NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 401 A 4.0706 8.1233 122.4572 51.9280 20.9784 175.7111 *403 D 4.2117 8.5004 117.9232 54.6834 40.8858 176.4052 404 C 4.5157 8.7708 121.8284 59.5828 42.0533 174.2753 405 A 4.7211 7.2665 117.7596 50.6135 22.4353 175.2248 406 K 4.7067 8.5060 121.0496 54.1754 35.3901 176.2602 407 G 3.9669 7.8508 113.1744 46.3573 0.0000 171.5137 408 K 4.8268 8.3030 118.8825 56.0139 33.2304 177.3648 409 I 4.0166 8.1284 123.3762 60.7798 37.6604 175.8597 410 E 4.2893 9.1502 128.5988 59.0622 30.1410 176.5075 411 F 5.0416 7.2218 111.5362 56.1984 40.7817 172.9273 412 S 5.2346 8.9652 113.5670 56.8722 66.6343 173.1252 413 K 4.5663 8.6401 121.4892 55.2729 35.7630 173.9053 414 Y 4.8938 8.7977 128.8340 56.5819 39.8964 174.6569 415 N 4.8873 8.4941 124.3075 51.5090 40.4985 175.8844 416 E 4.0184 8.6458 120.8789 59.2113 29.8278 177.2424 417 D 4.5691 7.9277 115.9318 53.1333 39.5303 176.1341 418 N 3.9162 7.9733 115.3730 54.3170 36.5437 174.1255 419 T 4.6608 7.6567 109.5569 60.6437 71.6955 173.1361 420 F 5.2941 9.2282 123.6016 56.7806 42.7869 173.4145 421 T 5.3613 8.7940 122.4896 61.9960 71.3284 173.7621 422 V 4.7507 9.0959 118.2893 59.3382 36.4194 174.4717 423 K 4.7139 8.1835 124.8491 54.6390 34.3351 174.8853 424 V 4.4915 8.3100 127.5213 61.4541 34.5773 175.7270 425 S 3.4557 9.5800 123.6043 59.8072 60.1552 173.4417 426 G 3.9451 7.7073 104.0517 45.8092 0.0000 174.0424 427 R 4.6278 7.7528 118.6526 54.2176 33.6711 174.5951 428 E 4.9925 8.4011 121.5454 55.3500 31.7599 174.8559 429 Y 5.4430 8.9244 120.1322 56.1423 42.9058 174.1860 430 W 5.8611 8.7073 117.7237 55.3387 32.3491 173.8552 431 T 4.6234 9.1500 114.4494 60.5059 70.4199 173.7561 432 N 4.9756 8.7539 122.8580 52.5866 37.7591 175.0373 433 R 4.1405 7.7589 119.8306 55.5622 29.4202 177.4094 434 W 4.3677 8.8852 121.6260 58.8275 28.0231 178.2875 435 N 3.7936 7.1339 117.0774 55.9639 37.8236 176.9917 436 L 4.1415 7.4698 119.4096 57.3949 41.4986 178.9697 437 Q 3.1896 7.5622 118.4226 58.6228 28.6195 177.5003 438 P 4.1896 0.0000 0.0000 65.8374 31.4098 178.4232 439 L 3.8242 7.3040 115.5358 57.5355 41.5196 179.4407 440 L 4.3369 8.7112 119.3992 57.9291 41.5319 179.3597 441 Q 4.1760 8.4583 119.7948 59.3441 29.0090 178.4498 442 S 4.1313 8.3932 116.1569 61.3780 62.7577 176.3622 443 A 4.0624 8.1843 123.5672 55.3734 18.0274 179.5379 444 Q 3.9645 8.3254 117.9848 59.2904 28.9353 178.2436 445 L 4.1019 8.2682 119.8173 57.2599 41.7272 178.6387 446 T 4.5211 7.6941 106.4766 60.3958 69.2976 174.4458 447 G 3.9196 7.7882 108.7494 47.2393 0.0000 174.3882 448 M 4.4115 8.1181 118.1488 55.1219 33.3356 176.5909 449 T 4.3688 8.4233 117.6209 63.0659 70.1784 174.4994 450 V 4.6885 8.5647 119.6882 59.8606 35.2072 175.1200 451 T 4.7262 8.1463 118.9679 61.7931 71.7523 173.2953 452 I 3.7938 8.1485 128.6030 60.4816 38.3918 175.1175 453 I 4.8424 7.8426 127.9593 59.6586 39.3640 174.8727 454 S 4.4209 8.3418 120.4761 58.0213 65.4686 174.1363 455 N 4.5127 8.8814 118.7029 54.6328 38.7765 175.8243 456 T 4.5175 7.7908 108.0537 60.2555 70.0973 174.4731 457 C 4.9247 8.7425 122.8923 56.3598 39.9421 174.0798 458 S 4.4068 7.8367 115.9927 57.4604 63.4855 173.5158 459 S 3.8042 8.4170 117.2930 60.4332 62.2616 174.6160 460 G 4.0847 8.9151 115.9952 45.1075 0.0000 173.9340 461 S 4.5257 7.9234 116.2697 58.3576 64.1596 174.1532 462 G 2.9540 8.2640 109.5539 45.4619 0.0000 172.6373 463 F 4.9517 7.6243 114.0337 55.5546 40.9865 174.4314 464 A 4.3575 8.3237 119.9548 52.0405 20.6018 175.3216 465 E 4.8759 8.2951 119.2972 55.6040 33.0355 174.6320 466 V 4.7996 8.3273 124.8501 60.3689 34.7323 173.1579 467 Q 4.4815 8.5903 124.5898 54.3454 31.4286 173.9194 468 F 5.1140 8.8456 125.1668 56.2172 40.4298 175.5780 469 N 4.6902 9.0701 121.3234 53.2877 38.3344 174.8159 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 401 A 8.12 4.07 