14 0.00 2.31 2.28 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 2.54 2.43 0.00 243 K 8.13 4.06 0.00 1.93 1.92 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.52 1.66 7.81 244 T 7.60 4.12 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 1.22 0.00 0.00 245 Y 8.05 3.91 0.00 2.83 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 Y 7.38 4.39 0.00 3.19 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 0.00 247 S 8.60 4.47 0.00 3.78 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 0.00 248 L 8.59 5.38 0.00 1.53 1.58 0.96 0.95 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 0.00 249 I 8.49 4.96 2.15 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 1.36 1.22 0.93 0.00 0.00 250 T 9.17 4.58 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 251 S 7.59 4.77 0.00 3.92 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 0.00 252 F 10.14 4.67 0.00 3.29 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 0.00 253 S 7.93 4.35 0.00 4.03 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 0.00 254 E 8.43 4.21 0.00 2.31 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 255 L 7.93 4.78 0.00 1.69 1.92 0.78 -0.26 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 0.00 256 Y 10.02 4.71 0.00 3.17 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 0.00 257 L 7.73 4.04 0.00 1.31 1.33 0.88 0.57 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 * Residues marked with a * may have inaccurate shift predictions.