NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 395 A 4.3295 8.2649 123.5836 51.5068 20.6925 176.7086 396 D 4.5715 7.7422 117.6331 54.4723 42.1437 170.2834 397 V 4.9625 8.4040 115.0453 59.5595 37.0116 174.3061 398 A 4.2908 8.9147 125.1310 51.2506 18.3478 177.2122 399 P 4.3047 0.0000 0.0000 65.0654 31.9761 176.4823 400 L 5.0689 7.4766 116.7616 52.3628 45.4838 176.7970 401 S 4.6128 9.5337 118.1317 59.0272 64.3448 173.3759 402 L 5.2395 9.0330 123.2640 53.4906 45.1533 176.2388 403 G 3.8914 8.7567 109.5205 45.8022 0.0000 171.7408 404 I 5.4142 8.2931 112.8610 58.7718 41.5284 174.3190 405 E 4.5780 8.8009 125.0587 56.2833 30.2212 176.1412 406 T 4.6943 8.6567 116.9986 59.3381 72.2335 173.5248 407 A 3.7735 8.4245 124.5157 54.0059 18.3810 178.1302 408 G 3.6808 8.2874 111.2805 45.3118 0.0000 174.0074 409 G 3.7088 8.0602 105.9811 45.5259 0.0000 173.1745 410 V 4.1050 7.3932 119.9854 61.8031 32.8878 174.9752 411 M 4.2734 8.8536 129.0437 55.9382 32.8020 175.4347 412 T 4.5781 8.7185 123.5357 61.5537 71.1990 173.4892 413 N 4.7182 8.8576 124.5124 53.5977 38.7884 174.9881 414 L 4.4325 8.7231 122.3892 55.3171 44.2449 177.0571 415 I 4.5493 7.2091 119.1536 59.2365 40.4610 175.0905 416 D 4.7673 8.8057 127.1639 53.5432 42.2216 175.8225 417 R 3.8345 8.4239 121.9316 58.4887 30.3622 176.1086 418 N 4.5808 9.5561 121.5750 53.4020 36.9210 174.2337 419 T 4.1860 7.6065 116.9753 63.0675 69.3942 174.4957 420 R 4.5277 8.8249 125.8708 56.8862 30.7393 175.9489 421 I 4.7287 8.0625 116.1118 58.2038 40.0510 173.7513 422 P 4.7117 0.0000 0.0000 63.7119 32.2864 175.1021 423 T 4.7298 8.6905 114.3787 61.2021 71.3612 172.1527 424 K 5.2431 8.4858 125.8456 55.0340 35.4877 174.9445 425 A 4.8888 9.1510 127.2859 50.9523 23.1894 174.3097 426 C 5.3417 8.4152 118.2109 58.2320 34.8261 173.3048 427 K 4.6838 9.0459 123.6031 54.9672 36.5345 175.1707 428 T 4.7865 8.2352 119.2681 62.7058 69.6894 174.3042 429 F 5.0075 9.6951 125.4057 56.2670 43.1943 173.6736 430 T 5.1366 9.1064 113.8197 60.9298 71.3192 172.3831 431 T 4.5691 8.4156 113.1415 61.7140 69.2794 174.3220 432 Y 4.7768 8.9826 124.3431 58.6155 39.8966 175.4529 433 A 4.5945 8.4115 120.8909 49.4244 21.9855 174.9368 434 D 4.5712 8.5607 120.0010 56.2904 41.2375 176.4713 435 N 4.1744 9.3036 119.3718 53.8738 36.8774 174.0636 436 Q 3.9769 7.7717 119.3288 56.2176 29.3308 175.0554 437 P 4.5749 0.0000 0.0000 63.7853 32.1404 175.3043 438 G 4.4802 7.3688 104.1769 45.7620 0.0000 172.6705 439 V 4.7897 8.9915 112.7772 59.4055 36.1494 175.0196 440 S 4.6664 8.8237 118.7438 56.7994 63.6654 173.8988 441 I 3.8327 8.5498 129.9435 60.4350 37.8062 175.1776 442 Q 4.7705 8.3483 127.5351 54.0340 30.9397 175.0514 443 V 4.6929 8.5358 126.0392 62.3361 32.9491 174.6048 444 Y 5.2470 9.4283 124.9699 56.1861 42.6162 173.9735 445 E 5.1270 10.0791 121.3706 54.1474 33.0729 175.0123 446 G 4.7456 7.8829 112.6299 43.7061 0.0000 172.8360 447 E 4.5808 8.3019 117.2650 55.9405 30.4303 176.8941 448 R 4.4737 8.1115 118.2323 55.1174 31.3612 176.7057 449 A 4.0950 8.5347 123.5188 54.5427 18.9499 177.7862 450 M 4.9559 7.5836 115.2787 53.3925 34.3379 177.2351 451 T 3.5046 8.4958 114.0166 64.0086 68.9281 176.7271 452 R 3.9682 7.7824 117.8288 58.5524 29.5528 176.8166 453 D 4.6323 7.7832 116.4881 54.0352 41.0257 175.2207 454 N 5.0428 7.7642 117.2449 51.6991 41.5318 172.6387 455 H 5.0233 8.9416 118.8831 54.7466 31.7541 173.5548 456 R 3.6901 8.4905 126.4122 55.8596 30.1766 175.6832 457 L 4.3634 8.5108 125.3494 54.4957 43.7349 176.5411 458 G 4.0501 7.0178 105.6721 46.5628 0.0000 171.8734 459 T 5.3555 8.2897 115.6168 61.8627 72.6256 173.5981 460 F 5.0672 8.8870 119.0167 55.7021 41.7853 173.0135 461 E 5.0015 8.9162 119.0579 54.9087 31.9019 175.2440 462 L 4.8508 8.8676 