NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4703 8.3349 117.0985 57.7755 63.8971 173.5796 3 E 4.1484 8.6395 125.4013 54.6318 30.4807 174.3474 4 L 4.5804 9.1310 122.1961 53.7759 44.4827 175.3132 5 I 5.0570 8.6202 124.8843 59.3581 40.5330 174.1506 6 L 5.1120 9.0411 129.3725 53.6058 44.5808 174.4820 7 H 5.5797 9.3869 124.4956 54.6645 30.6402 173.7724 8 H 5.1198 8.8245 117.7331 54.6938 32.6938 172.3431 9 Y 4.6295 8.5716 117.2163 56.4775 38.3366 175.1484 10 P 4.4416 0.0000 0.0000 65.6016 31.6298 177.7031 11 T 4.2925 7.9278 105.8645 62.5588 69.4685 174.7488 12 S 4.3998 7.8900 118.2517 58.0319 62.5577 173.8817 13 L 4.6563 8.9542 127.8879 58.0359 41.6047 179.2060 14 F 4.5303 8.8311 120.2699 61.0899 39.5779 176.3720 15 A 3.7865 8.1597 121.2831 53.7614 18.0881 178.9141 16 E 3.6504 7.8916 117.6034 58.7074 29.3082 178.7360 17 K 3.5516 6.7909 118.7150 59.2159 32.2540 178.3131 18 A 3.8013 7.3657 119.3390 55.0185 18.4523 179.3385 19 R 3.6016 7.2211 116.4464 58.9411 30.0974 180.2980 20 L 4.2419 7.6581 118.0749 54.8317 41.5723 179.2625 *22 L 4.0476 8.0423 120.8609 54.7337 43.5418 179.6900 23 G 3.9422 7.6732 106.0597 48.0286 0.0000 174.6277 24 F 4.1032 8.0002 121.5954 60.8517 39.4631 176.5085 25 K 3.5042 7.8269 118.5061 57.5263 31.9024 177.7994 26 G 3.8539 7.9879 105.4199 45.9902 0.0000 173.0151 27 V 4.3236 7.5355 118.6095 59.1871 33.0081 175.3440 28 N 4.9544 8.6929 122.2563 53.1790 39.3836 174.0490 29 W 5.4657 9.0930 118.6446 55.0969 32.7212 173.6845 30 R 4.9868 9.3846 119.5949 54.5996 32.3206 175.4811 31 S 5.2548 8.8755 118.8589 56.8499 64.6124 172.7826 32 V 4.8791 8.4264 128.5122 60.7697 32.8637 175.0461 33 T 4.5021 8.5286 125.1704 63.5167 69.3687 174.0476 34 I 4.3850 7.8497 127.0219 58.7660 37.9842 174.2221 35 P 4.4532 0.0000 0.0000 62.6517 31.8633 177.7503 36 S 4.4984 8.7548 117.3861 61.5034 63.5280 176.0207 37 I 4.0008 6.7796 119.3849 60.1283 37.6033 173.2408 *39 P 4.2782 0.0000 0.0000 63.8406 32.7100 176.6180 40 K 4.6293 7.9318 117.1649 53.3232 32.4580 175.1352 41 P 4.2919 0.0000 0.0000 65.8335 31.2516 178.5025 42 D 4.3175 7.9978 118.1255 57.0806 40.8659 178.3209 43 L 3.8521 7.8193 120.3547 58.4184 42.3219 178.7282 44 T 3.8996 7.9672 112.6009 64.8708 66.9700 175.9514 45 A 4.1513 7.6026 121.9426 55.0564 18.4604 179.3893 46 L 4.0697 7.2812 116.3805 57.9175 41.9414 179.1810 47 T 4.3286 7.7976 106.6471 61.3229 69.3020 175.5268 48 G 3.8239 8.7915 110.6698 46.3218 0.0000 174.3785 49 G 4.3529 8.0263 109.9302 44.8954 0.0000 174.1759 50 Y 4.0784 8.1502 122.7472 59.0483 38.7693 176.4925 51 R 4.4076 8.3156 126.8800 56.3624 30.6086 173.7977 52 K 4.0255 6.6193 118.8684 55.7475 32.0661 181.4110 53 T 4.9649 8.1384 111.5925 58.6166 72.0700 171.3346 54 P 4.9022 0.0000 0.0000 62.1928 32.8512 175.9196 55 V 4.6307 8.6822 120.2069 61.1481 35.0974 173.7315 56 L 5.1004 8.5716 129.1903 53.4847 44.1418 174.5568 57 Q 5.1528 9.6279 128.3831 54.3960 32.1602 174.1021 58 I 4.7001 8.5175 126.6476 59.1174 40.0921 176.9619 59 G 3.7010 8.9221 119.5902 46.9966 0.0000 173.4539 60 A 4.6512 8.7583 126.8738 51.4024 19.3170 175.6594 61 D 5.3631 8.0364 119.2058 53.6981 43.5626 175.3909 62 I 4.8910 8.6837 124.4645 59.6308 40.2797 173.9962 63 Y 4.6273 9.2626 125.0818 56.2954 40.1820 174.5535 64 C 4.9174 8.2965 121.1698 59.0527 31.0258 173.3075 65 D 4.9360 9.0594 121.0499 55.1375 41.4559 174.9453 66 T 3.8933 8.5849 122.5635 66.6054 69.0711 175.5759 67 A 4.0586 8.1588 124.0057 55.0520 18.8888 179.9555 68 L 4.3435 7.8402 118.3720 54.8961 41.5914 178.8263 *70 A 3.8466 8.1935 121.2841 51.7134 20.6599 180.1288 71 R 4.0361 7.4963 114.1842 59.2616 29.9798 179.2860 72 R 3.7331 7.7847 118.4327 59.3322 29.9920 178.6160 73 L 3.9460 7.7115 118.3449 57.6173 41.4211 178.9094 74 E 3.9990 8.0581 118.6900 59.3427 29.6795 178.3765 75 Q 4.0616 7.7987 118.4972 58.8714 29.1424 177.5509 76 E 4.1339 7.8610 119.6384 57.3803 29.9231 176.7364 77 K 4.4090 7.4823 118.4266 54.1538 34.7050 175.6252 78 A 4.2017 8.8557 129.7511 54.3157 18.6740 177.2137 79 S 4.7542 7.5217 108.3733 55.3155 65.1107 171.6740 80 P 4.2188 0.0000 0.0000 62.0756 