NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 302 T 4.3393 8.0333 117.3717 63.4495 70.1376 174.2162 303 M 3.8156 8.7572 126.8270 58.3583 31.9379 177.2748 304 D 4.0707 8.2720 118.4280 56.9100 41.3613 178.2231 305 E 3.9503 7.8873 119.6813 59.3585 29.8720 178.5378 306 Q 3.9939 8.4580 118.5137 59.0918 28.7406 178.7881 307 Q 3.9865 8.9230 119.9927 58.7326 28.4318 178.9243 308 S 4.1836 7.5063 114.8981 61.3298 63.3091 176.2945 309 Q 4.0743 7.9113 121.0426 58.5757 28.1919 178.4086 310 A 3.9883 7.9718 121.5329 54.5722 18.4532 179.0317 311 V 3.9506 7.2033 114.4549 61.0161 31.9095 176.2586 312 A 4.2185 6.9241 122.7124 51.0974 18.9385 175.9384 313 P 4.5562 0.0000 0.0000 63.4394 32.1799 175.8896 314 V 4.4754 8.2873 120.0671 61.5302 34.7375 174.1287 315 Y 5.0690 9.3282 125.9776 57.0228 39.9844 174.9509 316 V 4.8715 8.8869 121.1403 60.1918 35.1127 174.5635 317 G 4.2769 9.6966 109.6314 43.9943 0.0000 171.6832 318 G 4.0729 5.8095 109.7171 43.9530 0.0000 171.8762 319 F 4.2988 7.7897 118.5510 57.0003 39.6115 176.8562 320 L 4.3753 8.9004 124.7506 56.6091 42.5421 176.8675 321 A 4.5881 7.6670 117.9757 50.8703 22.8339 175.3170 322 R 4.6266 8.2753 119.5627 54.3804 32.0947 176.7228 323 Y 4.4344 8.1339 123.4414 60.8931 38.0690 177.0908 324 D 4.8142 8.0876 117.0854 52.9665 39.7285 175.4705 325 Q 4.5185 7.9096 119.1500 54.4288 30.5547 175.1700 326 S 4.4432 8.6420 118.5609 56.1784 62.2881 171.8960 327 P 4.4220 0.0000 0.0000 63.0659 31.4331 176.4877 328 D 4.6479 8.5168 118.1347 53.9231 40.1466 176.0368 329 E 4.6259 7.8465 119.7251 54.6550 33.6644 176.0193 330 A 4.0446 8.9149 126.7828 55.2165 18.6067 179.2333 331 E 3.9868 8.2133 112.2333 58.7734 29.5049 177.6064 332 L 4.4195 7.6262 117.8662 54.6882 42.2600 176.9563 333 L 4.1014 7.7052 120.2671 55.3085 41.9896 177.9958 334 L 4.5117 7.9732 124.0281 52.3265 43.2349 173.4289 335 P 4.4685 0.0000 0.0000 61.5366 33.8138 177.0988 336 R 3.2798 7.7648 118.7863 59.4155 29.7377 178.0059 337 D 4.2627 7.8804 118.2576 56.6824 39.0658 178.7312 338 V 3.1677 7.4331 119.2975 65.1935 31.5397 177.6028 339 V 3.6575 7.5259 117.8233 66.4658 31.3708 177.8672 340 E 4.2003 8.7365 118.3345 59.4956 29.2173 178.9856 341 H 4.2780 8.4853 118.4627 59.2784 30.0953 177.2838 342 W 4.3309 8.6921 121.1311 59.8713 28.5967 178.4971 343 L 4.4498 8.7214 118.2925 58.2657 41.2007 178.6873 344 H 4.4685 8.3022 116.7936 58.0947 29.9941 176.8223 345 A 4.0047 8.4609 121.6065 52.6995 18.0338 178.8834 346 Q 4.0791 5.7400 120.8584 53.6944 30.4510 175.2794 *356 A 4.1573 8.1400 120.2275 51.4870 19.7351 176.4921 357 L 4.3347 8.2999 122.4688 54.2323 42.9204 175.1624 358 P 4.8446 0.0000 0.0000 62.6260 33.4660 174.5051 359 L 5.1200 8.7848 124.0326 53.4398 44.3662 174.9618 360 N 5.3752 8.8034 122.6408 51.0204 41.8773 173.0027 361 I 4.1639 8.4132 120.0889 60.4795 38.3865 176.4941 362 N 4.0970 9.8088 128.3530 55.0693 37.7480 174.0843 363 H 4.0386 7.9748 110.2178 56.2482 27.6062 174.9683 364 D 4.5422 8.0829 121.2030 53.1344 40.4816 176.6555 365 D 4.4306 8.6438 127.0037 55.2349 39.7236 176.8723 366 T 4.1862 8.5829 110.4166 61.6286 69.7222 174.6652 367 A 4.4281 7.8424 125.8794 51.3448 19.3316 176.6295 368 V 4.1332 7.4473 121.8155 63.0956 32.6649 176.2597 369 V 4.4002 8.7619 119.2371 60.3892 33.6953 175.8609 370 G 4.6079 7.3740 107.7503 46.1841 0.0000 171.1604 371 H 5.3611 7.5823 116.6471 54.2152 32.7742 172.7804 372 V 4.3101 8.8025 119.7323 62.2411 31.3926 175.6188 373 A 4.6911 9.0479 129.8275 53.5539 