NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -21 M 4.4474 8.2931 120.3303 53.9308 33.4210 175.0653 -20 G 3.6996 7.7111 109.6748 45.5586 0.0000 171.5759 -19 S 4.4980 8.6085 129.4346 56.3990 63.3558 172.3556 -18 S 4.2768 7.9207 120.3666 57.7391 65.4791 175.2364 -17 H 4.1412 8.6983 124.2116 55.1140 27.1773 173.2716 -16 H 4.7826 8.6424 115.0474 54.7029 29.2784 174.4903 -15 H 4.5734 8.6787 122.8738 54.4739 27.4951 173.5145 -14 H 4.7680 8.2358 122.4157 54.2387 30.5462 172.0220 -13 H 4.7381 8.2293 124.9149 54.0517 29.6171 172.3723 -12 H 4.7284 7.5493 118.2727 54.1334 30.6604 172.1020 -11 S 4.3797 8.1027 120.9863 59.7535 63.8674 174.4380 -10 S 4.3122 6.6492 110.7735 57.0558 64.7203 175.4752 -9 G 3.8275 7.3777 109.9986 45.6939 0.0000 170.9771 -8 L 4.5979 8.0401 122.0362 52.7522 43.8990 176.9939 -7 V 3.7874 8.2892 127.1024 60.7627 32.1184 174.6289 -6 P 4.5414 0.0000 0.0000 61.8477 32.4785 173.3986 -5 R 3.9214 7.9465 116.8274 57.0865 28.8005 176.8444 -4 G 3.9900 7.5994 107.6887 45.8682 0.0000 174.8822 -3 S 4.0666 7.7950 112.3376 59.3203 63.4613 173.2555 -2 H 4.6930 7.9533 117.1577 55.3882 30.0061 173.3703 -1 M 5.4198 8.4591 117.6850 52.7993 34.9206 175.5212 *345 V 4.3089 8.0302 119.4889 62.2278 32.2387 175.3282 346 S 4.7547 8.7256 118.4525 57.3063 64.4726 174.0087 347 L 4.3071 7.1546 121.1989 51.8341 44.8248 175.4883 348 P 4.4784 0.0000 0.0000 64.8590 31.4039 178.6934 349 E 4.0361 7.9129 117.8953 59.3250 29.4131 178.6709 350 E 4.0989 8.0373 118.0911 58.8204 29.7708 178.3740 351 L 4.0738 7.7204 119.4199 56.9609 41.9467 178.1113 352 N 4.7403 7.8947 115.6986 55.8393 38.7293 177.0418 353 R 4.1739 7.8280 116.7117 58.6972 29.9894 178.3544 354 V 4.1521 7.6407 111.2565 60.4953 31.9886 175.7177 355 R 4.5347 7.4040 120.2669 56.7380 30.1516 175.5484 356 L 4.8764 9.2482 126.6665 53.0146 44.7207 176.1182 357 S 4.7654 8.2369 117.5258 56.5095 65.8161 175.2744 358 R 4.0090 8.4161 116.6936 59.4547 28.9607 178.7399 359 H 4.2027 8.1448 116.9962 58.5728 28.7067 177.6082 360 K 3.4530 7.2645 120.1269 58.9711 31.8216 179.4377 361 L 3.9340 7.5758 119.2439 57.6030 41.5634 179.0371 362 E 3.8824 8.4130 119.9688 59.2317 29.3599 178.9055 363 R 4.0843 7.4342 113.8472 57.7927 30.0493 177.6445 364 W 4.5458 7.4631 118.3237 56.7841 29.1491 177.5615 365 C 3.8601 7.3549 119.8323 61.9454 31.1191 173.9664 366 H 4.5921 7.4915 112.6917 56.3756 29.0571 175.0133 367 M 4.2799 6.9731 119.9601 54.2282 32.5206 175.0628 368 P 4.4169 0.0000 0.0000 62.3671 31.7260 177.0013 369 F 4.6701 7.6354 111.5826 58.4547 35.1859 175.0221 370 F 4.4427 8.7214 124.0317 59.2267 38.5874 177.2440 371 A 3.3869 7.6042 121.6243 55.0615 17.6976 179.3490 372 K 3.8078 7.7747 116.6429 59.9899 32.4969 178.8005 373 T 3.9966 7.7504 114.3757 66.6362 68.7416 176.5453 374 V 4.0821 8.0859 114.0697 62.6170 31.5224 176.4664 375 T 4.2944 7.0485 116.1760 65.2287 68.4100 173.3975 376 G 3.9480 8.6112 115.5466 45.6835 0.0000 173.5611 377 C 4.4816 7.9117 116.8545 59.3567 29.9741 172.6940 378 F 5.3529 8.6790 118.7233 55.7122 41.9816 175.1941 379 V 4.9939 9.0587 121.3555 59.0602 35.0974 174.9650 380 R 4.6801 8.4826 123.0816 55.3822 30.4854 174.2693 381 I 4.6266 8.4688 126.9466 59.1120 40.6313 174.2984 382 G 4.2459 8.4630 115.6460 44.4016 0.0000 172.8719 383 I 4.2727 8.1496 120.0011 62.2000 38.9076 175.7013 384 G 3.9090 9.0241 115.8260 45.3393 0.0000 172.0692 385 N 4.5638 7.8702 118.1147 53.6475 37.2793 173.4707 386 H 4.6269 7.6553 133.2070 55.9707 31.4097 173.9770 387 N 4.7491 8.0553 117.3861 52.3355 39.4176 173.3694 388 S 4.1652 8.8479 123.4780 58.4763 61.4096 171.0541 389 K 4.5720 7.4586 119.2805 53.5101 34.6321 174.9176 390 P 4.7819 0.0000 0.0000 62.7736 29.8677 174.0308 391 V 3.9811 7.7730 127.0647 62.9169 32.5525 173.6640 392 Y 5.2373 8.5836 125.2348 56.4212 41.0822 175.2921 393 R 4.9617 9.2539 120.7089 54.3870 35.4305 174.3820 394 V 4.3097 8.5770 120.7861 