NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 376 M 4.4386 8.2893 120.3570 54.9337 33.3808 175.1019 377 E 4.0657 8.6076 122.7774 55.6964 30.2557 174.9507 378 L 4.4327 8.1056 120.3377 53.7499 43.6692 177.7771 379 I 3.1233 8.1036 114.7304 59.7830 38.1395 177.0620 380 G 3.5447 8.3126 110.1600 48.2388 0.0000 174.0954 381 D 4.6264 7.4328 115.4688 51.3611 39.5839 175.4836 382 Y 3.8831 7.1287 115.9528 59.4607 36.0270 171.7817 383 S 4.3840 7.7731 115.8040 60.0106 64.0998 173.5659 384 K 4.2232 7.1839 117.6307 55.7756 34.4804 174.0324 385 A 4.5331 8.3115 122.1543 51.4437 18.9983 177.4172 386 F 4.1310 8.6507 118.6903 57.5319 39.6487 175.9325 387 L 4.1701 9.3571 127.5468 57.4606 42.2419 177.3911 388 L 4.2971 7.7194 117.2133 53.3348 42.6112 176.6332 389 Q 4.1804 8.4719 121.2324 56.2546 29.3029 175.7112 390 T 4.9891 8.2649 111.2105 60.1181 71.8426 173.1048 391 V 4.6120 8.5011 115.0118 59.1043 35.4414 175.2451 392 D 4.4600 8.6263 121.7071 54.5648 41.7613 175.3975 393 G 2.7518 7.9050 111.6222 42.9725 0.0000 172.5786 394 K 3.7425 8.3103 120.6354 59.4946 32.3115 176.9080 395 H 4.6392 8.4833 119.7724 54.7177 27.7166 175.9514 396 Q 4.1014 8.7635 125.1503 58.4612 28.6953 177.9319 397 D 4.6195 8.0789 114.9851 53.8389 40.3170 176.3382 398 L 4.4844 7.6472 119.8832 53.5970 43.3148 175.6050 399 K 4.6122 8.1527 119.7876 55.2485 34.0480 175.0663 400 Y 5.4322 8.8967 122.4186 56.2486 41.0268 174.6851 401 I 5.0203 8.7566 115.6765 59.0765 41.6196 175.1771 402 S 4.8808 8.3874 117.6649 56.6237 64.7801 173.3727 403 P 4.5186 0.0000 0.0000 65.7397 30.9180 178.5344 404 E 3.8424 8.1450 117.6791 59.6862 29.5817 178.9463 405 T 3.9295 7.7923 115.3262 66.6514 68.4767 176.4480 406 M 3.8597 8.0971 120.3001 58.6202 32.1598 178.5258 407 V 3.2941 8.0107 118.3158 65.4962 31.4955 177.8710 408 A 3.9066 7.9231 120.8106 54.9440 18.2041 179.6244 409 L 3.9704 7.8668 117.4166 58.0929 41.4599 179.8611 410 L 4.5065 7.8029 117.4748 57.3808 41.5754 178.6313 411 T 4.6047 8.0789 108.0106 61.0478 69.2669 175.2162 412 G 3.9726 8.1720 109.6149 46.4672 0.0000 176.0087 413 K 3.7878 8.1666 122.8471 58.2247 32.3332 177.6219 414 F 4.9709 7.8566 116.4715 57.0456 39.4873 177.3168 415 S 4.4788 8.0200 118.8555 61.1426 62.7076 175.1654 416 N 4.6290 8.1946 116.6275 54.1052 37.9537 175.4464 417 I 4.2484 7.8841 119.0367 61.8957 39.5959 175.0756 418 V 4.6327 8.3384 120.8344 61.4001 31.9109 174.8463 419 D 4.6002 9.1182 128.8711 57.1486 42.2661 175.8641 420 K 4.9017 7.8192 117.2974 55.2482 35.5733 174.2702 421 F 6.0939 8.0339 119.5646 54.2907 41.4814 173.7714 422 V 4.4049 8.4296 119.2500 61.2619 34.8051 174.0215 423 I 4.5740 8.3936 128.4124 60.1287 38.9186 174.9253 424 V 4.1592 8.6493 129.3694 61.2774 32.6158 174.4905 425 D 4.3637 8.7672 130.2938 53.5448 41.7118 175.8053 426 C 4.4134 8.7400 124.0461 59.8432 28.7416 174.4963 427 R 3.8431 7.8675 119.1587 55.1970 30.7798 176.4136 428 Y 3.6894 7.5941 116.8789 56.8740 39.6110 175.3371 429 P 4.5137 0.0000 0.0000 65.4093 31.2519 178.5984 430 Y 4.4469 7.9192 114.5198 60.0070 38.0963 177.9566 431 E 3.7023 6.9145 119.8706 59.1910 29.6278 178.2935 432 Y 3.8417 7.6087 119.4948 60.8468 38.6237 178.1582 433 E 4.1044 8.5907 118.5220 58.7559 29.6080 178.6186 434 G 3.9026 7.6488 103.2277 43.6637 0.0000 171.6851 435 G 3.4201 6.0049 109.0898 42.8114 0.0000 172.5181 436 H 4.3713 7.9172 121.2287 53.1089 32.1481 172.6265 437 I 4.4971 8.1956 120.3677 60.6762 37.5241 176.1732 438 K 4.1001 8.8556 125.3215 58.4937 32.2487 177.6619 439 T 3.5020 8.8887 111.8523 61.4436 67.7528 171.9195 440 A 4.3753 7.9875 124.0798 52.3838 19.3168 177.2039 441 V 4.1047 8.4691 114.0312 59.4311 34.4480 174.7828 442 N 4.4636 7.8359 123.9442 52.0194 39.3838 174.3410 443 L 4.9785 7.7499 128.1332 52.7350 40.5207 175.3501 444 P 4.3770 0.0000 0.0000 64.8418 32.5904 178.1849 445 L 4.5473 7.8481 119.5011 53.3222 43.6032 176.9818 446 E 3.7967 8.6989 123.5933 59.6486 29.3656 