124.4871 53.7104 44.9330 175.3982 463 S 4.8078 8.3960 122.6774 57.7853 65.5461 174.6860 464 G 3.8841 8.9660 111.5768 46.5788 0.0000 173.5302 465 I 3.8368 7.8018 121.9473 60.1746 37.3053 174.3655 466 P 4.5315 0.0000 0.0000 61.6159 31.8787 174.3972 467 P 4.4197 0.0000 0.0000 63.6068 31.8255 175.4649 468 A 4.5516 8.2580 122.3146 50.2735 23.4317 173.9401 469 P 4.7858 0.0000 0.0000 62.0131 32.7382 176.5156 470 R 3.9469 9.0441 119.7232 58.1722 29.4644 177.2447 471 G 4.4197 8.4572 108.3716 45.0630 0.0000 174.4522 472 V 3.8843 7.6228 119.5405 64.4872 32.2940 175.0557 473 P 4.4544 0.0000 0.0000 62.8344 32.7664 175.7614 474 Q 4.7235 8.7456 121.4290 54.5717 31.2649 174.7509 475 I 4.7986 9.2392 127.7235 59.5986 39.2584 175.0157 476 E 4.8586 9.0484 128.3418 55.6620 31.0301 175.9419 477 V 5.1111 9.1504 125.0497 61.5155 34.2793 174.1532 478 T 5.2709 9.4385 125.0314 61.9362 71.4451 173.0317 479 F 5.2496 9.3406 125.4223 55.8576 41.4103 174.2393 480 N 5.4911 9.2061 122.4853 51.8467 41.9477 172.7487 481 I 5.0291 9.1238 127.5699 59.6189 40.1252 175.9611 482 D 4.8960 8.7472 126.8128 51.9413 41.0538 176.9514 483 A 4.0553 8.4174 120.9395 54.9891 18.3183 178.0557 484 N 4.5573 8.3024 111.6497 53.3561 38.7762 176.2209 485 G 3.9484 8.2013 106.9364 45.1928 0.0000 173.7135 486 I 3.9701 7.6928 121.3368 60.8656 38.5551 174.3965 487 L 5.0912 8.6271 129.2501 53.5221 44.0802 174.5004 488 N 5.2996 9.0346 124.1926 51.4517 41.2940 173.6743 489 V 4.6365 8.4185 123.9454 61.1380 34.0546 174.4774 490 S 5.3070 9.3996 123.5501 56.6685 66.7075 172.8968 491 A 5.5738 9.3271 124.8621 50.2689 22.5134 174.8958 492 E 5.7989 9.0554 118.2951 54.0028 33.8007 173.9951 493 D 4.9823 8.7858 122.8458 53.9464 41.7306 176.9169 494 K 4.0094 9.0852 126.8597 59.3449 32.1717 178.5692 495 S 4.3679 8.9582 114.7225 60.4916 62.6681 175.0528 496 T 4.1454 8.1109 107.0023 61.2183 69.2309 175.4446 497 G 3.9224 8.2412 109.6553 45.7166 0.0000 173.9597 498 K 4.1647 7.9757 120.3067 56.8365 32.9283 176.3023 499 S 5.2791 8.5341 119.3413 57.1679 66.9140 172.6433 500 N 4.9107 9.0493 119.8285 52.8285 42.7535 172.9648 501 R 4.6547 7.6585 121.8099 54.6626 33.4378 173.8743 502 I 4.4977 8.0869 117.7007 59.3173 41.1808 174.0618 503 T 4.8322 8.3336 120.3358 62.2310 70.1993 173.8806 504 I 4.4124 9.0208 128.3167 59.5738 39.3153 175.3927 505 Q 4.4431 8.6101 126.0969 55.4856 29.9387 175.6039 506 N 4.5075 8.6952 121.4030 52.5532 39.1893 175.6803 507 E 4.6150 8.0972 130.5116 54.6874 29.4594 176.8585 508 K 3.9374 7.7552 116.4808 57.9785 32.8274 176.5876 509 G 4.0424 9.1020 113.2147 46.3106 0.0000 175.2388 510 R 3.8759 8.3978 120.1640 58.6137 30.1676 176.1175 511 L 4.6956 7.6936 120.1825 53.2088 43.4946 176.4527 512 T 4.3632 9.1873 117.8446 60.8267 71.3487 175.3444 513 Q 4.0127 8.5145 121.4461 59.4087 28.9289 178.5350 514 S 4.1437 8.0036 115.9263 61.3641 62.9276 175.7699 515 D 4.3912 8.1625 121.6930 57.7416 40.5622 179.2449 516 I 3.7352 7.6778 119.8661 64.4812 37.1112 178.2206 517 D 4.3633 8.4765 120.1457 57.3500 40.5584 178.8980 518 R 3.9418 8.0399 119.1335 59.7584 30.1220 178.5046 519 M 4.1065 8.2569 118.5599 58.5928 32.0800 179.2566 520 V 3.7144 8.1873 112.8606 64.3915 31.5842 178.1367 521 H 4.2382 8.3570 118.1568 59.4561 29.6697 177.1913 522 E 4.2034 8.8471 121.8005 58.7900 29.0366 179.1913 523 A 4.0832 7.8897 120.0768 54.9411 18.7735 179.3007 524 K 4.0215 8.0060 117.7318 59.8656 32.1432 178.7610 525 Q 3.8606 8.1667 118.4851 58.6579 28.4809 178.5198 526 F 5.1823 8.3255 118.4699 56.6244 39.4823 177.7958 527 E 4.0177 8.0046 120.8298 59.3788 29.3408 178.7952 528 K 3.9107 7.9959 120.1717 59.1744 32.1817 178.1625 529 E 3.9804 8.2804 118.2621 59.9227 29.3768 179.0653 530 D 4.4855 8.6891 119.0391 57.3516 