62.7981 32.3641 175.0978 395 A 4.9192 8.8926 128.9246 50.0225 22.4142 174.5494 396 E 4.0541 9.4113 124.2878 55.7218 31.4237 175.6116 397 I 4.3677 8.5347 128.6828 61.1826 38.3726 175.0636 398 T 4.6811 8.8514 119.5739 60.1665 68.6555 175.4203 399 G 3.8398 8.6081 121.5637 45.1719 0.0000 169.6170 400 V 4.8502 8.0201 117.3736 61.1144 33.9446 175.3823 401 V 4.6529 9.2498 120.9402 59.5775 35.2454 174.1177 402 E 5.1739 8.6856 119.5568 55.1024 32.0329 175.3436 403 T 4.7475 9.0551 111.6333 59.9274 71.8191 174.6285 404 A 4.3705 8.5991 124.5648 52.2802 18.8269 177.3898 405 K 4.5393 7.5891 117.5181 55.0481 35.1942 175.8335 406 V 4.1381 8.4184 126.6245 61.3610 32.7660 175.1087 407 Y 4.8172 8.0050 122.1210 55.4295 41.2050 174.0554 408 Q 4.4926 8.6343 121.6175 55.0039 29.8888 174.3856 409 L 4.8597 8.0333 127.4246 52.4122 46.0138 175.5543 410 G 4.0805 7.9918 108.0189 45.0693 0.0000 172.7063 411 G 3.8770 8.5960 113.5326 46.1443 0.0000 172.1223 412 T 4.6136 8.5875 119.5577 60.0070 70.8920 173.2293 413 R 4.6418 8.3906 123.6482 54.5721 32.5342 174.9390 414 T 4.5883 7.8298 116.8713 59.3154 71.1750 173.6971 415 N 5.4676 8.2430 125.3490 51.7419 36.6437 173.2223 416 K 5.1268 7.6726 116.1365 56.6548 36.8829 176.4164 417 G 4.4746 9.5548 107.2836 45.3888 0.0000 171.5122 418 L 5.2299 8.4318 118.3881 53.0608 45.1064 176.3300 419 Q 4.5300 8.5976 123.3142 55.0173 29.4805 174.7715 420 L 4.9921 8.9067 127.1498 54.2469 44.0637 176.2279 421 R 5.6164 8.8741 120.9654 55.0087 33.2186 173.5216 422 H 5.3222 9.2211 124.0715 54.0849 30.1266 176.5154 423 G 3.9638 9.2621 117.5113 46.6745 0.0000 175.0062 424 N 4.8551 8.9745 117.8722 50.5127 36.4161 172.1771 425 D 4.6064 8.3502 124.6753 53.3927 43.4130 171.8703 426 Q 4.8759 8.5166 124.5063 54.4811 29.7984 174.0624 427 R 4.6090 9.1158 126.8851 54.6800 34.3251 173.5578 428 V 4.5947 8.0062 124.0097 61.7465 32.3811 174.9465 429 F 5.1554 8.7056 125.5987 55.7120 42.4370 175.1701 430 R 4.3008 9.0911 121.4186 55.4519 31.1211 177.7088 431 L 4.0727 8.8753 122.0314 57.8042 41.8932 179.7273 432 E 3.8575 7.6105 115.4181 58.7000 29.7444 177.5565 433 F 4.6515 8.0713 117.0358 57.6281 39.5230 175.5305 434 V 4.2306 7.4090 121.2214 62.0947 32.3768 175.6201 435 S 4.4851 9.0047 121.5292 57.7583 63.1034 173.7749 436 N 4.8121 8.1861 117.1248 52.2791 37.7045 174.1076 437 Q 4.2523 7.3757 118.5344 54.7848 30.6441 174.7298 438 E 4.2898 7.9834 117.9477 55.3803 30.7485 176.6683 439 F 4.9404 9.5096 119.7063 56.9778 39.8275 175.4795 440 T 4.8133 8.2731 112.0378 59.3521 72.8755 174.9552 441 E 4.0672 8.6197 118.7610 59.4749 29.5808 179.0702 442 S 4.1349 8.0807 113.6750 61.3200 62.4660 175.8830 443 E 4.1122 8.2726 120.9824 59.3348 29.2914 179.0259 444 F 4.0171 8.7278 121.0901 61.7972 39.4792 177.2030 445 M 4.4322 8.8697 118.5202 58.0688 31.5455 178.7238 446 K 4.2586 8.0896 121.3248 58.4843 32.3520 178.7851 447 W 4.1542 8.3165 128.8663 60.0556 30.6329 177.6311 448 K 3.0929 8.3258 120.2894 59.5358 31.4059 178.5246 449 E 4.1028 8.2955 117.2049 59.0251 29.5123 179.0274 450 A 4.0614 7.5671 121.8495 55.3040 18.4412 179.5065 451 M 3.8790 7.9604 117.6635 58.3113 32.0672 178.7741 452 F 3.8568 8.4764 121.1916 61.3666 39.4267 177.0381 453 S 4.3006 8.4497 110.7767 60.3215 62.2787 174.9816 454 A 4.3541 7.6678 121.6768 52.4123 18.8923 178.2291 455 G 3.7282 7.6093 104.4226 45.6390 0.0000 173.1270 456 M 4.4162 7.7778 119.4133 53.6617 33.2680 176.1523 457 Q 4.3018 8.2545 120.4550 55.1472 30.1464 175.8049 458 L 4.2054 8.0835 119.5488 53.8320 42.5085 175.3765 459 P 4.7724 0.0000 0.0000 62.8620 32.5225 175.6586 460 T 5.2469 9.3577 112.1932 60.0040 71.8142 176.0083 461 L 4.1817 7.9818 121.6142 57.3776 41.4695 179.4371 462 D 4.3673 8.0686 118.3609 57.2320 41.2876 177.8299 463 E 3.9958 7.7716 118.7385 59.5037 29.5226 179.2428 464 I 3.8451 7.9002 119.8895 64.4386 37.1013 178.0211 465 N 4.6175 8.1677 119.0747 56.2569 