179.9014 447 R 4.0282 7.8757 115.3528 59.3359 29.4151 178.4495 448 D 4.4517 8.1034 118.9249 56.7973 41.0403 178.3900 449 A 4.0480 8.2477 121.4839 55.1152 18.4473 179.2942 450 E 4.0096 8.8309 118.3071 59.4458 29.6526 178.9950 451 S 4.0897 8.2196 113.1935 61.4559 62.3086 175.8750 452 F 4.0106 8.3678 122.1764 61.0346 39.2756 176.3706 453 L 4.4128 8.4105 118.0024 55.9013 41.8381 177.9980 454 L 4.6050 8.1715 115.8748 54.3366 43.1281 177.5983 455 K 4.0542 7.9371 120.2654 58.9515 32.2176 177.2902 456 S 4.3848 7.3035 112.6786 54.4476 62.3290 169.9115 457 P 4.3018 0.0000 0.0000 61.6684 31.7079 176.3498 458 I 3.8767 8.6001 123.9174 60.7532 36.3848 175.7086 459 A 4.6494 8.1237 128.5662 50.1140 21.2954 176.6096 460 P 5.6405 0.0000 0.0000 61.9638 30.0768 178.0092 *465 K 4.2854 8.3902 116.2857 56.3338 33.2389 174.0894 466 R 4.6857 8.8907 120.4398 54.8446 32.8084 175.6158 467 V 4.9828 8.3019 120.6739 61.3505 34.1207 174.8116 468 I 5.0807 8.8202 127.2347 59.6199 41.4297 174.1441 469 L 5.2151 8.7714 125.2607 53.0039 44.8836 175.4922 470 I 4.9819 8.6173 123.4778 59.7108 40.3138 174.5285 471 F 5.3117 9.4266 126.6321 56.4651 41.5736 174.6193 472 H 5.1926 8.6867 116.2155 55.0141 32.0721 171.6280 473 C 4.7259 8.4809 116.0994 57.8169 32.7260 175.4392 474 E 3.8130 9.0125 115.2560 58.9598 29.8769 179.1552 475 F 5.0561 8.0593 113.5520 56.4205 40.5119 175.2732 476 S 3.8742 8.1088 115.2815 59.9478 60.2696 172.9233 477 S 4.6996 8.5903 114.3996 59.6426 63.6551 173.5275 478 E 4.6387 7.8268 115.9264 57.8704 31.4929 178.2493 479 R 4.0613 7.9449 117.0979 59.3062 30.3528 179.3128 480 G 3.6043 8.0428 104.7554 47.5151 0.0000 173.6629 481 P 4.1333 0.0000 0.0000 64.9685 31.3238 178.6383 482 R 3.8408 8.0907 117.4439 59.6971 29.9199 178.3113 483 M 4.0591 8.0010 118.0151 58.5238 32.3290 177.6774 484 C 2.4500 7.4926 118.8287 62.0517 31.6567 175.8893 485 R 3.8635 7.8328 119.5700 58.9991 29.5907 178.8047 486 F 4.1878 8.3125 120.5285 61.4510 39.4076 177.2512 487 I 3.4189 7.9405 119.6289 64.2606 36.7951 178.4244 488 R 3.9019 7.7963 119.1973 59.1860 29.8762 178.0665 489 E 3.8721 8.1274 119.1238 59.5446 29.7735 179.1849 490 R 3.8234 7.7146 117.9816 59.0039 29.7969 178.5417 491 D 4.4202 8.2491 117.5424 57.4631 41.6722 178.2230 492 R 4.0386 8.3444 118.6893 59.2679 29.8592 178.8905 493 A 4.0887 7.8631 119.4360 54.5963 18.3501 179.0688 494 V 4.2714 7.3611 107.8709 60.3710 32.1254 175.2536 495 N 5.0068 7.3222 115.0570 51.3250 42.4549 173.4547 496 D 4.6828 8.2270 119.5550 52.9608 41.8250 175.8762 497 Y 4.2460 8.7067 125.5500 57.8813 39.4171 173.8603 498 P 3.9074 0.0000 0.0000 62.1079 31.6824 175.3509 499 S 4.2457 7.3849 114.8400 59.2815 63.1876 173.7653 500 L 4.5968 7.4916 121.5756 53.5030 45.5060 176.0260 501 Y 4.0590 8.9756 119.8949 60.3302 37.8229 176.0113 502 Y 4.8403 8.4481 117.5713 55.3660 38.2998 174.1762 503 P 4.1329 0.0000 0.0000 64.1257 32.4962 176.1748 504 E 4.6922 7.8077 120.9147 54.5793 31.8365 174.3990 505 M 5.4667 8.5433 125.5983 53.9271 36.2416 174.2975 506 Y 5.0811 9.2497 118.8648 56.3868 43.0857 174.1129 507 I 4.9152 8.5556 121.4978 59.4102 40.3352 175.0716 508 L 4.5787 8.8063 129.4072 53.9598 42.7724 176.1075 509 K 4.3669 8.9618 129.4711 58.3212 32.4301 177.1093 510 G 3.9617 9.1302 114.8474 44.1967 0.0000 174.4566 511 G 4.1030 8.0712 108.7694 45.4212 0.0000 173.3598 512 Y 3.9323 8.2639 118.3372 60.3338 39.0565 179.1419 513 K 2.9738 7.8332 120.4186 58.9842 32.2111 177.7301 514 E 4.2961 7.6588 116.2727 57.4176 30.0005 178.0810 515 F 4.0840 7.7163 120.9660 60.9056 39.2708 176.8033 516 F 3.9649 7.7244 120.6286 60.8101 38.8916 175.2937 517 P 3.8351 0.0000 0.0000 64.8972 31.1555 177.5619 518 Q 4.0109 6.7356 117.3276 57.0709 30.7860 175.8339 519 H 4.8036 7.4490 115.6151 53.1356 29.5824 172.2532 520 P 4.1876 0.0000 0.0000 65.6914 31.6461 178.2844 521 N 4.5983 8.1654 114.2851 54.4812 39.1601 174.4979 522 F 4.7428 8.5731 115.4573 58.1160 