NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 400 F 4.8429 8.3249 119.3641 57.1712 41.0287 175.6991 401 L 4.4272 7.9570 119.4843 55.4053 42.9103 175.9780 402 G 4.1196 8.4995 105.5695 44.8841 0.0000 173.6541 403 D 4.7316 8.4478 124.8365 51.2815 42.7384 173.9314 404 G 4.0877 8.8270 103.3261 44.8451 0.0000 172.2405 405 G 4.3265 8.1241 119.6088 45.3299 0.0000 175.5122 406 D 4.8192 8.5896 127.9173 51.7354 42.6689 175.3834 407 V 4.5600 8.4810 125.0084 62.6055 32.4306 175.2917 408 S 4.5671 8.2393 121.5494 56.7596 65.7871 172.5128 409 F 4.6644 8.8239 126.1823 57.2152 39.7768 175.0223 410 S 4.7528 8.4729 116.7622 56.8924 65.5754 175.0786 411 T 4.1561 8.5871 121.9987 66.5083 68.4312 175.9508 412 R 3.9562 7.8119 121.1971 58.1035 30.1442 175.5009 413 G 4.2442 8.0225 103.0017 42.9004 0.0000 173.0997 414 T 4.1638 8.4337 117.7481 63.2938 68.1592 174.1896 415 Q 4.0226 9.3616 127.8191 57.4604 29.1569 177.2522 416 N 3.9780 8.9563 118.2380 53.9905 36.1393 173.8218 417 W 4.6480 7.8854 127.4933 55.7640 31.9797 175.1757 418 T 4.5365 7.4738 116.3658 59.7471 72.0187 175.3495 419 V 3.4563 8.0414 120.6611 65.7997 31.4812 177.8286 420 E 3.8390 7.9378 118.3158 59.4531 29.3211 178.8316 421 R 3.6358 7.4343 117.3142 59.2045 30.0927 178.7574 422 L 3.8203 7.2471 119.9323 58.3193 42.1458 179.0642 423 L 4.0186 8.0861 119.0586 57.8753 41.4652 179.7760 424 Q 3.9581 7.8933 117.3162 58.9199 28.5707 178.4329 425 A 4.1219 8.2075 121.3930 54.7325 18.3531 179.1477 426 H 4.1710 8.3960 117.3949 59.2966 30.0554 177.5773 427 R 3.9538 8.1282 119.8978 59.2610 29.8119 179.0155 428 Q 4.0253 8.2505 117.8960 59.0634 28.7361 178.9647 429 L 4.0008 7.5935 119.7635 57.8624 41.3656 179.4779 430 E 4.2332 8.1098 117.5614 59.0983 29.4574 178.5070 431 E 4.3295 7.8346 116.2271 57.3348 29.7451 177.3713 432 R 4.5257 7.4164 116.6208 55.7765 30.8516 176.8933 433 G 3.8866 8.3530 106.5043 45.3144 0.0000 173.0966 434 Y 4.7036 7.8425 117.2701 57.5718 39.1625 175.5397 435 V 4.6902 9.0256 115.8600 59.1883 35.7646 174.9282 436 F 3.7637 9.1323 127.6892 58.4130 39.4184 175.0821 437 V 3.9748 9.1639 118.3018 60.5253 33.0535 176.0717 438 G 3.7452 5.3800 106.8071 44.3879 0.0000 171.0582 439 Y 5.1948 8.7380 117.7321 56.6026 41.4659 175.1536 440 H 4.8478 9.6197 120.7989 54.5884 32.9057 172.1406 441 G 4.2984 8.4247 113.6063 45.4383 0.0000 171.9518 442 T 4.8062 8.4238 118.5864 60.9787 71.8170 172.5074 443 F 4.8976 8.1616 117.3993 55.4121 39.6895 176.3736 444 L 3.9222 8.8624 121.4178 58.4637 41.4092 179.7782 445 E 4.1472 8.4732 115.5942 58.6285 29.9750 178.4737 446 A 3.7501 7.1929 121.6860 54.5289 18.3836 179.2726 447 A 3.4571 7.3105 119.4924 54.8851 18.2934 179.2455 448 Q 4.1361 7.5606 118.1356 59.6649 29.0943 178.6849 449 S 4.1033 7.9540 113.5990 61.6483 62.4952 176.1016 450 I 3.8592 7.3575 122.9908 63.8754 36.6694 178.7297 451 V 3.3825 7.4413 117.4799 65.3419 31.4459 177.2612 452 F 4.9375 7.9593 114.9393 57.6172 39.6899 176.6731 453 G 3.9262 8.7114 106.4520 44.5918 0.0000 174.3433 454 G 3.9141 7.8292 105.9688 44.7413 0.0000 172.7556 455 V 3.6759 8.0486 119.3937 62.0846 32.0194 175.4355 456 R 4.6907 8.1097 124.8248 54.1544 33.8555 175.3219 457 A 2.0000 7.6340 122.7744 52.7858 18.7165 178.9484 458 R 3.9319 7.7175 114.3207 57.0661 29.0175 176.3425 459 S 4.1176 8.4157 115.5467 58.4550 62.0017 172.9184 460 Q 4.6205 7.4669 118.6140 54.5860 31.7821 174.0780 461 D 4.4862 8.6161 118.1206 55.1494 38.1663 176.1611 462 L 4.0595 8.2133 119.6431 57.3133 41.9113 178.2230 463 D 4.7925 7.9051 115.4126 53.4999 41.6884 175.7134 464 A 4.0624 8.0289 124.3725 52.4561 18.7830 178.8078 465 I 3.5387 8.7348 124.5921 64.3039 37.2080 177.9009 466 W 4.8345 7.9149 117.0317 56.1925 29.3526 176.3813 