19.9141 176.9628 374 A 4.7980 7.6255 114.6430 51.4496 22.6130 175.2963 375 M 5.1673 8.8343 119.6816 53.7191 36.1857 174.9969 376 Q 4.5452 9.1858 123.6303 54.8624 33.2598 172.9734 377 S 5.0940 8.7900 121.4533 57.6330 63.7889 173.3047 378 V 4.6216 9.1578 119.8083 58.8579 35.2728 176.2996 379 R 3.9701 8.8147 120.3144 59.8859 29.7372 176.7051 380 D 4.6911 8.5340 115.1561 53.6647 42.0256 176.4798 381 G 2.7784 6.9918 105.2257 45.3526 0.0000 169.9467 382 L 4.7941 7.3432 122.9553 53.9472 43.2775 176.3140 383 F 4.6112 9.1573 129.7957 56.3033 41.9508 173.9834 384 C 5.2581 7.6108 119.0630 56.3896 33.7838 172.3942 385 L 5.0231 9.0783 121.6153 53.4518 44.9696 175.5847 386 G 4.4741 9.8375 113.5489 44.4621 0.0000 170.9341 387 C 4.7463 8.7686 119.4927 57.5143 34.9041 173.1412 388 V 4.1910 9.0957 128.3203 62.9047 31.3463 175.9796 389 T 4.4921 8.4272 117.5146 61.4547 71.1187 174.2202 390 S 4.1194 8.3925 118.4389 58.0281 62.6911 172.7942 391 P 4.2094 0.0000 0.0000 65.6339 31.1135 178.8278 392 R 3.8447 8.8109 117.3023 59.1880 30.0063 178.9124 393 F 3.4253 7.7068 120.2712 61.0546 39.2263 177.1870 394 L 3.6577 8.0309 118.8326 57.5266 41.3649 179.1353 395 E 3.7577 8.3518 119.7290 59.1430 29.5383 178.9168 396 I 3.4697 7.3291 119.8015 64.2784 37.1672 178.5258 397 V 2.8718 7.1521 118.9444 65.5602 31.0543 177.7927 398 R 3.6301 7.7930 118.6080 59.5968 29.6571 178.6277 399 R 3.7699 7.4844 115.8339 59.1562 30.2909 178.6881 400 A 3.9026 7.6796 120.7589 54.9618 18.1454 179.6157 401 S 4.0736 7.9208 113.0765 61.8549 62.5437 176.5876 402 E 4.1066 7.6950 120.5768 57.7851 29.1010 177.6420 403 K 4.5239 8.2315 118.2214 55.8288 33.0043 175.8937 404 S 4.7332 7.7607 114.1323 56.4016 64.5664 173.9032 405 E 3.9461 8.7531 129.7671 59.0313 29.2930 178.3394 406 L 3.9145 7.8031 119.3200 58.2741 42.5647 178.6828 407 V 3.7508 8.0282 118.2288 66.1669 31.1972 178.1176 408 S 4.1825 7.9689 114.1183 61.5805 62.7292 176.5963 409 R 4.0760 7.8330 119.4390 56.5050 29.9724 177.8257 410 G 3.9365 7.7740 107.7684 43.6007 0.0000 170.8806 411 P 4.6144 0.0000 0.0000 61.7195 32.8164 175.6389 412 V 3.8852 8.2095 111.7763 61.4620 34.6364 179.9658 413 S 3.1403 8.0756 113.9541 58.3072 63.9481 170.8729 414 P 4.8672 0.0000 0.0000 62.1953 31.9596 175.5871 415 L 4.1653 7.6415 119.0334 54.8816 42.0581 176.8663 416 Q 4.3407 8.3943 120.6179 54.5195 29.7636 174.1468 417 P 4.6109 0.0000 0.0000 63.5849 31.9743 176.4509 418 D 4.5122 9.5523 120.1184 51.4202 42.4164 175.4295 419 K 3.8376 8.5675 124.0992 59.2121 32.3050 178.0320 420 V 3.4232 7.6084 117.2833 66.1354 31.4244 177.9516 421 V 3.4319 7.7023 117.2519 66.0665 30.7824 177.6755 422 E 3.9466 8.6647 118.6577 59.2433 29.2009 179.0625 423 F 3.9181 8.6256 121.1755 61.2037 39.4063 177.2162 424 L 3.9100 8.0154 118.6476 57.7964 41.0553 179.6407 425 S 4.4757 7.8120 114.5094 61.4374 62.8218 176.8620 426 G 3.5368 7.7304 107.3735 47.8674 0.0000 175.8695 427 S 3.7981 7.6027 118.4951 59.8930 63.7945 174.1941 428 Y 5.1356 7.1986 116.5334 56.6881 37.4888 175.7421 429 A 4.4150 7.9442 121.7227 53.4050 20.0659 178.2307 430 G 4.5547 8.9296 102.8999 44.1535 0.0000 171.8746 431 L 5.3931 8.7084 119.9942 52.8169 44.7579 176.6249 432 S 4.5519 8.8070 116.7963 56.6517 65.4644 172.9174 433 L 4.5678 8.7593 129.4792 54.8679 43.3676 175.8840 434 S 4.8207 9.1129 119.8479 56.6460 64.3839 172.8571 435 S 5.2797 8.5415 120.8412 56.0232 66.5374 173.7865 436 R 4.0103 8.0480 117.3012 55.9749 29.5376 176.9519 437 R 4.1058 8.6225 