40.2414 174.7610 523 C 5.7218 8.2267 116.1067 58.2640 31.9956 173.5827 524 E 4.7401 9.0486 119.0038 54.6141 32.7331 173.3472 525 P 4.6162 0.0000 0.0000 61.9994 33.3217 176.4429 526 Q 4.7801 8.2918 119.8098 54.3249 26.9633 173.9075 527 D 4.3780 7.2057 119.8434 53.4087 44.8214 172.9120 528 Y 4.8226 7.9456 120.8970 56.0789 40.9495 173.7852 529 R 4.1985 8.3846 127.8863 53.5461 31.3002 173.6254 530 P 4.8012 0.0000 0.0000 61.8232 32.1320 177.4331 531 M 4.0353 8.9436 121.2387 58.7247 32.1760 176.8768 532 N 4.9080 8.1183 113.5959 52.8753 37.9211 174.2151 533 H 4.1173 8.2169 119.4305 57.0217 30.2327 175.9359 534 E 3.9270 8.9424 125.9835 59.4067 29.3828 177.7202 535 A 4.3124 8.3492 118.4013 52.5416 19.3084 177.1517 536 F 5.3309 8.1868 114.4563 55.7771 39.9972 177.7414 537 K 4.0228 8.1873 123.4038 59.7576 31.6740 178.6637 538 D 4.3327 7.8955 118.7122 57.2926 40.8691 178.4129 539 E 3.9610 7.9689 118.7002 59.1325 29.4553 179.0057 540 L 4.2566 7.9018 120.3959 58.1959 42.3691 179.2265 541 K 3.9284 7.8324 118.2868 59.7399 31.7703 179.3419 542 T 3.8400 7.9365 115.1053 66.6721 68.6008 176.1039 543 F 4.0763 8.2939 122.2954 61.3695 39.4544 177.3955 544 R 3.7904 7.9800 117.5851 59.0350 29.6022 178.2804 545 L 4.3074 7.4719 115.5028 55.6817 41.6681 177.5137 546 K 4.3040 7.5971 118.3047 56.3024 32.9971 176.8335 547 T 4.1125 7.2911 109.4798 60.8499 69.5609 174.8985 548 R 3.8959 8.2517 122.3433 58.8968 30.4458 176.3800 549 S 4.1790 7.3679 109.5504 56.4659 65.2943 173.5451 550 W 4.7729 7.7386 121.3363 56.7457 28.0954 174.9504 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 376 M 8.29 4.44 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.63 0.00 377 E 8.61 4.07 0.00 2.32 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 0.00 2.59 2.56 0.00 378 L 8.11 4.43 0.00 1.86 1.83 1.02 0.86 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 0.00 379 I 8.10 3.12 1.53 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 1.19 1.08 -0.18 0.00 0.00 380 G 8.31 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 0.00 381 D 7.43 4.63 0.00 2.49 2.45 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 0.00 382 Y 7.13 3.88 0.00 3.05 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 0.00 383 S 7.77 4.38 0.00 3.86 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 0.00 384 K 7.18 4.22 0.00 1.87 1.88 0.00 1.44 0.00 0.00 1.79 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.24 1.27 7.81 385 A 8.31 4.53 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 386 F 8.65 4.13 0.00 3.12 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 0.00 387 L 9.36 4.17 0.00 1.55 1.75 0.97 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 388 L 7.72 4.30 0.00 1.12 1.19 0.04 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 389 Q 8.47 4.18 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 390 T 8.26 4.99 4.39 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 1.37 0.00 0.00 391 V 8.50 4.61 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 0.68 0.00 0.00 1.00 0.00 0.00 392 D 8.63 4.46 0.00 2.61 2.48 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 0.00 393 G 7.90 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 0.00 0.00 0.00 394 K 8.31 3.74 0.00 1.64 1.80 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.53 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.23 1.39 7.81 395 H 8.48 4.64 0.00 3.50 3.36 0.00 5.68 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 396 Q 8.76 4.10 0.00 2.07 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.51 2.31 0.00 397 D 8.08 4.62 0.00 2.81 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 398 L 7.65 4.48 0.00 1.71 1.45 0.80 0.81 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 0.00 399 K 8.15 4.61 0.00 1.35 1.63 0.00 1.21 0.00 0.00 1.60 0.00 0.00 2.13 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.98 0.21 7.81 400 Y 8.90 5.43 0.00 3.15 