467 R 4.2119 7.9598 115.5391 56.2022 29.3313 175.9063 468 G 3.4187 7.7257 106.9322 46.1139 0.0000 171.4396 469 F 4.4396 7.4951 122.3380 56.2438 41.0673 174.1478 470 Y 4.7570 8.2965 124.4968 57.4977 38.9783 174.7418 471 I 4.8308 8.7223 115.9453 59.6090 42.2355 173.4606 472 A 4.8179 9.2145 123.0175 50.5013 22.1554 177.4785 473 G 3.7819 9.2663 112.1519 48.4032 0.0000 173.3485 474 D 4.8346 7.9973 120.9628 50.7828 40.7763 175.5653 475 P 4.0480 0.0000 0.0000 64.7510 30.8762 178.3210 476 A 3.9518 7.8095 120.3009 55.2011 18.5741 178.8826 477 L 4.0822 7.9261 118.3108 58.3215 42.2065 178.7156 478 A 4.0615 8.1396 120.2964 55.6529 18.0677 178.6192 479 Y 4.0800 8.7036 117.5414 60.7704 38.7800 178.3805 480 G 3.6457 8.1960 105.5842 45.6445 0.0000 172.6277 481 Y 4.4665 8.1432 118.5396 54.9483 40.0935 175.2196 482 A 4.9936 9.2097 134.4149 52.5115 21.2534 177.8056 483 Q 2.7332 8.7830 123.1085 58.3293 30.3687 174.6810 *493 I 4.2115 8.2632 115.1443 60.5808 40.5303 176.7297 494 R 4.5185 7.2376 117.7017 55.3355 30.1327 170.9348 495 N 4.5064 8.6108 122.2749 53.2570 40.2659 172.8529 496 G 4.4583 8.3306 115.8342 44.1953 0.0000 171.4476 497 A 4.8586 8.8161 120.2514 50.3560 23.3769 175.6985 498 L 5.0793 8.5913 119.4413 53.2285 44.4762 175.6757 499 L 5.2884 8.7424 121.5622 53.1226 46.3806 175.4405 500 R 4.7385 9.2861 120.6730 54.5783 32.7921 175.3216 501 V 4.5243 8.0439 123.4647 61.3784 33.8209 173.7690 502 Y 5.1456 8.6550 125.6107 56.4781 40.5961 175.3169 503 V 5.1233 8.7160 115.5291 58.5606 36.7631 173.5440 504 P 3.8975 0.0000 0.0000 62.3996 31.3983 177.4140 505 R 3.9116 8.9882 121.7036 58.4262 30.0961 178.1944 506 S 4.0473 7.6724 112.3257 60.8572 63.5454 175.1340 507 S 4.4070 7.8466 113.9421 59.2197 63.7521 175.9840 508 L 3.4606 7.1714 121.8558 57.3303 41.4554 177.7383 509 P 4.1698 0.0000 0.0000 64.9546 31.5699 177.0009 510 G 3.9062 8.6102 107.1194 45.3473 0.0000 172.3003 511 F 4.9262 7.7340 118.9554 55.9640 40.1305 175.0745 512 Y 4.8610 8.7423 120.9705 56.1664 41.6073 174.6242 513 R 5.2072 8.5032 119.5837 55.2667 33.6382 173.7146 514 T 4.8497 9.1424 119.2874 60.7170 71.0826 174.3532 515 S 4.3652 8.7103 118.5267 59.8129 64.0434 174.6958 516 L 4.1714 7.8042 119.8532 54.9056 41.9773 175.8114 517 T 4.7134 7.8330 109.2086 58.9573 69.5676 174.8946 518 L 3.2312 8.0225 124.2027 55.4248 42.1985 176.6290 519 A 2.0000 5.8000 120.0963 52.3836 16.1208 177.3655 520 A 4.7790 6.7223 117.8992 50.7827 21.6291 176.5910 521 P 4.4130 0.0000 0.0000 65.8381 31.2334 177.8321 522 E 3.8225 8.1746 117.2280 57.5387 30.0553 177.3431 523 A 4.3541 8.1011 119.5627 54.3758 18.7884 178.8167 524 A 3.9318 7.8882 119.8163 55.5654 18.1688 179.7743 525 G 3.6375 8.0527 102.0608 47.9425 0.0000 174.7801 526 E 4.0578 8.1255 121.4784 59.0294 29.7268 178.6849 527 V 3.5834 8.0810 118.4825 66.3279 31.5012 177.8446 528 E 3.8523 8.0602 117.8960 58.9318 28.9692 179.3323 529 R 3.8181 7.6264 118.4299 59.1652 30.2208 178.2970 530 L 3.8971 7.5272 117.0686 57.9722 41.8608 179.3168 531 I 3.1794 7.3235 118.3323 61.6153 37.2118 176.2761 532 G 3.7816 7.9196 107.3890 46.2431 0.0000 173.0430 533 H 4.4510 7.3413 111.5993 54.0183 30.3509 172.2703 534 P 4.3750 0.0000 0.0000 62.1745 31.7409 176.5501 535 L 4.0380 8.0751 122.4072 53.9481 42.0647 175.2142 536 P 4.6990 0.0000 0.0000 61.1021 32.2381 176.0862 537 L 4.2784 8.2036 118.6760 55.5790 43.1256 175.8863 538 R 4.4964 9.4381 118.8637 56.6898 29.4712 177.8470 539 L 4.2261 8.8361 123.6140 56.5142 42.0156 174.8019 540 D 5.4007 7.8188 117.4197 52.7439 45.3612 175.4355 541 A 4.8122 8.4321 119.2433 50.7504 22.9276 175.3124 542 I 5.0856 8.4709 119.9537 59.5020 41.8626 173.8145 543 T 5.0253 8.9168 123.5879 60.4470 70.3500 172.8271 544 G 