31.8319 175.9785 81 A 4.3007 8.2444 124.4743 52.0226 19.2534 177.8132 82 F 4.3020 9.6385 122.2656 59.8895 39.0985 174.2977 83 Y 4.8537 7.9218 118.1675 54.7961 38.3674 173.1144 84 P 4.4191 0.0000 0.0000 61.9038 32.3205 176.3800 85 Q 4.4242 8.5229 121.3670 57.6516 28.9469 177.2739 86 G 4.0283 9.3914 111.1622 45.7673 0.0000 173.6801 87 Q 4.6810 8.0811 117.1546 55.2108 30.3496 177.2212 88 E 4.0523 8.3880 120.3822 59.5295 29.4369 178.9113 89 F 4.1179 8.2587 119.9409 61.2562 39.6663 176.8533 90 A 4.0121 8.1445 120.0096 55.1334 18.2911 179.6423 91 V 3.0502 7.7191 116.5774 65.8635 31.5693 178.1563 92 A 4.1892 8.1122 120.7295 55.0897 18.2338 179.8854 93 G 3.3750 7.9767 104.3591 47.8039 0.0000 175.7173 94 L 4.0827 7.9471 122.7012 57.7546 42.0200 178.9314 95 A 4.0634 8.1164 120.5354 55.1683 18.4750 179.4931 96 A 3.9536 8.1644 119.3577 54.9584 18.5228 179.6560 97 W 4.0371 8.5081 126.7607 60.5801 30.8039 178.1353 98 A 3.5746 8.4497 120.7932 55.1406 17.6014 179.3628 99 D 4.3333 8.3010 117.0671 57.5519 41.1482 177.5374 100 S 4.4360 7.9608 113.9506 59.9587 63.5417 176.5417 101 V 3.3661 7.3964 120.2557 64.9384 31.7853 178.4751 102 L 3.6875 6.6212 119.3708 57.9969 41.9466 178.4936 103 F 4.1232 8.0717 120.6407 61.2715 39.4533 177.0972 104 L 3.7151 7.8603 118.5937 57.8421 41.4138 179.2220 105 H 4.0138 8.1091 115.5842 58.8099 28.7100 177.7059 106 A 3.5230 7.6294 122.2920 55.0882 18.1692 180.1326 107 V 3.6409 7.2755 110.9021 64.4506 31.0155 179.0357 108 S 4.0869 7.7378 114.7226 61.4959 62.4311 176.7206 109 L 3.7719 7.2315 120.2959 57.6512 41.3516 179.5032 110 V 3.4816 7.4013 116.9806 65.1840 31.4743 176.7155 111 F 5.0177 7.7275 116.2494 57.8292 40.5129 175.1233 112 Q 4.4730 7.4596 125.2905 54.4526 34.0322 180.1804 *148 P 4.2750 0.0000 0.0000 63.4569 31.5147 176.7143 149 V 3.6045 7.8255 126.3720 66.6007 31.7124 176.6052 150 E 3.9156 8.0793 118.6370 59.4202 29.5636 178.4663 151 Q 4.0421 8.0398 119.1189 58.9824 29.2770 178.1839 152 V 3.6498 8.3669 122.2285 66.6725 31.4192 178.8925 153 K 4.2461 8.3790 122.3505 59.9546 31.5846 180.0263 154 H 4.5711 8.5366 118.7397 59.5539 30.2472 177.2234 155 Q 3.9336 8.4710 119.9701 58.4850 28.2989 178.3959 156 W 4.2448 8.3005 129.2020 60.0878 30.5302 176.2928 157 P 4.2287 0.0000 0.0000 65.5482 30.9788 178.4073 158 T 3.9315 7.4447 114.5778 66.4478 68.2591 176.9454 159 F 4.5844 6.6389 115.5525 58.5597 38.5461 177.0618 *161 S 4.6735 7.9844 117.4975 58.5406 64.9794 176.2299 162 R 3.8260 7.7198 119.7328 58.8598 29.7250 178.7407 163 L 3.7677 7.7432 120.1374 58.0559 42.1024 178.8363 164 E 3.9464 8.0003 118.0278 59.4897 29.2335 179.3451 165 S 4.1579 7.8719 114.0432 61.6577 63.0896 176.2578 166 Q 4.0946 7.8857 122.0450 59.2038 28.7808 178.2759 167 L 3.9409 7.9574 120.1789 57.4626 41.3722 179.4166 168 S 4.1823 7.8160 113.2971 61.0688 62.9405 175.5841 169 H 4.4602 7.6855 118.9069 56.3333 28.5023 176.1160 170 G 3.8907 7.9972 108.9517 45.6526 0.0000 174.1704 171 G 3.7899 7.7969 107.5451 45.0289 0.0000 174.2379 172 D 4.2744 8.7852 122.1965 56.6126 41.2453 176.2480 173 F 5.3080 7.7749 114.6754 55.5211 43.3402 175.5904 174 L 3.8485 9.4335 121.3963 57.6105 41.2816 178.7666 175 F 4.4644 8.6245 114.2462 56.9614 39.4112 175.7654 176 G 4.1838 7.9051 116.4426 45.1963 0.0000 174.2550 177 A 4.5148 7.9819 122.6490 50.3813 19.9099 176.2755 178 P 4.0825 0.0000 0.0000 62.7875 32.2369 175.5605 179 S 4.5705 8.6018 113.8371 55.9462 66.3819 174.9345 180 I 3.7590 8.1896 119.7456 64.0697 37.3755 177.5847 181 A 4.1089 7.6070 120.5904 55.1297 18.0933 179.2627 182 D 4.6307 7.9922 117.1432 57.7431 40.8015 179.0897 183 F 4.0858 7.8579 117.7067 60.4727 39.0772 177.7839 184 S 4.1586 8.0742 114.4209 61.5851 62.5334 176.9703 185 V 3.8398 7.9828 120.5603 66.1357 31.4107 177.9174 186 A 4.1808 8.5919 120.8238 55.4354 18.2525 179.0632 187 H 4.3828 8.8309 117.4835 59.7273 29.8386 177.6390 188 T 4.0759 7.8509 110.3526 64.9101 68.3659 176.5358 189 L 4.2769 7.8904 121.1410 57.3949 41.8551 178.9142 190 W 4.3783 8.7358 128.4364 60.3727 30.7357 177.8041 191 F 3.8191 8.6726 120.4812 61.2844 38.6659 177.1493 192 L 