38.8492 177.1626 466 K 4.0209 8.3216 120.1744 59.2190 31.9989 179.6403 467 K 4.0247 8.6773 119.4418 59.5346 31.6522 179.2930 468 E 4.0396 8.7299 118.2827 59.3739 29.4609 178.9544 469 L 3.9968 8.2330 121.4874 58.0575 42.2142 178.8937 470 S 4.1604 8.2470 113.1487 61.1314 62.2806 176.2389 471 I 3.8947 8.1250 123.4392 64.3000 36.9594 178.5465 472 K 4.1724 8.0724 119.0430 59.8355 32.2133 178.9838 473 E 4.0543 7.9079 118.6589 58.7462 29.4434 178.6665 474 A 3.8723 7.6657 120.7604 54.7853 18.4797 179.2694 475 L 4.3062 8.0159 119.4741 58.9876 40.9251 177.4392 *476 N 4.5536 8.0378 120.8871 52.3866 38.3402 177.9212 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 -21 M 8.29 4.45 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.55 0.00 -20 G 7.71 3.70 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 0.00 0.00 0.00 -19 S 8.61 4.50 0.00 3.89 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 -18 S 7.92 4.28 0.00 3.83 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 -17 H 8.70 4.14 0.00 3.21 3.35 0.00 5.86 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -16 H 8.64 4.78 0.00 3.25 3.28 0.00 5.53 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 -15 H 8.68 4.57 0.00 3.16 3.34 0.00 5.84 0.00 0.00 0.00 0.00 6.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -14 H 8.24 4.77 0.00 3.11 3.21 0.00 5.67 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -13 H 8.23 4.74 0.00 3.05 3.11 0.00 5.92 0.00 0.00 0.00 0.00 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -12 H 7.55 4.73 0.00 3.04 3.07 0.00 5.77 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -11 S 8.10 4.38 0.00 3.83 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -10 S 6.65 4.31 0.00 3.70 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 -9 G 7.38 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -8 L 8.04 4.60 0.00 1.55 1.56 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 -7 V 8.29 3.79 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 0.89 0.00 0.00 0.93 0.00 0.00 -6 P 0.00 4.54 0.00 2.20 2.12 0.00 3.91 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 1.95 1.97 0.00 -5 R 7.95 3.92 0.00 2.00 1.94 0.00 3.20 0.00 0.00 3.23 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 -4 G 7.60 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 -3 S 7.79 4.07 0.00 3.88 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 -2 H 7.95 4.69 0.00 3.24 3.27 0.00 5.61 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -1 M 8.46 5.42 0.00 2.13 1.98 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.60 0.00 *345 V 8.03 4.31 2.20 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 1.20 0.00 0.00 1.17 0.00 0.00 346 S 8.73 4.75 0.00 3.77 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 347 L 7.15 4.31 0.00 1.51 1.38 0.86 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 348 P 0.00 4.48 0.00 2.20 2.34 0.00 3.36 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.19 0.00 349 E 7.91 4.04 0.00 1.94 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 2.35 2.31 0.00 350 E 8.04 4.10 0.00 2.10 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 2.37 2.31 0.00 351 L 7.72 4.07 0.00 1.88 1.36 0.26 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 352 N 7.89 4.74 0.00 2.96 2.92 0.00 0.00 7.28 8.09 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 0.00 353 R 7.83 4.17 0.00 2.04 2.10 0.00 3.10 0.00 0.00 3.61 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 354 V 7.64 4.15 2.25 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 1.02 0.00 0.00 1.24 0.00 0.00 355 R 7.40 4.53 0.00 2.40 2.14 0.00 3.09 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 356 L 9.25 4.88 0.00 1.64 1.50 1.16 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 357 S 8.24 4.77 0.00 3.82 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 358 R 8.42 4.01 0.00 2.17 2.28 0.00 2.75 