4.8579 8.4709 114.2787 44.3027 0.0000 170.2920 545 P 5.0256 0.0000 0.0000 62.1985 33.4231 174.5525 *546 E 4.1680 8.4310 118.4999 56.5767 30.9175 179.8974 *547 E 4.1713 8.0406 121.0777 59.8840 30.4606 179.5264 *548 E 4.7319 8.0862 122.4787 55.8386 29.0287 179.4520 549 G 3.8889 8.0359 109.2000 46.1344 0.0000 173.2171 550 G 4.1062 7.2684 114.6745 45.9086 0.0000 173.4472 *551 R 4.4839 8.0123 119.0279 55.7038 30.6846 172.9341 552 L 3.9856 8.7358 122.5212 55.8129 39.3373 174.0166 553 E 4.8680 8.8385 121.0074 54.7408 33.4862 174.5455 554 T 4.7665 8.9380 118.3053 61.8975 71.9555 172.9515 555 I 4.0202 8.4429 126.7808 59.3137 39.7830 174.4371 556 L 4.6525 8.1007 126.9843 52.3629 43.8363 176.3979 557 G 3.9336 8.4400 111.4817 45.5830 0.0000 174.4869 558 W 4.5973 9.0649 122.7962 59.3591 28.8500 177.1378 559 P 4.3175 0.0000 0.0000 65.2488 31.0547 178.1272 560 L 4.1112 7.8748 118.5770 57.9556 41.8558 178.2930 561 A 3.8904 8.2396 121.1782 55.4113 18.1029 178.9850 562 E 4.6230 8.1957 114.6915 56.9263 29.6193 177.5456 563 R 4.6981 7.9286 118.7655 56.0281 31.1872 175.2819 564 T 4.8551 7.3106 105.8981 60.0995 71.6722 173.4680 565 V 3.9254 8.1018 122.7329 61.1155 33.3835 174.5045 566 V 5.0426 8.1422 127.5138 61.1056 33.7648 174.4589 567 I 4.6690 8.4964 119.6853 58.2041 41.3124 172.9447 568 P 4.5040 0.0000 0.0000 63.2014 31.7164 175.6184 569 S 5.1185 8.4289 116.1190 57.1173 64.0834 173.9919 570 A 4.6978 9.4112 125.8619 53.0256 19.1857 178.1612 571 I 3.8884 7.9738 118.3589 60.6655 37.3594 174.2777 572 P 4.8985 0.0000 0.0000 61.5599 33.3077 174.4406 573 T 4.8989 8.2232 108.1798 59.8769 70.7742 172.9627 574 D 4.9805 8.1579 121.0680 51.6446 42.9828 175.2386 575 P 4.4749 0.0000 0.0000 64.5570 31.4343 177.0754 576 R 4.1862 7.6464 117.3958 57.4285 30.6235 175.8581 577 N 4.7995 7.9838 116.3048 51.6074 38.6769 174.3021 578 V 4.2921 7.7121 128.6293 61.4179 32.9121 175.1698 *581 D 4.4667 8.1320 118.1682 53.2868 42.3989 175.5813 582 L 2.7337 8.5704 114.8893 55.3036 43.2220 175.1987 583 D 4.4498 8.2132 125.3653 52.8971 41.8461 174.4064 584 P 4.1897 0.0000 0.0000 65.9899 31.4447 178.7690 585 S 4.1962 7.4542 113.0366 61.2439 62.7938 175.9274 586 S 4.2065 8.1353 114.2977 60.0352 63.1761 174.3689 587 I 3.9592 7.3245 121.9366 59.8110 36.3373 174.4527 588 P 4.2442 0.0000 0.0000 63.1892 32.4591 176.9649 589 D 4.3611 8.6876 120.8956 56.7569 41.6515 178.3972 590 K 4.1020 7.9201 119.0481 59.5898 32.3478 178.7066 591 E 3.9642 8.1246 118.9702 58.9928 29.3906 178.2057 592 Q 3.9824 8.0262 119.1175 58.9300 29.0422 178.1205 593 A 4.1087 7.5529 120.7872 55.2378 18.6590 179.2748 594 I 3.7287 7.6142 116.4395 64.3688 37.1047 177.5108 595 S 3.6214 7.3792 113.4902 57.5427 63.3568 174.2958 596 A 4.3222 7.4537 124.4667 52.1045 18.9672 177.5043 597 L 4.9457 8.1338 118.6336 52.3949 44.7199 173.8263 598 P 4.3013 0.0000 0.0000 63.1993 31.6927 175.3981 599 D 4.1878 7.8443 122.1418 54.0133 40.9416 174.9675 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 400 F 8.32 4.84 0.00 3.07 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 0.00 401 L 7.96 4.43 0.00 1.89 2.02 1.26 0.67 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 0.00 402 G 8.50 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 0.00 0.00 0.00 403 D 8.45 4.73 0.00 2.73 2.64 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 0.00 404 G 8.83 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 0.00 405 G 8.12 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 406 D 8.59 4.82 0.00 2.60 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 407 V 8.48 4.56 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 1.27 0.00 0.00 408 S 8.24 4.57 0.00 3.85 3.61 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 