40.5899 179.1754 531 G 3.6843 7.9333 105.4021 47.2856 0.0000 175.5263 532 E 4.4308 8.0001 121.9398 58.6987 29.4082 178.6390 533 Q 3.9114 7.8427 117.3363 57.8364 29.2163 177.5926 534 R 4.0409 7.5625 119.5467 59.6852 30.4589 177.2676 535 E 4.1218 7.7674 116.3142 58.8468 29.9278 178.5811 536 R 4.3398 7.9790 116.8328 57.6951 31.2455 177.3487 537 V 4.2689 6.6978 109.9191 61.2879 30.4835 177.1597 *540 R 4.0536 8.3154 126.0943 57.6239 30.1590 174.8103 541 N 4.6014 8.5499 111.3015 54.3944 36.2814 173.4405 542 Q 5.0898 7.5134 116.7304 54.7276 30.9131 174.7687 543 L 4.8660 9.0682 123.0931 52.8783 45.5563 176.5643 544 E 4.3235 8.5687 120.6481 56.6285 29.8070 176.4072 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 395 A 8.26 4.33 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 0.00 396 D 7.74 4.57 0.00 2.71 2.60 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 0.00 397 V 8.40 4.96 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 0.73 0.00 0.00 0.95 0.00 0.00 398 A 8.91 4.29 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 0.00 399 P 0.00 4.30 0.00 2.22 2.22 0.00 3.74 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 400 L 7.48 5.07 0.00 1.55 1.69 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 401 S 9.53 4.61 0.00 4.05 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 0.00 402 L 9.03 5.24 0.00 1.67 1.95 1.06 0.92 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 0.00 403 G 8.76 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 0.00 404 I 8.29 5.41 1.75 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.40 1.08 0.00 0.00 405 E 8.80 4.58 0.00 1.88 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 2.22 2.09 0.00 406 T 8.66 4.69 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 407 A 8.42 3.77 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 408 G 8.29 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 0.00 0.00 0.00 409 G 8.06 3.71 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 0.00 410 V 7.39 4.11 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 0.95 0.00 0.00 0.88 0.00 0.00 411 M 8.85 4.27 0.00 2.12 1.85 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 412 T 8.72 4.58 4.46 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 1.39 0.00 0.00 413 N 8.86 4.72 0.00 2.56 2.70 0.00 0.00 7.04 7.85 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 0.00 414 L 8.72 4.43 0.00 0.41 1.26 1.00 0.61 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 0.00 415 I 7.21 4.55 1.93 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.65 0.95 0.00 0.00 416 D 8.81 4.77 0.00 2.61 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 0.00 417 R 8.42 3.83 0.00 1.95 1.90 0.00 3.36 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 418 N 9.56 4.58 0.00 2.88 3.09 0.00 0.00 7.08 8.13 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 0.00 419 T 7.61 4.19 4.27 0.00 0.00 0.00 0.00 0.00 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 0.00 420 R 8.82 4.53 0.00 1.70 1.89 0.00 3.50 0.00 0.00 3.29 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 421 I 8.06 4.73 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.66 1.00 0.00 0.00 422 P 0.00 4.71 0.00 2.11 2.09 0.00 3.79 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 2.00 1.97 0.00 423 T 8.69 4.73 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 424 K 8.49 5.24 0.00 1.78 1.63 0.00 2.04 0.00 0.00 1.74 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.50 7.81 425 A 9.15 4.89 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 0.00 426 C 8.42 5.34 0.00 3.02 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 0.00 427 K 9.05 4.68 0.00 1.71 1.04 0.00 1.68 0.00 0.00 1.38 0.00 0.00 2.73 