4.0553 7.7090 117.6374 57.3411 41.5047 178.7357 193 K 4.2736 7.3343 115.6091 56.9971 32.3843 178.3692 194 Q 3.8284 7.3948 118.5168 56.6423 29.0091 176.0277 195 T 4.5967 6.8736 109.1272 58.5624 71.6749 172.1467 196 P 4.3613 0.0000 0.0000 65.8394 31.6227 178.9627 197 V 3.6089 7.7623 117.7347 64.2848 31.4484 177.4856 198 T 4.3739 7.7096 109.6889 62.6110 68.9121 176.4758 199 A 4.1127 7.7682 124.3265 54.6766 18.3623 177.7259 200 P 4.2047 0.0000 0.0000 65.4466 31.1130 178.6486 201 F 4.4039 7.9465 116.4240 60.4295 38.9257 177.5248 202 V 4.1431 8.0897 117.5233 66.3141 31.3640 177.7661 203 D 4.4842 8.3038 117.6673 57.4372 40.7328 178.2426 204 D 4.5165 8.5270 118.6235 55.4403 41.3365 176.1960 205 Y 4.7716 7.5798 117.2153 54.1473 38.0385 174.3024 206 P 4.4824 0.0000 0.0000 65.0396 31.4111 178.1359 207 S 4.2078 8.1190 112.1670 61.2987 63.2082 176.4180 208 V 3.9793 7.7318 114.5708 63.4894 31.1809 178.4351 209 S 4.2434 7.9848 115.1452 61.3480 62.6543 176.6921 210 V 3.5748 7.8264 121.3860 65.5440 31.3995 177.6551 211 W 4.0682 8.2567 127.6421 60.2972 30.5875 177.4886 212 L 3.1787 8.2645 120.3869 58.0135 41.6580 178.6856 213 D 4.3384 8.4109 119.2603 57.3056 40.5081 178.7764 214 R 3.7736 7.3787 118.1866 59.3099 30.1611 178.4853 215 V 3.8833 7.3239 118.0452 66.0268 31.0279 177.9381 216 L 4.2502 7.9668 118.1842 56.9449 41.2050 179.4710 217 G 3.5963 7.6607 105.0740 47.4285 0.0000 175.4761 218 F 4.3549 7.8410 119.6086 60.3254 39.4768 176.7842 219 G 3.9060 8.3585 106.0660 45.5374 0.0000 172.9494 220 H 5.0209 8.9435 114.6500 55.3392 30.1940 176.6071 221 G 3.8798 8.1734 106.9403 44.7873 0.0000 171.6257 222 S 4.7209 8.5413 114.9154 56.5702 63.9885 174.4006 223 L 5.2224 8.3239 126.7564 52.5763 43.1460 175.9333 224 S 4.6070 7.8835 114.3552 56.3317 66.6880 172.9172 225 D 4.9622 8.6754 121.8662 54.6718 41.4822 175.4786 226 L 4.9052 8.6718 123.6687 53.0538 45.8477 176.1844 227 S 4.4274 8.6605 120.1426 57.8004 64.3532 175.3085 228 S 4.1667 8.7017 117.2651 61.5234 62.5869 176.5773 229 A 3.9615 7.9899 123.6566 55.0538 18.3584 179.2875 230 A 3.9642 8.6151 119.3812 55.2047 18.4929 179.7242 231 A 3.9972 8.0237 119.4284 55.3362 18.3489 179.9562 232 I 3.6863 7.7301 118.0500 64.4878 37.1853 178.2661 233 E 3.9226 8.0536 119.9203 59.2713 29.1887 178.9117 234 I 3.7029 7.6875 119.4609 64.3183 36.9360 178.2918 235 A 4.2158 7.6687 121.6575 54.6011 18.2757 179.3233 236 S 4.9670 7.9332 112.2834 61.3442 62.5916 175.9716 237 N 4.4629 8.1819 117.6996 54.8758 38.4207 175.3921 238 A 4.4856 6.9944 122.5851 51.1897 20.0777 176.1638 239 T 4.6696 7.8312 108.4651 58.9064 71.5185 172.5125 240 P 4.3397 0.0000 0.0000 62.3129 31.9311 176.3014 241 A 4.2405 8.8390 124.6143 51.0671 19.0010 176.0389 242 P 4.3850 0.0000 0.0000 62.3401 31.9586 177.1119 243 L 4.1167 8.1294 121.3571 53.7636 42.3275 175.4089 244 P 4.2467 0.0000 0.0000 62.7323 31.9961 177.1868 245 D 4.6913 8.2639 122.7009 52.7670 39.6228 174.2687 246 E 4.7629 8.0940 120.7688 53.9754 33.0772 174.4151 247 T 4.6594 8.5652 115.8259 59.9413 70.5994 173.6949 248 F 4.8587 8.4122 126.3545 56.6133 42.5623 173.3060 249 I 3.9392 7.3429 127.7999 59.1616 37.8844 175.2299 250 D 4.2842 8.1170 125.9158 53.4731 41.6798 175.4233 251 P 4.2280 0.0000 0.0000 65.0554 31.5735 176.8848 252 N 4.6637 8.4451 113.3968 52.7449 38.5934 175.6832 253 G 3.7858 7.9561 105.7907 45.5710 0.0000 174.4482 254 F 4.4166 8.0600 117.3972 57.1259 39.7900 174.5323 255 K 4.6328 8.6935 123.1810 54.0586 35.3905 175.6472 256 A 4.4713 8.4062 126.6211 53.8343 18.7522 178.2474 257 G 4.0307 8.7890 110.9509 45.0529 0.0000 173.8821 258 D 4.6241 8.1525 120.0272 54.3597 42.2167 175.3458 259 K 5.0289 8.5456 120.8843 55.0838 33.9662 176.0054 260 V 4.8233 8.8438 116.9432 60.0431 37.1034 173.4765 261 A 5.1370 8.8210 122.3858 50.2952 22.1596 175.1719 262 I 4.7554 8.7043 121.7813 59.3737 40.2140 174.7679 263 A 4.9734 8.7466 127.1892 49.6273 22.8996 175.1525 264 A 4.0534 8.7514 121.1880 51.7908 18.7089 178.4640 265 V 3.5374 8.0211 120.7228 63.7361 31.9815 177.0906 266 D 4.7595 7.4257 123.5629 51.2997 40.0155 175.5370 *267 Y 4.1909 