121.3345 57.2123 30.6739 175.8623 438 C 4.8362 8.4998 119.0595 59.4223 28.6173 174.6556 439 D 4.2653 8.1828 121.1015 56.3885 39.0108 176.1759 *452 T 4.0601 7.6053 113.5406 62.1342 68.1654 172.4697 453 T 4.6845 7.6486 112.8140 58.7138 68.6422 171.5175 454 P 3.5966 0.0000 0.0000 65.5142 32.7161 175.9431 455 F 4.8659 8.3114 119.1194 57.0003 39.1551 176.0598 456 K 4.4010 9.2868 125.0302 58.0349 32.5499 176.5888 457 H 4.7476 7.5225 112.3546 55.1161 32.0616 171.5128 458 V 4.8598 8.3646 117.6509 60.9858 34.4262 173.9381 459 A 5.3395 8.9594 128.7160 50.0778 22.2748 174.9700 460 L 5.0246 8.8929 122.3156 54.1340 43.4898 175.9258 461 C 5.3060 9.3431 118.0910 56.7355 33.3432 175.2276 462 S 4.3235 8.8905 112.7102 60.9236 62.7823 175.1241 463 V 4.3346 7.3555 109.9103 60.3153 35.0357 172.8703 464 G 4.1561 8.4288 112.0171 43.9437 0.0000 174.0574 465 R 4.1475 8.4384 118.4294 58.0350 30.5851 177.6430 466 R 4.4301 7.7582 116.4284 54.9296 31.2160 176.4949 467 R 4.2719 8.3877 121.3903 57.3623 30.8178 177.0038 468 G 3.9731 10.8593 109.7377 45.8808 0.0000 173.3711 469 T 5.3615 7.4985 108.7353 60.8928 69.9891 174.3252 470 L 4.3296 8.2697 123.8693 56.7192 42.7778 175.6231 471 A 4.6663 9.3222 129.1270 50.6825 20.4895 176.4623 472 V 4.3743 8.6931 122.8773 61.4494 33.7718 174.0719 473 Y 5.2452 8.7529 125.6618 57.0503 39.9583 175.0977 474 G 4.3534 8.8900 107.5592 46.3335 0.0000 174.6526 475 R 4.4059 8.7574 118.9277 57.2705 30.9058 177.0002 476 D 4.7657 7.8237 117.5760 51.1291 44.0933 174.2748 477 P 3.6449 0.0000 0.0000 65.7412 30.7866 178.4787 478 E 4.0001 7.7488 117.5903 59.0065 29.3365 178.6898 479 W 4.1852 8.9295 127.4511 60.5356 31.0262 178.0074 480 V 3.7609 8.1852 119.2068 65.1748 30.7991 178.5280 481 T 4.1629 8.0376 110.7524 64.3472 68.3482 175.8269 482 Q 4.1593 7.8635 118.7289 57.3194 28.8002 177.8412 483 R 3.9237 7.5378 119.1467 56.8535 30.3870 176.1922 484 F 4.6282 7.6684 118.5804 54.9714 38.5160 174.7245 485 P 4.3629 0.0000 0.0000 65.3736 31.2934 177.7964 486 D 4.5067 8.2026 118.3479 56.9231 41.0552 177.0438 487 L 4.2449 7.6445 118.5792 54.8554 42.2045 177.2524 488 T 4.5023 8.8293 113.3992 60.0142 72.1581 175.8227 489 A 3.9501 8.4112 122.7511 55.2614 18.3267 179.8135 490 A 4.0156 7.8987 118.6203 55.3833 18.6815 179.0782 491 D 4.3020 8.0694 117.5063 57.9441 40.7903 179.6301 492 R 3.9346 8.2652 118.4794 59.3233 29.9393 178.8660 493 D 4.3392 8.2750 118.9445 57.3481 40.6838 179.1249 494 G 3.9142 8.0550 107.4718 47.0181 0.0000 175.8844 495 L 4.1500 7.6957 120.8752 57.6695 41.8832 179.1964 496 R 2.0000 8.7590 119.5061 58.7396 29.9313 178.2374 497 A 3.7601 7.9514 120.7120 55.1598 18.3584 179.6585 498 Q 3.9269 7.4252 115.1685 58.8369 28.7706 178.6989 499 W 4.5777 8.0924 115.1066 58.3867 28.2926 177.2645 500 Q 4.3777 7.3985 118.2650 58.2048 28.7313 177.7628 501 R 4.0573 7.6098 118.0769 58.4698 30.4471 177.1912 502 C 4.2692 7.3072 117.0695 59.2018 32.1437 173.3008 *510 S 4.2774 8.4329 117.3154 57.0491 63.6504 174.5365 511 G 3.9496 8.2458 105.6125 45.2776 0.0000 172.6827 512 D 4.3395 8.5032 120.2377 53.9843 41.0977 174.7149 513 P 4.4820 0.0000 0.0000 63.7125 32.1222 176.3676 514 F 4.4716 8.1753 122.1115 58.2052 39.6040 174.6582 515 R 4.5483 7.8856 125.2786 55.7063 31.4645 175.3694 516 S 4.8418 5.8100 114.2444 57.4839 64.6670 170.8875 517 D 4.9060 8.2082 116.6658 51.9596 41.7660 175.5073 518 S 4.0820 8.7231 113.2637 62.2486 62.6244 175.7647 519 Y 4.3694 7.7327 120.0251 60.5800 37.5648 178.8571 520 G 