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.20 1.33 7.81 428 T 8.24 4.79 4.16 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 1.22 0.00 0.00 429 F 9.70 5.01 0.00 3.04 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 0.00 430 T 9.11 5.14 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 1.33 0.00 0.00 431 T 8.42 4.57 4.42 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 1.25 0.00 0.00 432 Y 8.98 4.78 0.00 2.99 3.22 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 0.00 433 A 8.41 4.59 1.19 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 0.00 0.00 434 D 8.56 4.57 0.00 2.64 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 0.00 435 N 9.30 4.17 0.00 2.81 2.89 0.00 0.00 6.95 7.73 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 0.00 436 Q 7.77 3.98 0.00 2.29 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.96 0.00 0.00 0.00 0.00 0.00 2.58 2.36 0.00 437 P 0.00 4.57 0.00 2.27 2.29 0.00 3.97 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.93 0.00 438 G 7.37 4.48 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 0.00 439 V 8.99 4.79 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 0.72 0.00 0.00 0.91 0.00 0.00 440 S 8.82 4.67 0.00 3.78 3.69 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 0.00 441 I 8.55 3.83 0.56 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.18 0.54 0.00 0.00 442 Q 8.35 4.77 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.02 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 443 V 8.54 4.69 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 0.88 0.00 0.00 0.86 0.00 0.00 444 Y 9.43 5.25 0.00 2.92 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 0.00 445 E 10.08 5.13 0.00 2.03 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 0.00 2.27 2.31 0.00 446 G 7.88 4.75 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 0.00 447 E 8.30 4.58 0.00 1.97 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 2.24 2.26 0.00 448 R 8.11 4.47 0.00 1.93 1.82 0.00 3.39 0.00 0.00 3.30 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 449 A 8.53 4.09 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 0.00 450 M 7.58 4.96 0.00 1.93 1.87 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.37 0.00 451 T 8.50 3.50 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 0.77 0.00 0.00 452 R 7.78 3.97 0.00 1.91 2.06 0.00 2.96 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 453 D 7.78 4.63 0.00 2.64 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 0.00 454 N 7.76 5.04 0.00 2.92 3.16 0.00 0.00 6.69 7.80 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 0.00 455 H 8.94 5.02 0.00 3.21 3.33 0.00 5.59 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 456 R 8.49 3.69 0.00 1.10 1.47 0.00 3.01 0.00 0.00 2.83 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.89 0.00 457 L 8.51 4.36 0.00 1.39 1.58 0.92 0.75 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 0.00 458 G 7.02 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 0.00 0.00 0.00 459 T 8.29 5.36 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 1.25 0.00 0.00 460 F 8.89 5.07 0.00 3.05 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 0.00 461 E 8.92 5.00 0.00 1.91 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.25 0.00 462 L 8.87 4.85 0.00 1.82 1.51 1.09 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 463 S 8.40 4.81 0.00 3.98 3.86 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 0.00 464 G 8.97 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 465 I 7.80 3.84 2.04 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.15 0.97 0.00 0.00 466 P 0.00 4.53 0.00 2.05 1.99 0.00 3.71 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 