7.1241 117.9998 57.9193 43.0847 174.7118 *270 E 4.2150 8.6795 107.0144 57.7802 31.1912 171.8222 271 A 4.9482 7.6379 123.2602 50.3297 21.6605 177.2683 272 V 4.0619 8.0252 121.9810 61.5617 33.0527 175.0945 273 E 5.0173 8.3651 122.0128 54.8593 32.4167 176.1895 274 G 3.9846 8.3377 107.7240 46.7122 0.0000 170.5181 275 E 5.0472 8.3287 121.7903 54.5198 31.6548 176.9444 276 L 4.5491 8.8311 129.3754 54.5392 44.1334 174.9954 *278 F 4.8312 8.3336 123.5282 58.2749 40.9378 173.4689 279 T 4.5133 7.6981 118.7837 60.0292 69.6377 172.9730 280 G 3.8789 8.3049 116.0759 43.7021 0.0000 173.5674 281 R 3.5020 8.2865 118.2042 58.1974 30.0247 178.0320 282 E 4.5727 7.9799 114.5001 56.0372 31.4080 174.6110 283 E 5.1537 7.7131 118.0328 54.7494 33.8908 173.5978 284 L 5.4472 9.2130 124.5936 53.0252 45.6346 175.4519 285 I 4.8502 8.7934 123.7050 59.2855 40.0011 174.6908 286 L 4.8509 8.4888 128.2172 53.2137 44.9407 174.7595 287 R 5.0859 9.3073 127.8598 54.9541 32.0495 175.1076 288 R 5.0543 8.7175 121.0038 54.7753 33.5961 173.4598 289 E 5.2156 8.7197 118.3753 54.7389 32.7445 174.9721 290 D 4.8041 8.5764 121.3746 52.6879 44.8730 176.1022 291 N 4.3336 9.0380 121.7306 56.8008 38.9959 177.1113 292 R 4.0191 8.1400 114.9097 59.2895 30.6433 178.1187 293 A 4.0012 8.5643 121.1440 53.2985 19.2115 178.4256 294 G 4.0946 8.2749 104.2147 44.5687 0.0000 172.2287 295 V 4.1974 8.1219 119.4508 63.2886 32.4536 177.0817 296 V 4.6746 8.7056 125.9294 61.7714 35.8051 172.8760 297 H 5.3821 9.3562 123.3084 53.9925 31.6152 173.0921 298 V 4.4819 8.6100 123.5308 61.2793 34.0312 173.7659 299 H 5.1276 8.8399 125.1349 53.9732 31.0982 173.5823 300 F 4.8519 8.5718 121.2070 54.6288 42.7318 173.3273 301 P 5.2559 0.0000 0.0000 61.9025 31.9721 176.8712 302 R 4.0996 8.6330 118.5020 59.3093 30.2597 177.5977 303 L 4.2037 7.7992 117.1827 56.0166 42.1742 177.5468 304 G 3.8480 9.2476 111.0736 45.1647 0.0000 172.3420 305 F 5.1709 7.6641 116.6027 55.4768 42.6464 174.2725 306 R 4.5855 9.3576 123.4434 54.6869 32.2099 174.7580 307 V 4.6362 8.2716 125.4056 61.0549 33.6238 174.2964 308 E 4.9069 8.8674 129.4905 54.8828 32.1619 178.2663 309 K 4.1622 9.6948 124.6384 57.7931 32.2404 175.8225 310 R 4.0651 7.0944 121.5312 55.6232 30.5045 175.2659 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 S 8.33 4.47 0.00 3.65 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 E 8.64 4.15 0.00 2.05 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 2.32 2.40 0.00 4 L 9.13 4.58 0.00 1.71 1.69 0.87 0.78 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 5 I 8.62 5.06 2.09 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 1.15 1.10 0.91 0.00 0.00 6 L 9.04 5.11 0.00 1.49 1.51 0.75 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 7 H 9.39 5.58 0.00 3.06 3.19 0.00 5.68 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 H 8.82 5.12 0.00 3.26 3.34 0.00 5.25 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Y 8.57 4.63 0.00 3.18 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 10 P 0.00 4.44 0.00 2.12 2.19 0.00 3.80 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 2.04 0.00 11 T 7.93 4.29 4.32 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 1.29 0.00 0.00 12 S 7.89 4.40 0.00 3.94 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 0.00 13 L 8.95 4.66 0.00 2.01 1.89 0.24 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 14 F 8.83 4.53 0.00 3.41 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 15 A 8.16 3.79 1.56 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 0.00 0.00 16 E 7.89 3.65 0.00 1.93 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.79 0.00 17 K 6.79 3.55 0.00 0.96 1.27 0.00 1.78 0.00 0.00 1.48 0.00 0.00 2.81 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.17 1.25 7.81 18 A 7.37 3.80 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 19 R 7.22 3.60 0.00 1.65 1.54 0.00 3.26 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.47 0.00 20 L 7.66 4.24 0.00 1.73 1.60 0.81 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 *22 L 8.04 4.05 0.00 1.32 1.16 -0.75 0.43 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 