NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 449 K 4.3556 8.2993 120.0108 56.1742 33.7563 175.3665 450 P 5.2728 0.0000 0.0000 62.7861 33.4151 175.8520 451 G 4.4298 8.7163 107.3463 45.9320 0.0000 171.9660 452 K 5.3604 8.7439 120.2703 54.3074 34.6451 176.0181 453 A 4.7837 8.8292 129.3583 52.2009 19.5877 176.5252 454 T 4.8578 9.7960 112.5077 59.7477 72.5579 172.6686 455 G 4.4999 8.4290 109.5517 43.9518 0.0000 173.3507 456 K 4.2355 9.3596 121.3955 55.7479 33.6572 178.6190 457 G 4.0128 8.5546 107.1460 45.8930 0.0000 173.3663 458 K 4.3761 8.2640 119.3966 54.8371 36.6054 172.6441 459 P 4.7566 0.0000 0.0000 62.6406 32.0260 176.1872 460 V 4.6474 8.0379 115.1887 59.4350 35.8281 175.8381 461 N 4.8981 8.4881 122.6586 53.2864 36.4802 175.6842 462 N 4.8515 8.7981 115.5168 52.6034 38.2869 175.4018 463 K 4.6126 7.5946 118.7601 55.8125 33.0975 178.0216 464 W 4.6011 7.8452 128.4751 61.0569 30.9568 176.5018 465 L 4.6457 7.5274 114.7219 53.9604 41.3054 178.4205 466 N 4.3584 8.0706 118.7457 56.2418 38.6666 176.1471 467 N 4.8376 7.9555 114.2097 52.9881 38.2908 175.7883 468 A 4.4385 8.0261 120.6482 53.9400 18.9152 179.5610 469 G 4.0667 8.0117 103.8270 44.6127 0.0000 173.2592 470 K 4.6602 7.2296 118.0265 55.8580 36.6265 175.7733 471 D 4.3129 8.2517 120.8596 56.1743 39.2092 175.4660 472 L 4.3040 8.8787 128.2789 55.3389 42.1565 176.6533 473 G 3.8529 7.7732 105.3864 44.4527 0.0000 172.8820 474 S 4.6806 8.3301 114.6595 57.4129 64.1440 172.9406 475 P 4.9057 0.0000 0.0000 62.1955 33.1793 175.8120 476 V 4.1832 8.3779 120.4174 61.8733 32.5196 173.3429 477 P 4.6163 0.0000 0.0000 63.3055 31.7167 176.7543 478 D 4.5762 9.2611 127.0807 56.1592 38.7981 179.3833 479 R 3.8454 7.8540 117.5705 59.1197 30.4524 178.6047 480 I 3.7162 7.4933 118.5909 64.2276 37.0428 178.2311 481 A 4.1234 8.2296 121.9193 55.2275 18.0182 179.3629 482 N 4.4039 8.3438 113.9345 55.5735 38.6529 176.9311 483 K 4.2686 7.6516 118.0539 57.3560 32.8259 177.7917 484 L 4.6007 7.6579 117.9372 54.2782 43.1367 176.3611 485 R 4.2694 7.6737 118.7146 58.2241 30.2584 176.3326 486 D 4.6192 8.9317 122.4926 54.5790 40.0549 174.1476 487 K 4.3320 7.7403 119.4934 55.3016 33.7246 176.0819 488 E 5.1593 8.1379 123.9144 55.4346 31.0689 175.6229 489 F 4.8852 8.0438 121.2623 55.9619 42.8120 175.9671 490 K 4.1157 8.9221 122.3432 58.6919 32.5115 177.2188 491 S 4.9232 7.5323 113.5812 57.3124 66.4249 175.9659 492 F 4.4943 8.8243 123.3692 61.4821 39.0854 176.4506 493 D 4.4606 8.4277 118.2997 57.4133 40.5851 178.1430 494 D 4.3409 7.9579 117.9761 57.4806 41.3196 177.9411 495 F 2.9712 7.9532 121.0267 60.8299 39.1428 176.9437 496 R 3.4684 8.1745 118.3749 59.2518 29.8453 178.5694 497 K 4.3431 7.8705 119.3711 59.1214 32.1635 179.5102 498 K 4.1820 8.0944 119.9664 58.6419 31.9619 179.2967 499 F 3.6429 7.6888 120.9664 61.0252 39.2916 177.4115 500 W 4.2149 8.0863 118.5560 59.5902 28.2907 178.4279 501 E 4.1736 8.5733 119.1589 59.5213 28.8911 179.2491 502 E 3.8795 8.0383 118.6001 59.3192 29.2517 179.5573 503 V 3.4407 7.3950 118.3254 65.7908 31.3224 178.1306 504 S 4.3344 7.7564 114.1960 60.1265 62.9424 175.8808 505 K 4.3731 7.6641 121.1593 56.8050 32.2986 176.1684 506 D 4.4759 7.4877 119.6772 52.8032 41.0889 174.5573 507 P 4.2511 0.0000 0.0000 66.1206 31.1829 178.4704 508 E 3.9791 8.2038 114.7987 58.9591 29.5374 178.9233 509 L 4.3155 8.0524 118.9377 57.5359 42.0097 179.2130 510 S 4.4321 8.3799 115.1946 61.5819 62.5435 176.5514 511 K 4.2156 7.7925 119.6593 58.1997 31.8356 178.0107 512 Q 4.3281 7.9887 117.2885 54.7538 29.4106 175.1488 513 F 4.8694 7.8661 119.9772 54.7535 41.8638 175.8649 514 S 4.3298 8.7724 120.2816 58.4643 64.4507 175.4648 515 R 3.8868 8.5256 121.1401 59.6463 29.7175 177.9110 516 N 4.2755 8.1131 116.1733 56.7899 39.0941 176.3289 517 N 4.2847 7.9270 117.9202 56.5770 