0.00 0.00 3.43 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 359 H 8.14 4.20 0.00 3.06 3.29 0.00 5.63 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 360 K 7.26 3.45 0.00 1.13 0.74 0.00 1.52 0.00 0.00 1.43 0.00 0.00 2.54 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.14 1.22 7.81 361 L 7.58 3.93 0.00 1.87 1.82 1.01 1.02 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 0.00 362 E 8.41 3.88 0.00 2.07 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 2.25 2.37 0.00 363 R 7.43 4.08 0.00 2.00 1.95 0.00 3.03 0.00 0.00 2.94 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.47 0.00 364 W 7.46 4.55 0.00 2.93 2.43 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 0.00 365 C 7.35 3.86 0.00 3.02 3.05 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 0.00 366 H 7.49 4.59 0.00 3.23 3.39 0.00 5.78 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 367 M 6.97 4.28 0.00 1.84 2.06 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.71 0.00 368 P 0.00 4.42 0.00 1.62 1.55 0.00 3.56 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 1.83 1.90 0.00 369 F 7.64 4.67 0.00 3.01 3.12 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 0.00 370 F 8.72 4.44 0.00 3.10 3.15 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 0.00 371 A 7.60 3.39 1.10 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 0.00 372 K 7.77 3.81 0.00 1.61 1.78 0.00 1.60 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.52 7.81 373 T 7.75 4.00 4.36 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 1.12 0.00 0.00 374 V 8.09 4.08 2.20 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 1.54 0.00 0.00 0.81 0.00 0.00 375 T 7.05 4.29 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 1.19 0.00 0.00 376 G 8.61 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 0.00 377 C 7.91 4.48 0.00 3.08 3.15 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 0.00 378 F 8.68 5.35 0.00 2.70 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 0.00 379 V 9.06 4.99 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 1.01 0.00 0.00 1.05 0.00 0.00 380 R 8.48 4.68 0.00 0.95 1.49 0.00 2.34 0.00 0.00 2.61 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.89 0.00 381 I 8.47 4.63 1.75 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.23 0.72 0.87 0.00 0.00 382 G 8.46 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 0.00 0.00 0.00 0.00 383 I 8.15 4.27 1.84 0.00 0.00 0.77 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 0.71 0.63 0.00 0.00 384 G 9.02 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 0.00 385 N 7.87 4.56 0.00 2.26 2.40 0.00 0.00 6.68 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 0.00 386 H 7.66 4.63 0.00 3.10 3.25 0.00 5.93 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 387 N 8.06 4.75 0.00 2.72 2.73 0.00 0.00 7.13 7.74 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 0.00 388 S 8.85 4.17 0.00 4.02 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 0.00 389 K 7.46 4.57 0.00 1.65 1.62 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.30 1.39 7.81 390 P 0.00 4.78 0.00 2.28 2.18 0.00 3.42 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.86 0.00 391 V 7.77 3.98 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 0.90 0.00 0.00 0.97 0.00 0.00 392 Y 8.58 5.24 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 0.00 393 R 9.25 4.96 0.00 1.73 1.89 0.00 3.02 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 394 V 8.58 4.31 1.46 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 -0.59 0.00 0.00 0.24 0.00 0.00 395 A 8.89 4.92 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 0.00 0.00 0.00 0.00 0.00 396 E 9.41 4.05 0.00 2.10 1.94 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 2.04 1.51 0.00 397 I 8.53 4.37 2.11 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 1.33 0.55 0.89 0.00 0.00 398 T 8.85 