23 G 7.67 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 0.00 0.00 0.00 24 F 8.00 4.10 0.00 2.50 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 K 7.83 3.50 0.00 1.82 1.72 0.00 1.67 0.00 0.00 1.19 0.00 0.00 2.71 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.25 1.34 7.81 26 G 7.99 3.85 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 0.00 0.00 0.00 27 V 7.54 4.32 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 0.76 0.00 0.00 0.93 0.00 0.00 28 N 8.69 4.95 0.00 2.64 2.85 0.00 0.00 6.87 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 29 W 9.09 5.47 0.00 3.47 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 30 R 9.38 4.99 0.00 1.75 1.87 0.00 3.20 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 31 S 8.88 5.25 0.00 3.63 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 32 V 8.43 4.88 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 1.26 0.00 0.00 0.91 0.00 0.00 33 T 8.53 4.50 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 1.21 0.00 0.00 34 I 7.85 4.39 0.94 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.47 0.59 0.00 0.00 35 P 0.00 4.45 0.00 2.25 2.20 0.00 3.65 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 36 S 8.75 4.50 0.00 3.95 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 I 6.78 4.00 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.36 0.93 0.00 0.00 *39 P 0.00 4.28 0.00 2.21 2.11 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.01 0.00 40 K 7.93 4.63 0.00 1.80 1.73 0.00 1.71 0.00 0.00 1.88 0.00 0.00 3.08 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.59 1.41 7.81 41 P 0.00 4.29 0.00 2.27 2.32 0.00 3.76 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 42 D 8.00 4.32 0.00 2.80 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.82 3.85 0.00 1.72 1.64 0.80 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 44 T 7.97 3.90 4.43 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 1.27 0.00 0.00 45 A 7.60 4.15 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 46 L 7.28 4.07 0.00 1.54 1.70 0.86 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 47 T 7.80 4.33 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 1.25 0.00 0.00 48 G 8.79 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.03 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 0.00 0.00 0.00 0.00 50 Y 8.15 4.08 0.00 3.09 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 51 R 8.32 4.41 0.00 1.86 1.80 0.00 3.33 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.17 0.00 52 K 6.62 4.03 0.00 1.77 1.63 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.00 7.81 53 T 8.14 4.96 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 54 P 0.00 4.90 0.00 1.94 2.16 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.13 0.00 55 V 8.68 4.63 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 1.00 0.00 0.00 1.05 0.00 0.00 56 L 8.57 5.10 0.00 1.72 1.51 0.63 0.56 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 57 Q 9.63 5.15 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.51 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 58 I 8.52 4.70 1.96 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.77 0.99 0.00 0.00 59 G 8.92 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 0.00 0.00 0.00 60 A 8.76 4.65 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 61 D 8.04 5.36 0.00 2.79 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 62 I 8.68 4.89 1.72 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 1.17 0.83 0.75 0.00 0.00 63 Y 9.26 4.63 0.00 2.65 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 64 C 8.30 4.92 0.00 2.21 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 65 D 9.06 4.94 0.00 2.89 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 66 T 8.58 3.89 4.22 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 1.00 0.00 0.00 67 A 8.16 4.06 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 7.84 4.34 0.00 1.71 1.91 0.95 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 *70 A 8.19 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 