38.7333 177.1232 518 N 4.3440 8.4288 117.7677 56.3188 37.0920 177.2543 519 D 4.3358 8.0260 120.3777 57.3647 40.8587 178.9474 520 R 4.0205 7.8726 118.4948 59.6822 30.1241 179.1577 521 M 4.4632 7.9677 119.5722 57.6546 31.6733 178.8020 522 K 4.1582 7.8235 117.5035 58.2193 32.2034 177.9620 523 V 4.2338 7.2806 110.2568 60.8605 32.1118 176.5334 524 G 4.0972 8.3409 109.8073 44.7659 0.0000 173.8134 525 K 4.3315 8.1532 119.7704 55.6664 33.4475 176.6018 526 A 2.8280 8.1538 124.9570 50.5985 19.3609 175.7715 527 P 4.2451 0.0000 0.0000 62.2996 32.8920 175.7898 528 K 4.5732 8.9128 122.8228 56.3183 32.8439 177.3365 529 T 3.8309 7.8323 120.0199 60.9713 68.9185 174.0059 530 R 4.1671 8.2688 121.4690 55.9672 30.6269 178.2787 531 T 3.8748 8.3602 110.3697 64.5430 68.8317 175.2641 532 Q 4.2160 7.9466 117.3889 56.9954 29.4540 175.5041 533 D 4.8085 7.7874 118.1578 54.4570 42.2390 176.7735 534 V 4.1355 7.4771 113.0210 60.6838 33.9702 175.8229 535 S 4.2241 8.8549 116.1452 56.6084 64.5175 175.4595 536 G 3.8157 8.8198 119.7085 46.8138 0.0000 175.5276 537 K 4.0101 8.8676 124.6695 58.0115 32.2656 176.8717 538 R 4.1417 8.0586 118.6374 56.0898 29.1663 176.4080 539 T 4.4610 8.3244 116.1990 61.4844 68.5476 173.2802 540 S 5.0382 7.5644 115.4166 57.3153 65.0783 174.0030 541 F 4.1850 8.4531 121.1665 57.9770 39.4237 174.7159 542 E 5.0693 9.6719 121.6081 54.7172 33.3889 174.6990 543 L 5.1858 8.7256 121.1635 53.6875 43.4132 175.4774 544 H 4.8989 9.4697 124.6924 54.6647 32.0832 173.1994 545 Q 4.7505 8.2148 125.8265 54.2940 30.7929 174.1711 546 E 4.5255 9.2212 127.9481 55.1305 30.6200 176.2563 547 K 4.2012 8.4061 119.7470 55.1920 34.8490 173.2081 548 P 4.3404 0.0000 0.0000 62.6177 32.0501 176.3354 549 I 3.8384 8.4211 120.7706 64.4702 37.7332 177.9429 550 S 3.7594 8.0702 111.7898 60.6520 61.8917 175.1259 *555 V 3.7333 8.2225 127.6152 62.4336 32.0463 173.8079 556 Y 4.3300 7.8080 125.1412 55.9028 38.2585 173.7630 557 D 4.8710 7.6996 120.0100 53.1119 40.6151 176.5344 558 M 4.2206 8.9352 126.3848 57.0092 31.9527 177.2074 559 D 4.7743 8.3710 117.9853 54.5701 41.6322 176.3835 560 N 5.0632 8.8976 116.7773 52.6573 40.6650 173.3726 561 I 5.0852 7.7831 119.9498 59.5431 39.6701 174.9796 562 S 4.9099 9.1185 120.6495 56.6325 67.3710 172.7199 563 V 4.7912 8.9835 121.0470 61.7836 32.8533 175.1700 564 V 5.7748 9.3870 120.6081 58.6102 36.4805 174.5772 565 T 4.4160 8.3794 111.9231 60.4452 70.2550 173.8255 566 P 4.2451 0.0000 0.0000 65.8930 31.1120 178.5139 567 K 3.8155 8.0396 117.9522 59.8034 32.1468 178.8574 568 R 3.8994 8.1117 118.7221 59.5689 30.0442 177.9320 569 H 4.3592 8.7420 118.6862 59.0129 29.5801 177.4374 570 I 3.7468 7.6106 121.2527 64.2903 37.1707 177.7688 571 D 4.4858 7.8098 119.5237 57.3779 40.7930 178.5636 572 I 3.6951 7.6351 120.2881 64.9177 36.8861 178.0494 573 H 4.8487 7.6866 113.2475 55.6780 28.6160 176.2700 574 R 4.5706 8.0652 115.9667 56.0595 29.9720 176.0451 575 G 3.9067 7.8066 109.0629 45.4061 0.0000 174.5557 576 K 4.2310 7.9048 122.5564 56.5714 31.4446 176.0449 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 449 K 8.30 4.36 0.00 1.93 1.96 0.00 1.63 0.00 0.00 1.83 0.00 0.00 3.15 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.54 7.81 450 P 0.00 5.27 0.00 2.25 2.16 0.00 3.47 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.93 0.00 451 G 8.72 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 0.00 0.00 0.00 0.00 452 K 8.74 5.36 0.00 1.80 1.75 0.00 1.94 0.00 0.00 1.73 0.00 0.00 2.76 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.37 7.81 453 A 8.83 4.78 1.65 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 0.00 0.00 454 T 9.80 4.86 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 0.00 455 G 8.43 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.36 4.24 0.00 1.81 1.87 