3.6763 8.8281 106.7904 47.9627 0.0000 175.8204 521 L 4.2167 8.0733 122.0680 57.2898 41.4110 179.3896 522 L 4.1607 8.4031 120.0929 58.1571 42.1068 178.9813 523 G 3.8128 8.4966 105.9029 47.8804 0.0000 175.2435 524 N 4.3469 8.5285 119.7454 56.2364 38.7987 177.0751 525 S 4.2070 8.2365 116.3141 61.5040 62.7725 176.9995 526 V 3.7736 7.3445 121.3778 64.4291 31.3961 177.8617 527 D 4.5949 8.0914 119.6311 57.3306 40.5670 178.4678 528 A 4.0961 8.1116 120.7296 55.1296 18.1968 179.2946 529 L 3.9713 7.6095 116.2551 56.7866 41.5594 177.5944 530 Y 4.4506 7.4801 115.2609 57.4685 38.3404 175.2362 531 I 4.1683 7.3826 122.0471 60.3646 37.7468 176.3428 532 R 4.0518 8.5420 124.9051 57.3499 30.7876 175.9900 533 E 3.7988 8.8862 119.0663 57.1385 27.4564 177.2474 534 R 3.8740 8.0781 117.9218 59.7086 30.1760 177.0132 535 L 3.9718 7.8149 117.7996 57.5187 41.7788 177.5685 536 P 4.3152 0.0000 0.0000 65.6843 31.1680 178.8214 537 K 4.0568 8.1991 117.1220 59.3644 31.9329 179.4045 538 L 4.1775 8.1452 119.3187 57.9793 41.4918 179.8123 539 R 3.9472 8.4845 118.3721 59.3572 29.9301 178.3860 540 Y 4.0111 8.2292 119.3037 60.8660 38.7829 178.0138 541 D 4.2978 8.6030 120.0597 57.1550 40.7060 178.5004 542 K 3.8478 8.4085 120.5441 59.7219 32.0354 178.5670 543 Q 3.8662 8.2273 119.8945 58.9287 28.7325 177.7796 544 L 3.7115 7.5143 120.4870 57.9043 42.2538 178.4433 545 V 3.9545 7.6880 114.7310 62.3830 31.7679 176.3290 546 G 3.8445 7.6052 105.9911 47.0552 0.0000 175.4179 547 V 3.7004 7.3469 118.0640 63.8477 31.8172 177.3960 548 T 4.0054 7.7462 109.8968 65.5615 68.9774 175.8304 549 E 4.3447 7.7595 118.8398 56.1318 29.1008 175.9595 550 R 4.6534 7.4053 117.5561 54.4594 34.1514 174.0592 551 E 4.6224 8.3367 118.2697 54.8093 31.3831 175.9507 552 S 4.5915 7.9954 116.1187 58.1271 65.4639 173.1765 553 Y 4.5104 8.6627 116.5151 58.1326 38.0149 176.2448 554 V 3.7467 7.3771 120.8304 63.5721 31.8750 175.9148 555 K 4.2670 8.6068 124.9268 57.4151 33.0548 176.4653 556 A 4.1687 7.9471 125.6540 52.3299 18.3275 176.9857 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 302 T 8.03 4.34 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 1.23 0.00 0.00 303 M 8.76 3.82 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.67 0.00 304 D 8.27 4.07 0.00 2.70 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 0.00 305 E 7.89 3.95 0.00 2.02 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 2.35 2.38 0.00 306 Q 8.46 3.99 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.57 0.00 0.00 0.00 0.00 0.00 2.35 2.66 0.00 307 Q 8.92 3.99 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 308 S 7.51 4.18 0.00 3.97 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 0.00 309 Q 7.91 4.07 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.58 0.00 310 A 7.97 3.99 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 0.00 311 V 7.20 3.95 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 0.79 0.00 0.00 0.85 0.00 0.00 312 A 6.92 4.22 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 0.00 313 P 0.00 4.56 0.00 1.83 1.96 0.00 3.70 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 1.99 1.96 0.00 314 V 8.29 4.48 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 1.12 0.00 0.00 0.97 0.00 0.00 315 Y 9.33 5.07 0.00 3.11 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 0.00 316 V 8.89 4.87 1.79 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 0.72 0.00 0.00 0.38 0.00 0.00 317 G 9.70 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 