R 7.50 4.04 0.00 1.96 1.93 0.00 3.04 0.00 0.00 3.00 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.80 0.00 72 R 7.78 3.73 0.00 1.51 1.47 0.00 2.93 0.00 0.00 2.93 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.15 0.00 73 L 7.71 3.95 0.00 2.05 1.79 0.85 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.06 4.00 0.00 2.38 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 2.46 2.44 0.00 75 Q 7.80 4.06 0.00 2.09 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.73 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 76 E 7.86 4.13 0.00 1.92 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 2.27 2.31 0.00 77 K 7.48 4.41 0.00 1.65 1.54 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.27 7.81 78 A 8.86 4.20 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 79 S 7.52 4.75 0.00 3.73 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 P 0.00 4.22 0.00 1.75 1.77 0.00 3.31 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.30 0.00 81 A 8.24 4.30 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 82 F 9.64 4.30 0.00 3.14 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 7.92 4.85 0.00 2.95 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 84 P 0.00 4.42 0.00 2.20 2.00 0.00 3.51 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.23 0.00 85 Q 8.52 4.42 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.69 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 86 G 9.39 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 Q 8.08 4.68 0.00 2.21 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.75 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 88 E 8.39 4.05 0.00 2.11 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 2.42 2.63 0.00 89 F 8.26 4.12 0.00 3.11 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 90 A 8.14 4.01 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 V 7.72 3.05 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 0.81 0.00 0.00 -0.23 0.00 0.00 92 A 8.11 4.19 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 93 G 7.98 3.37 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 0.00 94 L 7.95 4.08 0.00 2.05 1.87 0.82 1.08 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 95 A 8.12 4.06 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.16 3.95 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 97 W 8.51 4.04 0.00 3.43 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.45 3.57 1.47 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 0.00 0.00 99 D 8.30 4.33 0.00 2.81 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 0.00 100 S 7.96 4.44 0.00 4.04 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 0.00 101 V 7.40 3.37 0.92 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 0.68 0.00 0.00 0.80 0.00 0.00 102 L 6.62 3.69 0.00 0.86 1.56 0.26 0.82 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 0.00 103 F 8.07 4.12 0.00 3.21 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.86 3.72 0.00 1.92 1.63 1.03 1.09 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 0.00 105 H 8.11 4.01 0.00 3.57 3.43 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 7.63 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.28 3.64 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 -0.12 0.00 0.00 0.82 0.00 0.00 108 S 7.74 4.09 0.00 4.03 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 0.00 109 L 7.23 3.77 0.00 1.33 1.23 -0.57 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 110 V 7.40 3.48 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 -0.29 0.00 0.00 0.78 0.00 0.00 111 F 7.73 5.02 0.00 3.17 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 Q 7.46 4.47 0.00 2.04 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.21 2.17 0.00 *148 P 0.00 4.27 0.00 2.23 2.28 0.00 3.63 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 149 V 7.83 3.60 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 0.98 0.00 0.00 0.90 0.00 0.00 150 E 8.08 3.92 0.00 2.08 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 2.40 2.38 0.00 151 Q 8.04 4.04 