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 401 I 8.76 5.02 1.73 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.30 0.55 0.00 0.00 402 S 8.39 4.88 0.00 4.03 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 0.00 403 P 0.00 4.52 0.00 2.16 2.16 0.00 3.62 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.28 0.00 404 E 8.14 3.84 0.00 2.01 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 2.35 2.36 0.00 405 T 7.79 3.93 4.31 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 1.06 0.00 0.00 406 M 8.10 3.86 0.00 2.37 1.98 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.11 0.00 407 V 8.01 3.29 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 0.49 0.00 0.00 -0.04 0.00 0.00 408 A 7.92 3.91 1.43 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 0.00 0.00 409 L 7.87 3.97 0.00 1.44 0.39 0.39 0.32 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 0.00 410 L 7.80 4.51 0.00 1.85 2.09 1.06 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 411 T 8.08 4.60 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 1.47 0.00 0.00 412 G 8.17 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 0.00 0.00 0.00 413 K 8.17 3.79 0.00 1.46 1.33 0.00 1.46 0.00 0.00 0.96 0.00 0.00 2.48 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.67 1.08 7.81 414 F 7.86 4.97 0.00 3.12 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 0.00 415 S 8.02 4.48 0.00 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 0.00 416 N 8.19 4.63 0.00 2.87 3.01 0.00 0.00 5.84 7.81 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 0.00 417 I 7.88 4.25 2.01 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.77 0.96 0.00 0.00 418 V 8.34 4.63 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 0.99 0.00 0.00 0.97 0.00 0.00 419 D 9.12 4.60 0.00 2.89 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 0.00 420 K 7.82 4.90 0.00 1.83 1.61 0.00 1.69 0.00 0.00 1.88 0.00 0.00 2.87 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.40 1.31 7.81 421 F 8.03 6.09 0.00 3.11 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 0.00 422 V 8.43 4.40 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 1.06 0.00 0.00 0.99 0.00 0.00 423 I 8.39 4.57 1.91 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.81 0.93 0.00 0.00 424 V 8.65 4.16 1.44 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 0.86 0.00 0.00 0.37 0.00 0.00 425 D 8.77 4.36 0.00 2.74 2.42 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 0.00 426 C 8.74 4.41 0.00 2.92 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 0.00 427 R 7.87 3.84 0.00 1.66 1.73 0.00 3.09 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.50 0.00 428 Y 7.59 3.69 0.00 2.19 2.16 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 0.00 429 P 0.00 4.51 0.00 2.23 2.14 0.00 3.68 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.95 0.00 430 Y 7.92 4.45 0.00 2.89 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 431 E 6.91 3.70 0.00 1.73 1.69 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 2.11 1.47 0.00 432 Y 7.61 3.84 0.00 2.84 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 0.00 433 E 8.59 4.10 0.00 2.08 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 2.43 2.56 0.00 434 G 7.65 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 0.00 435 G 6.00 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 0.00 0.00 0.00 436 H 7.92 4.37 0.00 3.02 2.81 0.00 5.27 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 437 I 8.20 4.50 1.87 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.68 0.87 0.00 0.00 438 K 8.86 4.10 0.00 1.84 1.85 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.69 1.53 7.81 439 T 8.89 3.50 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 1.26 0.00 0.00 440 A 7.99 4.38 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 0.00 441 V 8.47 4.10 1.45 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 