0.00 409 F 8.82 4.66 0.00 3.06 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 0.00 410 S 8.47 4.75 0.00 3.97 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 0.00 411 T 8.59 4.16 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 1.29 0.00 0.00 412 R 7.81 3.96 0.00 1.83 2.00 0.00 3.41 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 413 G 8.02 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 414 T 8.43 4.16 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 415 Q 9.36 4.02 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.37 6.29 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 416 N 8.96 3.98 0.00 3.09 2.97 0.00 0.00 6.76 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 0.00 417 W 7.89 4.65 0.00 3.34 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 0.00 418 T 7.47 4.54 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 1.16 0.00 0.00 419 V 8.04 3.46 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 1.11 0.00 0.00 0.95 0.00 0.00 420 E 7.94 3.84 0.00 1.96 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 421 R 7.43 3.64 0.00 1.11 0.73 0.00 3.01 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.42 0.00 422 L 7.25 3.82 0.00 1.57 1.66 1.28 0.89 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 0.00 423 L 8.09 4.02 0.00 1.79 1.69 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 424 Q 7.89 3.96 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 425 A 8.21 4.12 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 426 H 8.40 4.17 0.00 3.45 3.56 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 427 R 8.13 3.95 0.00 2.05 1.98 0.00 3.20 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.03 0.00 428 Q 8.25 4.03 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.67 0.00 429 L 7.59 4.00 0.00 1.48 1.44 -0.06 0.62 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 0.00 430 E 8.11 4.23 0.00 2.12 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 2.33 2.30 0.00 431 E 7.83 4.33 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 2.35 2.49 0.00 432 R 7.42 4.53 0.00 2.06 2.10 0.00 3.42 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 433 G 8.35 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 434 Y 7.84 4.70 0.00 3.09 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 0.00 435 V 9.03 4.69 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 0.80 0.00 0.00 0.87 0.00 0.00 436 F 9.13 3.76 0.00 2.59 2.83 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 0.00 437 V 9.16 3.97 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 0.56 0.00 0.00 0.89 0.00 0.00 438 G 5.38 3.75 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 0.00 0.00 0.00 439 Y 8.74 5.19 0.00 2.99 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 0.00 440 H 9.62 4.85 0.00 2.97 3.10 0.00 5.76 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 441 G 8.42 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 442 T 8.42 4.81 4.04 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 0.96 0.00 0.00 443 F 8.16 4.90 0.00 3.24 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 444 L 8.86 3.92 0.00 1.84 1.92 1.02 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 445 E 8.47 4.15 0.00 2.27 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.53 0.00 446 A 7.19 3.75 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 447 A 7.31 3.46 0.22 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 0.00 448 Q 7.56 4.14 0.00 2.42 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.71 0.00 0.00 0.00 0.00 0.00 2.51 2.58 0.00 449 S 7.95 4.10 0.00 3.95 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 0.00 450 I 7.36 3.86 