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.15 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.39 7.81 457 G 8.55 4.01 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 0.00 458 K 8.26 4.38 0.00 1.86 1.69 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.32 1.33 7.81 459 P 0.00 4.76 0.00 2.17 2.05 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 460 V 8.04 4.65 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 0.83 0.00 0.00 0.47 0.00 0.00 461 N 8.49 4.90 0.00 2.84 2.68 0.00 0.00 6.02 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 462 N 8.80 4.85 0.00 2.85 2.96 0.00 0.00 5.65 7.13 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 0.00 463 K 7.59 4.61 0.00 1.81 2.03 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 3.43 0.00 0.00 0.00 0.00 1.43 1.34 7.81 464 W 7.85 4.60 0.00 3.19 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 465 L 7.53 4.65 0.00 1.44 1.27 -0.13 -0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 466 N 8.07 4.36 0.00 2.90 2.90 0.00 0.00 6.83 7.30 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 0.00 467 N 7.96 4.84 0.00 2.91 3.04 0.00 0.00 6.10 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 468 A 8.03 4.44 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 469 G 8.01 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 0.00 470 K 7.23 4.66 0.00 1.89 1.86 0.00 1.66 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.44 7.81 471 D 8.25 4.31 0.00 2.86 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 0.00 0.00 0.00 472 L 8.88 4.30 0.00 1.62 1.72 0.88 0.94 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 0.00 473 G 7.77 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 0.00 474 S 8.33 4.68 0.00 3.49 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 0.00 475 P 0.00 4.91 0.00 2.19 2.16 0.00 4.04 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.10 0.00 476 V 8.38 4.18 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 1.19 0.00 0.00 1.07 0.00 0.00 477 P 0.00 4.62 0.00 1.75 1.55 0.00 3.74 0.00 0.00 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.17 0.00 478 D 9.26 4.58 0.00 2.82 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 0.00 479 R 7.85 3.85 0.00 1.64 1.94 0.00 3.20 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.74 0.00 480 I 7.49 3.72 1.94 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.76 0.63 0.00 0.00 481 A 8.23 4.12 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 0.00 482 N 8.34 4.40 0.00 2.81 2.89 0.00 0.00 7.04 8.41 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 0.00 483 K 7.65 4.27 0.00 1.84 1.82 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.55 7.81 484 L 7.66 4.60 0.00 1.85 1.96 0.88 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 485 R 7.67 4.27 0.00 2.00 1.90 0.00 3.39 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 486 D 8.93 4.62 0.00 2.89 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 0.00 487 K 7.74 4.33 0.00 1.78 1.33 0.00 1.63 0.00 0.00 1.46 0.00 0.00 2.77 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.61 7.81 488 E 8.14 5.16 0.00 1.88 1.66 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 0.00 2.15 2.09 0.00 489 F 8.04 4.89 0.00 2.09 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 0.00 490 K 8.92 4.12 0.00 1.86 1.94 0.00 1.78 0.00 0.00 1.80 0.00 0.00 2.86 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.54 7.81 491 S 7.53 4.92 0.00 4.16 4.06 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 0.00 492 F 8.82 4.49 0.00 3.21 3.23 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 0.00 493 D 8.43 4.46 0.00 2.83 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 0.00 494 D 7.96 4.34 0.00 2.85 3.03 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 0.00 495 F 7.95 2.97 