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.69 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 152 V 8.37 3.65 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 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 H 8.94 5.02 0.00 3.25 3.67 0.00 5.77 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 0.00 221 G 8.17 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 0.00 0.00 0.00 222 S 8.54 4.72 0.00 3.88 3.85 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 0.00 223 L 8.32 5.22 0.00 0.27 0.13 0.54 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 224 S 7.88 4.61 0.00 3.76 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 0.00 225 D 8.68 4.96 0.00 2.55 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 0.00 226 L 8.67 4.91 0.00 1.69 1.43 0.92 0.76 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 0.00 227 S 8.66 4.43 0.00 4.04 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 S 8.70 4.17 0.00 4.20 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 0.00 229 A 7.99 3.96 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 0.00 230 A 8.62 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 A 8.02 4.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 I 7.73 3.69 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.85 0.92 0.00 0.00 233 E 8.05 3.92 0.00 2.22 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 0.00 2.31 2.40 0.00 234 I 7.69 3.70 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.57 0.92 0.00 0.00 235 A 7.67 4.22 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 0.00 236 S 7.93 4.97 0.00 4.06 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 0.00 237 N 8.18 4.46 0.00 2.83 2.86 0.00 0.00 7.03 6.91 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 0.00 238 A 6.99 4.49 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 T 7.83 4.67 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 1.19 0.00 0.00 240 P 0.00 4.34 0.00 1.72 1.56 0.00 3.58 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.89 0.00 241 A 8.84 4.24 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 0.00 242 P 0.00 4.39 0.00 2.03 1.98 0.00 3.66 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 2.01 2.09 0.00 243 L 8.13 4.12 0.00 1.63 1.54 1.00 1.01 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 0.00 244 P 0.00 4.25 0.00 1.23 1.69 0.00 2.85 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.70 0.00 245 D 8.26 4.69 0.00 2.64 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 8.09 4.76 0.00 2.10 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 2.30 2.36 0.00 247 T 8.57 4.66 4.28 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 1.26 0.00 0.00 248 F 8.41 4.86 0.00 2.80 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 0.00 249 I 7.34 3.94 1.56 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.56 0.74 0.00 0.00 250 D 8.12 4.28 0.00 2.72 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 0.00 251 P 0.00 4.23 0.00 2.13 2.11 0.00 3.83 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 2.14 2.10 0.00 252 N 8.45 4.66 0.00 2.90 2.81 0.00 0.00 7.08 7.69 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 0.00 253 G 7.96 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 F 8.06 4.42 0.00 3.22 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 0.00 255 K 8.69 4.63 0.00 1.67 1.59 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.35 7.81 256 A 8.41 4.47 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 0.00 257 G 8.79 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 258 D 8.15 4.62 0.00 2.99 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 K 8.55 5.03 0.00 1.64 1.74 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.46 7.81 260 V 8.84 4.82 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 0.72 0.00 0.00 0.90 0.00 0.00 261 A 8.82 5.14 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 0.00 262 I 8.70 4.76 1.30 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.02 -0.19 0.00 0.00 263 A 8.75 4.97 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 264 A 8.75 