0.54 0.00 0.00 0.47 0.00 0.00 442 N 7.84 4.46 0.00 1.44 1.89 0.00 0.00 6.96 6.66 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 0.00 443 L 7.75 4.98 0.00 1.41 1.48 0.47 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 444 P 0.00 4.38 0.00 2.30 2.22 0.00 3.76 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.82 0.00 445 L 7.85 4.55 0.00 1.90 1.61 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 446 E 8.70 3.80 0.00 1.54 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 1.70 2.05 0.00 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0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.35 7.81 456 S 7.30 4.38 0.00 3.71 3.56 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 0.00 457 P 0.00 4.30 0.00 1.43 1.17 0.00 3.40 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.37 0.00 458 I 8.60 3.88 2.11 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.28 0.96 0.00 0.00 459 A 8.12 4.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 460 P 0.00 5.64 0.00 2.20 1.54 0.00 3.39 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 *465 K 8.39 4.29 0.00 1.71 2.07 0.00 1.75 0.00 0.00 1.90 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.50 7.81 466 R 8.89 4.69 0.00 1.76 1.85 0.00 3.08 0.00 0.00 3.30 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 467 V 8.30 4.98 2.16 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 0.00 476 S 8.11 3.87 0.00 4.25 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 477 S 8.59 4.70 0.00 3.94 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 0.00 478 E 7.83 4.64 0.00 2.07 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 2.37 2.37 0.00 479 R 7.94 4.06 0.00 1.82 1.98 0.00 2.95 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.75 0.00 480 G 8.04 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 481 P 0.00 4.13 0.00 2.10 1.95 0.00 3.69 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 2.51 2.19 0.00 482 R 8.09 3.84 0.00 1.98 2.10 0.00 3.10 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 483 M 8.00 4.06 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.81 0.00 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0.00 3.49 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 1.80 1.83 0.00 493 A 7.86 4.09 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 0.00 494 V 7.36 4.27 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 0.89 0.00 0.00 1.21 0.00 0.00 495 N 7.32 5.01 0.00 2.70 2.59 0.00 0.00 6.86 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 0.00 496 D 8.23 4.68 0.00 2.66 2.59 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 0.00 497 Y 8.71 4.25 0.00 2.92 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 498 P 0.00 3.91 0.00 1.48 0.90 0.00 3.59 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 499 S 7.38 4.25 0.00 3.82 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 0.00 500 L 7.49 4.60 0.00 1.38 1.55 0.78 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 501 Y 8.98 4.06 0.00 2.76 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 502 Y 8.45 4.84 0.00 3.15 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 503 P 0.00 4.13 0.00 2.00 2.11 0.00 3.66 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 1.97 1.82 0.00 504 E 7.81 4.69 0.00 2.01 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 2.27 2.00 0.00 505 M 8.54 5.47 0.00 2.19 1.98 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.72 0.00 506 Y 9.25 5.08 0.00 2.83 2.79 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 0.00 507 I 8.56 4.92 0.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.43 0.83 0.00 0.00 508 L 8.81 4.58 0.00 1.78 1.61 1.