0.00 2.25 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 0.00 496 R 8.17 3.47 0.00 1.70 2.05 0.00 3.47 0.00 0.00 3.38 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.79 0.00 497 K 7.87 4.34 0.00 1.89 1.89 0.00 1.78 0.00 0.00 1.80 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.77 1.56 7.81 498 K 8.09 4.18 0.00 1.66 1.93 0.00 1.75 0.00 0.00 1.89 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.82 1.91 7.81 499 F 7.69 3.64 0.00 2.09 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 0.00 500 W 8.09 4.21 0.00 3.43 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 501 E 8.57 4.17 0.00 2.23 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.59 0.00 502 E 8.04 3.88 0.00 1.86 1.78 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 2.39 2.35 0.00 503 V 7.40 3.44 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 1.16 0.00 0.00 0.39 0.00 0.00 504 S 7.76 4.33 0.00 4.08 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 0.00 505 K 7.66 4.37 0.00 1.87 1.86 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.56 7.81 506 D 7.49 4.48 0.00 2.54 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 507 P 0.00 4.25 0.00 2.18 2.09 0.00 3.62 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 508 E 8.20 3.98 0.00 2.01 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 2.38 0.00 509 L 8.05 4.32 0.00 1.82 1.79 0.37 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 510 S 8.38 4.43 0.00 3.91 4.01 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 0.00 511 K 7.79 4.22 0.00 1.69 1.89 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.73 7.81 512 Q 7.99 4.33 0.00 1.89 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.57 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 513 F 7.87 4.87 0.00 3.14 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 514 S 8.77 4.33 0.00 4.08 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 0.00 515 R 8.53 3.89 0.00 1.96 1.99 0.00 3.25 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.77 0.00 516 N 8.11 4.28 0.00 2.84 2.81 0.00 0.00 7.18 6.71 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 0.00 517 N 7.93 4.28 0.00 3.06 2.90 0.00 0.00 7.08 6.81 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 0.00 518 N 8.43 4.34 0.00 2.97 2.89 0.00 0.00 7.07 7.60 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 0.00 519 D 8.03 4.34 0.00 2.94 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 0.00 520 R 7.87 4.02 0.00 1.91 1.87 0.00 3.08 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.84 0.00 521 M 7.97 4.46 0.00 2.28 2.03 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.19 0.00 522 K 7.82 4.16 0.00 1.94 1.87 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.65 7.81 523 V 7.28 4.23 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 0.68 0.00 0.00 1.01 0.00 0.00 524 G 8.34 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 0.00 525 K 8.15 4.33 0.00 1.78 1.65 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.38 7.81 526 A 8.15 2.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 527 P 0.00 4.25 0.00 2.14 1.79 0.00 2.25 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 1.11 1.32 0.00 528 K 8.91 4.57 0.00 1.72 1.70 0.00 1.51 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.51 7.81 529 T 7.83 3.83 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 1.03 0.00 0.00 530 R 8.27 4.17 0.00 1.87 1.81 0.00 3.18 0.00 0.00 3.40 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.64 0.00 531 T 8.36 3.87 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 1.19 0.00 0.00 532 Q 7.95 4.22 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.17 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 533 D 7.79 4.81 0.00 2.69 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 