1.75 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.42 0.87 0.00 0.00 451 V 7.44 3.38 1.68 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 0.10 0.00 0.00 0.82 0.00 0.00 452 F 7.96 4.94 0.00 3.40 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 453 G 8.71 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 0.00 454 G 7.83 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.02 0.00 522 E 8.17 3.82 0.00 1.98 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 2.31 2.33 0.00 523 A 8.10 4.35 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 524 A 7.89 3.93 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 0.00 525 G 8.05 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 0.00 0.00 0.00 526 E 8.13 4.06 0.00 2.11 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 2.41 2.45 0.00 527 V 8.08 3.58 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 1.01 0.00 0.00 1.27 0.00 0.00 528 E 8.06 3.85 0.00 2.12 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 2.12 2.42 0.00 529 R 7.63 3.82 0.00 1.75 2.08 0.00 3.25 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 530 L 7.53 3.90 0.00 1.47 1.17 1.01 0.83 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 0.00 531 I 7.32 3.18 1.78 0.00 0.00 0.49 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 0.38 0.41 0.00 0.00 532 G 7.92 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 0.00 0.00 0.00 533 H 7.34 4.45 0.00 3.13 3.22 0.00 5.73 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 534 P 0.00 4.38 0.00 2.04 1.97 0.00 3.69 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 535 L 8.08 4.04 0.00 1.39 1.48 0.25 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 536 P 0.00 4.70 0.00 2.19 2.31 0.00 3.36 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 537 L 8.20 4.28 0.00 1.62 1.64 0.86 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 538 R 9.44 4.50 0.00 1.73 1.04 0.00 2.55 0.00 0.00 3.00 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 539 L 8.84 4.23 0.00 1.67 1.72 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 540 D 7.82 5.40 0.00 2.67 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 0.00 541 A 8.43 4.81 0.03 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 0.00 542 I 8.47 5.09 1.92 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.56 1.01 0.00 0.00 543 T 8.92 5.03 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 544 G 8.47 4.86 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 0.00 0.00 0.00 545 P 0.00 5.03 0.00 2.12 2.18 0.00 3.99 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 *546 E 8.43 4.17 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.62 0.00 *547 E 8.04 4.17 0.00 1.98 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 2.19 1.86 0.00 *548 E 8.09 4.73 0.00 1.94 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 549 G 8.04 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 550 G 7.27 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *551 R 8.01 4.48 0.00 1.85 1.77 0.00 3.36 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.22 0.00 552 L 8.74 3.99 0.00 1.84 1.84 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 553 E 8.84 4.87 0.00 2.09 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 2.20 2.32 0.00 554 T 8.94 4.77 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 1.06 0.00 0.00 555 I 8.44 4.02 1.61 0.00 0.00 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 -0.18 0.64 0.37 0.00 0.00 556 L 8.10 4.65 0.00 1.42 1.38 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 557 G 8.44 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 0.00 558 W 9.06 4.60 0.00 3.42 3.14 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 