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 509 K 8.96 4.37 0.00 1.93 1.96 0.00 1.80 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.48 1.50 7.81 510 G 9.13 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 0.00 0.00 0.00 511 G 8.07 4.10 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 0.00 0.00 0.00 512 Y 8.26 3.93 0.00 3.01 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 0.00 513 K 7.83 2.97 0.00 1.49 2.00 0.00 2.08 0.00 0.00 1.76 0.00 0.00 3.22 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.56 1.98 7.81 514 E 7.66 4.30 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 515 F 7.72 4.08 0.00 3.18 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 0.00 516 F 7.72 3.96 0.00 2.08 2.58 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 0.00 517 P 0.00 3.84 0.00 2.12 2.06 0.00 3.51 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 518 Q 6.74 4.01 0.00 1.72 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.31 0.00 0.00 0.00 0.00 0.00 2.14 2.35 0.00 519 H 7.45 4.80 0.00 2.09 3.06 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 0.00 520 P 0.00 4.19 0.00 2.27 1.70 0.00 3.49 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.71 0.00 521 N 8.17 4.60 0.00 2.66 2.76 0.00 0.00 6.87 7.02 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 0.00 522 F 8.57 4.74 0.00 3.49 3.36 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 0.00 523 C 8.23 5.72 0.00 3.32 3.21 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 0.00 524 E 9.05 4.74 0.00 1.90 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 525 P 0.00 4.62 0.00 2.12 2.21 0.00 3.54 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.93 0.00 526 Q 8.29 4.78 0.00 2.19 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.74 0.00 0.00 0.00 0.00 0.00 2.72 2.43 0.00 527 D 7.21 4.38 0.00 2.59 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 0.00 528 Y 7.95 4.82 0.00 2.32 2.55 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 0.00 529 R 8.38 4.20 0.00 1.56 1.57 0.00 3.06 0.00 0.00 2.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.21 0.00 530 P 0.00 4.80 0.00 2.16 2.02 0.00 3.77 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.02 0.00 531 M 8.94 4.04 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.70 0.00 532 N 8.12 4.91 0.00 2.96 3.00 0.00 0.00 5.94 7.90 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 0.00 533 H 8.22 4.12 0.00 3.42 3.42 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 534 E 8.94 3.93 0.00 1.97 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 2.33 2.32 0.00 535 A 8.35 4.31 1.14 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 0.00 0.00 536 F 8.19 5.33 0.00 2.84 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 537 K 8.19 4.02 0.00 1.76 1.85 0.00 1.66 0.00 0.00 1.82 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.70 7.81 538 D 7.90 4.33 0.00 2.59 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 0.00 539 E 7.97 3.96 0.00 1.83 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 2.51 2.45 0.00 540 L 7.90 4.26 0.00 1.95 1.94 1.19 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 541 K 7.83 3.93 0.00 1.91 1.77 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.63 7.81 542 T 7.94 3.84 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 1.23 0.00 0.00 543 F 8.29 4.08 0.00 3.15 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 544 R 7.98 3.79 0.00 1.79 1.90 0.00 3.20 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.85 0.00 545 L 7.47 4.31 0.00 1.59 1.70 0.83 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 546 K 7.60 4.30 0.00 1.30 1.60 0.00 1.54 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.35 7.81 547 T 7.29 4.11 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 1.12 0.00 0.00 548 R 8.25 3.90 0.00 1.67 1.85 0.00 3.18 0.00 0.00 3.06 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.49 0.00 549 S 7.37 4.18 0.00 3.64 3.55 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 0.00 550 W 7.74 4.77 0.00 3.31 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 * Residues marked with a * may have inaccurate shift predictions.