0.00 534 V 7.48 4.14 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 0.56 0.00 0.00 0.92 0.00 0.00 535 S 8.85 4.22 0.00 3.81 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 536 G 8.82 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 0.00 537 K 8.87 4.01 0.00 1.75 1.87 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.40 7.81 538 R 8.06 4.14 0.00 2.00 2.01 0.00 3.42 0.00 0.00 3.11 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.56 0.00 539 T 8.32 4.46 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 1.21 0.00 0.00 540 S 7.56 5.04 0.00 3.76 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.45 4.18 0.00 2.82 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 0.00 542 E 9.67 5.07 0.00 2.00 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 2.43 0.00 543 L 8.73 5.19 0.00 1.89 1.85 0.55 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 544 H 9.47 4.90 0.00 3.05 3.13 0.00 5.73 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 545 Q 8.21 4.75 0.00 1.60 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.59 0.00 0.00 0.00 0.00 0.00 1.97 2.13 0.00 546 E 9.22 4.53 0.00 1.95 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 2.35 2.41 0.00 547 K 8.41 4.20 0.00 1.69 1.62 0.00 1.39 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.06 1.28 7.81 548 P 0.00 4.34 0.00 2.02 2.04 0.00 3.64 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 2.01 2.11 0.00 549 I 8.42 3.84 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.45 0.89 0.00 0.00 550 S 8.07 3.76 0.00 3.95 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 *555 V 8.22 3.73 1.82 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 0.70 0.00 0.00 0.84 0.00 0.00 556 Y 7.81 4.33 0.00 3.05 2.35 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 0.00 557 D 7.70 4.87 0.00 2.67 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 0.00 558 M 8.94 4.22 0.00 2.12 2.26 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.74 0.00 559 D 8.37 4.77 0.00 2.84 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 560 N 8.90 5.06 0.00 2.62 2.88 0.00 0.00 6.74 7.58 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 0.00 561 I 7.78 5.09 1.83 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.67 0.88 0.00 0.00 562 S 9.12 4.91 0.00 4.01 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 563 V 8.98 4.79 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 1.07 0.00 0.00 0.95 0.00 0.00 564 V 9.39 5.77 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 0.73 0.00 0.00 0.89 0.00 0.00 565 T 8.38 4.42 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 1.29 0.00 0.00 566 P 0.00 4.25 0.00 2.21 2.19 0.00 3.63 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 2.10 2.25 0.00 567 K 8.04 3.82 0.00 1.98 1.79 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.44 7.81 568 R 8.11 3.90 0.00 2.09 2.06 0.00 3.19 0.00 0.00 3.28 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 569 H 8.74 4.36 0.00 3.34 3.41 0.00 5.66 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 0.00 570 I 7.61 3.75 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.92 0.91 0.00 0.00 571 D 7.81 4.49 0.00 2.80 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 0.00 572 I 7.64 3.70 1.93 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 1.45 1.10 0.66 0.00 0.00 573 H 7.69 4.85 0.00 3.14 3.28 0.00 5.63 0.00 0.00 0.00 0.00 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 574 R 8.07 4.57 0.00 1.83 1.93 0.00 3.07 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 575 G 7.81 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 576 K 7.90 4.23 0.00 1.80 2.12 0.00 1.65 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.27 1.41 7.81 * Residues marked with a * may have inaccurate shift predictions.