4.05 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 265 V 8.02 3.54 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 0.60 0.00 0.00 0.89 0.00 0.00 266 D 7.43 4.76 0.00 2.59 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *267 Y 7.12 4.19 0.00 2.30 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 0.00 0.00 0.00 *270 E 8.68 4.21 0.00 2.01 1.87 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 2.13 1.89 0.00 271 A 7.64 4.95 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 272 V 8.03 4.06 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 1.07 0.00 0.00 1.05 0.00 0.00 273 E 8.37 5.02 0.00 1.85 1.87 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 2.20 2.27 0.00 274 G 8.34 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 0.00 275 E 8.33 5.05 0.00 2.03 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 2.23 2.24 0.00 276 L 8.83 4.55 0.00 1.69 1.62 0.97 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 *278 F 8.33 4.83 0.00 3.19 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 0.00 279 T 7.70 4.51 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 1.21 0.00 0.00 280 G 8.30 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 0.00 0.00 0.00 281 R 8.29 3.50 0.00 1.74 1.88 0.00 3.24 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.22 0.00 282 E 7.98 4.57 0.00 1.95 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 2.23 2.14 0.00 283 E 7.71 5.15 0.00 2.11 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 2.26 2.34 0.00 284 L 9.21 5.45 0.00 1.59 1.49 0.87 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 285 I 8.79 4.85 1.86 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.68 0.56 0.00 0.00 286 L 8.49 4.85 0.00 1.79 1.49 0.98 0.68 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 0.00 287 R 9.31 5.09 0.00 1.78 1.74 0.00 3.12 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 288 R 8.72 5.05 0.00 1.91 1.95 0.00 2.78 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 289 E 8.72 5.22 0.00 1.83 1.86 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 2.19 2.26 0.00 290 D 8.58 4.80 0.00 2.78 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 291 N 9.04 4.33 0.00 2.76 2.87 0.00 0.00 7.00 7.66 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 0.00 292 R 8.14 4.02 0.00 1.80 1.99 0.00 3.22 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 293 A 8.56 4.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 294 G 8.27 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 0.00 0.00 0.00 0.00 295 V 8.12 4.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.93 0.00 0.00 296 V 8.71 4.67 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 0.85 0.00 0.00 0.91 0.00 0.00 297 H 9.36 5.38 0.00 3.11 3.00 0.00 5.82 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 298 V 8.61 4.48 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 0.34 0.00 0.00 0.83 0.00 0.00 299 H 8.84 5.13 0.00 2.50 2.94 0.00 5.63 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 300 F 8.57 4.85 0.00 2.60 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 301 P 0.00 5.26 0.00 2.31 2.12 0.00 3.17 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.32 0.00 302 R 8.63 4.10 0.00 1.94 2.07 0.00 3.29 0.00 0.00 3.37 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 303 L 7.80 4.20 0.00 1.71 1.66 0.96 0.97 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 0.00 304 G 9.25 3.85 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 0.00 0.00 0.00 305 F 7.66 5.17 0.00 3.00 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 0.00 306 R 9.36 4.59 0.00 1.82 1.87 0.00 3.04 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 307 V 8.27 4.64 1.56 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 -0.18 0.00 0.00 0.66 0.00 0.00 308 E 8.87 4.91 0.00 2.04 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 0.00 2.25 2.24 0.00 309 K 9.69 4.16 0.00 1.77 1.73 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.36 1.00 7.81 310 R 7.09 4.07 0.00 1.81 1.89 0.00 3.38 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.