4.68 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 1.33 0.00 0.00 399 G 8.61 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 400 V 8.02 4.85 1.94 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 0.92 0.00 0.00 0.57 0.00 0.00 401 V 9.25 4.65 2.10 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 0.76 0.00 0.00 1.01 0.00 0.00 402 E 8.69 5.17 0.00 2.08 1.95 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 2.20 2.30 0.00 403 T 9.06 4.75 4.35 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 1.35 0.00 0.00 404 A 8.60 4.37 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 0.00 405 K 7.59 4.54 0.00 1.82 1.72 0.00 1.91 0.00 0.00 1.84 0.00 0.00 3.09 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.56 7.81 406 V 8.42 4.14 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 0.84 0.00 0.00 0.88 0.00 0.00 407 Y 8.01 4.82 0.00 3.10 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 0.00 408 Q 8.63 4.49 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.84 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 409 L 8.03 4.86 0.00 1.71 1.53 0.93 1.13 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 0.00 410 G 7.99 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 0.00 0.00 0.00 411 G 8.60 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 0.00 412 T 8.59 4.61 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 1.24 0.00 0.00 413 R 8.39 4.64 0.00 1.72 1.75 0.00 3.22 0.00 0.00 3.13 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.59 0.00 414 T 7.83 4.59 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 0.77 0.00 0.00 415 N 8.24 5.47 0.00 2.95 2.97 0.00 0.00 6.06 7.21 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 0.00 416 K 7.67 5.13 0.00 1.87 1.79 0.00 1.60 0.00 0.00 1.91 0.00 0.00 3.32 0.00 0.00 3.46 0.00 0.00 0.00 0.00 1.45 1.48 7.81 417 G 9.55 4.47 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 0.00 418 L 8.43 5.23 0.00 1.80 1.72 1.10 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 419 Q 8.60 4.53 0.00 2.16 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.88 0.00 0.00 0.00 0.00 0.00 2.30 2.49 0.00 420 L 8.91 4.99 0.00 1.99 1.66 1.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 421 R 8.87 5.62 0.00 1.90 1.78 0.00 3.26 0.00 0.00 3.31 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 422 H 9.22 5.32 0.00 3.22 3.40 0.00 5.78 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 0.00 423 G 9.26 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 0.00 424 N 8.97 4.86 0.00 2.82 2.85 0.00 0.00 5.57 8.06 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 0.00 425 D 8.35 4.61 0.00 3.09 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 0.00 426 Q 8.52 4.88 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.54 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 427 R 9.12 4.61 0.00 1.97 1.62 0.00 2.93 0.00 0.00 2.90 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.35 0.00 428 V 8.01 4.59 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 0.89 0.00 0.00 0.91 0.00 0.00 429 F 8.71 5.16 0.00 3.13 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 0.00 430 R 9.09 4.30 0.00 1.60 0.66 0.00 3.23 0.00 0.00 3.57 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 431 L 8.88 4.07 0.00 1.88 1.83 1.06 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 432 E 7.61 3.86 0.00 1.68 1.77 0.00 0.00 0.00 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 1.47 0.00 433 F 8.07 4.65 0.00 3.14 3.01 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 0.00 434 V 7.41 4.23 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 0.76 0.00 0.00 1.06 0.00 0.00 435 S 9.00 4.49 0.00 3.50 3.48 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 0.00 436 N 8.19 4.81 0.00 2.49 2.66 0.00 0.00 5.99 7.37 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 0.00 437 Q 7.38 4.25 0.00 1.67 