467 P 0.00 4.42 0.00 1.93 2.11 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 468 A 8.26 4.55 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 469 P 0.00 4.79 0.00 2.07 1.96 0.00 3.62 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 470 R 9.04 3.95 0.00 1.87 1.86 0.00 3.06 0.00 0.00 3.11 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 471 G 8.46 4.42 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 0.00 472 V 7.62 3.88 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 0.81 0.00 0.00 0.96 0.00 0.00 473 P 0.00 4.45 0.00 2.15 1.98 0.00 3.62 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 474 Q 8.75 4.72 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.86 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 475 I 9.24 4.80 2.02 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 1.31 1.35 0.99 0.00 0.00 476 E 9.05 4.86 0.00 2.01 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 2.35 2.30 0.00 477 V 9.15 5.11 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 1.29 0.00 0.00 0.96 0.00 0.00 478 T 9.44 5.27 4.34 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 1.37 0.00 0.00 479 F 9.34 5.25 0.00 2.95 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 0.00 480 N 9.21 5.49 0.00 2.84 2.64 0.00 0.00 6.62 7.52 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 0.00 481 I 9.12 5.03 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.80 0.96 0.00 0.00 482 D 8.75 4.90 0.00 2.92 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 0.00 483 A 8.42 4.06 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 0.00 484 N 8.30 4.56 0.00 2.87 2.86 0.00 0.00 7.10 7.73 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 0.00 485 G 8.20 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 0.00 0.00 0.00 486 I 7.69 3.97 2.17 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 1.22 0.80 0.94 0.00 0.00 487 L 8.63 5.09 0.00 1.77 1.47 0.90 0.43 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 0.00 488 N 9.03 5.30 0.00 2.61 2.62 0.00 0.00 6.04 8.54 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 0.00 489 V 8.42 4.64 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 0.94 0.00 0.00 -0.12 0.00 0.00 490 S 9.40 5.31 0.00 3.80 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 491 A 9.33 5.57 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 0.00 0.00 0.00 0.00 0.00 0.00 492 E 9.06 5.80 0.00 2.13 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 2.23 2.14 0.00 493 D 8.79 4.98 0.00 2.80 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 0.00 494 K 9.09 4.01 0.00 1.79 1.89 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.43 7.81 495 S 8.96 4.37 0.00 3.80 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 496 T 8.11 4.15 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 1.28 0.00 0.00 497 G 8.24 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 498 K 7.98 4.16 0.00 1.77 1.79 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.45 7.81 499 S 8.53 5.28 0.00 3.69 3.71 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 0.00 500 N 9.05 4.91 0.00 2.82 2.69 0.00 0.00 6.66 7.26 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 0.00 501 R 7.66 4.65 0.00 1.62 1.50 0.00 3.13 0.00 0.00 3.43 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.62 0.00 502 I 8.09 4.50 1.81 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 1.31 0.65 0.84 0.00 0.00 503 T 8.33 4.83 4.18 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 1.16 0.00 0.00 504 I 9.02 4.41 1.80 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 1.16 0.61 0.87 0.00 0.00 505 Q 8.61 4.44 0.00 1.92 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.08 