0.00 559 P 0.00 4.32 0.00 2.06 2.15 0.00 3.84 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 2.07 2.20 0.00 560 L 7.87 4.11 0.00 1.70 1.73 0.90 1.07 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 0.00 561 A 8.24 3.89 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 562 E 8.20 4.62 0.00 1.99 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 2.52 2.66 0.00 563 R 7.93 4.70 0.00 1.80 1.94 0.00 3.26 0.00 0.00 3.31 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 564 T 7.31 4.86 4.37 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 1.31 0.00 0.00 565 V 8.10 3.93 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 -0.37 0.00 0.00 -0.40 0.00 0.00 566 V 8.14 5.04 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 0.97 0.00 0.00 0.90 0.00 0.00 567 I 8.50 4.67 1.87 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.03 0.94 0.00 0.00 568 P 0.00 4.50 0.00 0.49 1.49 0.00 2.46 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.76 0.00 569 S 8.43 5.12 0.00 4.28 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 570 A 9.41 4.70 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 0.00 571 I 7.97 3.89 1.97 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 1.39 0.69 0.96 0.00 0.00 572 P 0.00 4.90 0.00 2.26 2.15 0.00 3.79 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 573 T 8.22 4.90 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 1.16 0.00 0.00 574 D 8.16 4.98 0.00 2.85 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 575 P 0.00 4.47 0.00 2.22 2.18 0.00 3.58 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 576 R 7.65 4.19 0.00 1.87 2.04 0.00 3.14 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 577 N 7.98 4.80 0.00 2.72 2.88 0.00 0.00 6.68 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 578 V 7.71 4.29 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 0.81 0.00 0.00 0.99 0.00 0.00 *581 D 8.13 4.47 0.00 2.75 2.53 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 0.00 582 L 8.57 2.73 0.00 0.99 1.28 0.73 0.69 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 0.00 583 D 8.21 4.45 0.00 2.71 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 0.00 0.00 0.00 584 P 0.00 4.19 0.00 2.17 2.07 0.00 3.60 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.08 0.00 585 S 7.45 4.20 0.00 4.25 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 586 S 8.14 4.21 0.00 3.95 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 0.00 587 I 7.32 3.96 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.55 1.00 0.00 0.00 588 P 0.00 4.24 0.00 2.18 2.02 0.00 3.66 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.20 0.00 589 D 8.69 4.36 0.00 2.64 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 0.00 590 K 7.92 4.10 0.00 1.83 1.82 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.48 7.81 591 E 8.12 3.96 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 592 Q 8.03 3.98 0.00 2.21 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 593 A 7.55 4.11 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 0.00 594 I 7.61 3.73 1.84 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 1.34 0.46 0.53 0.00 0.00 595 S 7.38 3.62 0.00 3.75 3.42 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 0.00 596 A 7.45 4.32 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 0.00 597 L 8.13 4.95 0.00 1.66 1.60 1.03 1.42 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 0.00 598 P 0.00 4.30 0.00 2.01 1.89 0.00 3.82 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.91 0.00 599 D 7.84 4.19 0.00 2.57 2.36 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 0.00 * Residues marked with a * may have inaccurate shift predictions.