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.28 6.75 0.00 0.00 0.00 0.00 0.00 2.15 2.20 0.00 438 E 7.98 4.29 0.00 1.90 1.84 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 2.19 2.22 0.00 439 F 9.51 4.94 0.00 3.13 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 0.00 440 T 8.27 4.81 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 1.30 0.00 0.00 441 E 8.62 4.07 0.00 2.24 2.25 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 2.39 2.40 0.00 442 S 8.08 4.13 0.00 3.97 3.98 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 0.00 443 E 8.27 4.11 0.00 2.55 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 2.81 2.48 0.00 444 F 8.73 4.02 0.00 3.15 3.19 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 0.00 445 M 8.87 4.43 0.00 2.06 2.26 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.94 0.00 446 K 8.09 4.26 0.00 2.11 2.15 0.00 1.59 0.00 0.00 1.80 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.41 7.81 447 W 8.32 4.15 0.00 3.36 3.15 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 0.00 448 K 8.33 3.09 0.00 1.62 1.88 0.00 1.52 0.00 0.00 1.60 0.00 0.00 3.09 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.39 7.81 449 E 8.30 4.10 0.00 2.17 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 0.00 2.47 2.30 0.00 450 A 7.57 4.06 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 0.00 451 M 7.96 3.88 0.00 1.83 1.68 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.70 0.00 452 F 8.48 3.86 0.00 3.06 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 0.00 453 S 8.45 4.30 0.00 4.13 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 0.00 454 A 7.67 4.35 1.46 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 0.00 0.00 455 G 7.61 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 456 M 7.78 4.42 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.45 0.00 457 Q 8.25 4.30 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.08 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 458 L 8.08 4.21 0.00 1.70 1.74 0.11 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 459 P 0.00 4.77 0.00 2.44 2.44 0.00 4.01 0.00 0.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 460 T 9.36 5.25 4.64 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 1.32 0.00 0.00 461 L 7.98 4.18 0.00 1.66 1.80 0.97 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 462 D 8.07 4.37 0.00 2.74 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 0.00 463 E 7.77 4.00 0.00 2.44 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 2.37 2.40 0.00 464 I 7.90 3.85 2.10 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.89 1.01 0.00 0.00 465 N 8.17 4.62 0.00 2.92 3.08 0.00 0.00 6.84 6.42 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 0.00 466 K 8.32 4.02 0.00 1.97 1.87 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.82 1.65 7.81 467 K 8.68 4.02 0.00 1.94 1.93 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.76 1.67 7.81 468 E 8.73 4.04 0.00 2.20 2.28 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 2.58 2.40 0.00 469 L 8.23 4.00 0.00 1.85 1.95 0.96 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 470 S 8.25 4.16 0.00 4.13 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 0.00 471 I 8.13 3.89 2.19 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.20 1.22 0.00 0.00 472 K 8.07 4.17 0.00 2.07 2.13 0.00 1.34 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.64 1.52 7.81 473 E 7.91 4.05 0.00 2.12 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 2.35 2.62 0.00 474 A 7.67 3.87 0.62 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 0.00 0.00 475 L 8.02 4.31 0.00 2.06 2.35 1.01 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 *476 N 8.04 4.55 0.00 2.57 2.92 0.00 0.00 6.88 7.35 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 * Residues marked with a * may have inaccurate shift predictions.