0.00 0.00 0.00 0.00 318 G 5.81 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 0.00 0.00 0.00 319 F 7.79 4.30 0.00 3.25 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 320 L 8.90 4.38 0.00 1.43 1.71 0.77 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 321 A 7.67 4.59 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 0.00 322 R 8.28 4.63 0.00 1.68 1.71 0.00 2.89 0.00 0.00 3.23 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.44 0.00 323 Y 8.13 4.43 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 0.00 324 D 8.09 4.81 0.00 2.80 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 325 Q 7.91 4.52 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.91 0.00 0.00 0.00 0.00 0.00 2.29 2.45 0.00 326 S 8.64 4.44 0.00 3.84 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 327 P 0.00 4.42 0.00 2.47 2.20 0.00 3.76 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 328 D 8.52 4.65 0.00 2.80 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 0.00 329 E 7.85 4.63 0.00 1.97 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 2.23 2.40 0.00 330 A 8.91 4.04 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 0.00 331 E 8.21 3.99 0.00 2.11 2.14 0.00 0.00 0.00 0.00 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0.00 0.00 390 S 8.39 4.12 0.00 3.92 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 391 P 0.00 4.21 0.00 2.19 2.06 0.00 3.82 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 392 R 8.81 3.84 0.00 1.94 2.02 0.00 3.20 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 393 F 7.71 3.43 0.00 2.01 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 0.00 394 L 8.03 3.66 0.00 1.74 1.58 1.07 1.02 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 0.00 395 E 8.35 3.76 0.00 1.94 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 2.22 2.28 0.00 396 I 7.33 3.47 1.66 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 1.29 0.44 0.72 0.00 0.00 397 V 7.15 2.87 1.73 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 0.56 0.00 0.00 0.07 0.00 0.00 398 R 7.79 3.63 0.00 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0.00 0.00 0.00 0.00 0.00 1.90 1.95 0.00 415 L 7.64 4.17 0.00 1.68 1.42 0.34 0.83 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 0.00 416 Q 8.39 4.34 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.96 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 417 P 0.00 4.61 0.00 2.21 2.13 0.00 3.78 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 418 D 9.55 4.51 0.00 2.35 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 419 K 8.57 3.84 0.00 1.76 1.82 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.50 7.81 420 V 7.61 3.42 1.96 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 0.91 0.00 0.00 0.81 0.00 0.00 421 V 7.70 3.43 1.71 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 0.61 0.00 0.00 0.85 0.00 0.00 422 E 8.66 3.95 0.00 2.13 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 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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 0.00 *452 T 7.61 4.06 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 1.05 0.00 0.00 453 T 7.65 4.68 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 1.19 0.00 0.00 454 P 0.00 3.60 0.00 0.69 0.49 0.00 3.45 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.27 0.00 455 F 8.31 4.87 0.00 3.13 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 0.00 456 K 9.29 4.40 