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 506 N 8.70 4.51 0.00 2.73 2.76 0.00 0.00 6.90 7.65 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 0.00 507 E 8.10 4.62 0.00 2.04 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 2.29 2.29 0.00 508 K 7.76 3.94 0.00 1.74 1.82 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.78 7.81 509 G 9.10 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 0.00 0.00 0.00 0.00 510 R 8.40 3.88 0.00 1.75 2.10 0.00 3.25 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 511 L 7.69 4.70 0.00 1.62 1.55 0.89 0.95 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 0.00 512 T 9.19 4.36 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 1.21 0.00 0.00 513 Q 8.51 4.01 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.96 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 514 S 8.00 4.14 0.00 3.91 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 0.00 515 D 8.16 4.39 0.00 2.92 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 516 I 7.68 3.74 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.70 0.98 0.00 0.00 517 D 8.48 4.36 0.00 2.85 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 518 R 8.04 3.94 0.00 2.06 2.10 0.00 3.30 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 519 M 8.26 4.11 0.00 2.14 2.26 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.61 0.00 520 V 8.19 3.71 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 1.06 0.00 0.00 0.96 0.00 0.00 521 H 8.36 4.24 0.00 3.27 3.52 0.00 5.61 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 0.00 522 E 8.85 4.20 0.00 2.13 2.22 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 2.57 2.32 0.00 523 A 7.89 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 524 K 8.01 4.02 0.00 1.94 2.04 0.00 1.69 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.52 7.81 525 Q 8.17 3.86 0.00 1.75 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.64 0.00 0.00 0.00 0.00 0.00 2.22 2.50 0.00 526 F 8.33 5.18 0.00 3.16 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 0.00 527 E 8.00 4.02 0.00 2.22 2.40 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 0.00 2.42 2.32 0.00 528 K 8.00 3.91 0.00 1.85 1.86 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.66 1.54 7.81 529 E 8.28 3.98 0.00 2.43 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 2.56 2.56 0.00 530 D 8.69 4.49 0.00 2.92 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 0.00 531 G 7.93 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 0.00 0.00 0.00 532 E 8.00 4.43 0.00 2.20 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 0.00 2.33 2.29 0.00 533 Q 7.84 3.91 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.97 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 534 R 7.56 4.04 0.00 1.97 1.93 0.00 3.31 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 535 E 7.77 4.12 0.00 2.05 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 0.00 2.54 2.28 0.00 536 R 7.98 4.34 0.00 1.81 2.02 0.00 3.14 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.93 0.00 537 V 6.70 4.27 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 0.70 0.00 0.00 0.98 0.00 0.00 *540 R 8.32 4.05 0.00 2.02 2.12 0.00 3.11 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 541 N 8.55 4.60 0.00 2.87 2.71 0.00 0.00 6.74 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 0.00 542 Q 7.51 5.09 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.04 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 543 L 9.07 4.87 0.00 1.54 1.47 0.81 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 544 E 8.57 4.32 0.00 1.87 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 2.12 2.11 0.00 * Residues marked with a * may have inaccurate shift predictions.