0.00 1.54 1.86 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.48 7.81 457 H 7.52 4.75 0.00 3.33 3.40 0.00 5.39 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 458 V 8.36 4.86 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 0.89 0.00 0.00 0.88 0.00 0.00 459 A 8.96 5.34 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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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 0.00 525 S 8.24 4.21 0.00 4.14 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 526 V 7.34 3.77 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 0.93 0.00 0.00 1.12 0.00 0.00 527 D 8.09 4.59 0.00 2.98 2.84 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 0.00 528 A 8.11 4.10 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 0.00 529 L 7.61 3.97 0.00 1.68 1.24 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 530 Y 7.48 4.45 0.00 3.05 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 0.00 531 I 7.38 4.17 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.69 0.94 0.00 0.00 532 R 8.54 4.05 0.00 1.82 1.87 0.00 3.39 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 533 E 8.89 3.80 0.00 2.15 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 2.30 2.27 0.00 534 R 8.08 3.87 0.00 2.04 1.91 0.00 3.19 0.00 0.00 3.31 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 535 L 7.81 3.97 0.00 1.76 1.71 0.90 1.01 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 0.00 536 P 0.00 4.32 0.00 2.15 2.12 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 537 K 8.20 4.06 0.00 2.06 1.90 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.64 7.81 538 L 8.15 4.18 0.00 2.04 1.75 1.02 0.88 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 0.00 539 R 8.48 3.95 0.00 2.00 2.01 0.00 3.15 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.92 0.00 540 Y 8.23 4.01 0.00 3.18 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 0.00 541 D 8.60 4.30 0.00 2.94 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 542 K 8.41 3.85 0.00 2.04 1.82 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.46 7.81 543 Q 8.23 3.87 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 544 L 7.51 3.71 0.00 1.20 1.59 0.75 1.09 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 0.00 545 V 7.69 3.95 2.31 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 1.36 0.00 0.00 0.96 0.00 0.00 546 G 7.61 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 0.00 547 V 7.35 3.70 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 0.61 0.00 0.00 0.58 0.00 0.00 548 T 7.75 4.01 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 1.20 0.00 0.00 549 E 7.76 4.34 0.00 1.99 1.96 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 2.30 2.38 0.00 550 R 7.41 4.65 0.00 1.52 1.58 0.00 3.12 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.73 0.00 551 E 8.34 4.62 0.00 1.89 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 2.18 2.17 0.00 552 S 8.00 4.59 0.00 3.96 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 0.00 553 Y 8.66 4.51 0.00 3.21 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 0.00 554 V 7.38 3.75 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 0.80 0.00 0.00 0.99 0.00 0.00 555 K 8.61 4.27 0.00 1.77 1.83 0.00 1.84 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.33 7.81 556 A 7.95 4.17 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 * Residues marked with a * may have inaccurate shift predictions.