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 *403 D 8.50 4.21 0.00 2.52 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 0.00 404 C 8.77 4.52 0.00 2.46 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.27 4.72 1.08 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 0.00 406 K 8.51 4.71 0.00 1.47 1.58 0.00 1.88 0.00 0.00 1.66 0.00 0.00 2.68 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.30 7.81 407 G 7.85 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 0.00 408 K 8.30 4.83 0.00 1.66 1.77 0.00 1.80 0.00 0.00 1.81 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.42 7.81 409 I 8.13 4.02 1.92 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.50 0.96 0.00 0.00 410 E 9.15 4.29 0.00 1.96 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 411 F 7.22 5.04 0.00 3.11 3.13 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 0.00 412 S 8.97 5.23 0.00 3.54 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 0.00 413 K 8.64 4.57 0.00 1.90 1.69 0.00 1.59 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.41 7.81 414 Y 8.80 4.89 0.00 3.38 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 0.00 415 N 8.49 4.89 0.00 2.88 2.63 0.00 0.00 6.20 7.18 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 0.00 416 E 8.65 4.02 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 2.30 2.34 0.00 417 D 7.93 4.57 0.00 2.72 2.66 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 0.00 0.00 0.00 418 N 7.97 3.92 0.00 2.92 3.02 0.00 0.00 6.85 7.16 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 0.00 419 T 7.66 4.66 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 420 F 9.23 5.29 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 0.00 421 T 8.79 5.36 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 1.37 0.00 0.00 422 V 9.10 4.75 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 0.90 0.00 0.00 1.06 0.00 0.00 423 K 8.18 4.71 0.00 0.79 0.79 0.00 1.55 0.00 0.00 1.49 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.14 1.25 7.81 424 V 8.31 4.49 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 0.87 0.00 0.00 0.82 0.00 0.00 425 S 9.58 3.46 0.00 4.05 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 0.00 426 G 7.71 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 0.00 427 R 7.75 4.63 0.00 1.81 1.42 0.00 3.11 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 428 E 8.40 4.99 0.00 1.85 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 2.17 2.23 0.00 429 Y 8.92 5.44 0.00 2.79 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 430 W 8.71 5.86 0.00 3.48 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 0.00 431 T 9.15 4.62 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 1.20 0.00 0.00 432 N 8.75 4.98 0.00 2.98 3.15 0.00 0.00 6.13 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 0.00 433 R 7.76 4.14 0.00 1.77 1.77 0.00 3.22 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 434 W 8.89 4.37 0.00 3.72 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 0.00 435 N 7.13 3.79 0.00 2.49 2.51 0.00 0.00 7.17 6.74 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 0.00 436 L 7.47 4.14 0.00 1.82 1.76 0.85 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 437 Q 7.56 3.19 0.00 2.14 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.80 0.00 0.00 0.00 0.00 0.00 1.61 2.23 0.00 438 P 0.00 4.19 0.00 2.21 2.29 0.00 3.58 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.02 0.00 439 L 7.30 3.82 0.00 1.90 1.41 0.84 0.37 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 0.00 440 L 8.71 4.34 0.00 2.03 2.09 1.32 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 441 Q 8.46 4.18 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 442 S 8.39 4.13 0.00 3.84 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 0.00 443 A 8.18 4.06 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 0.00 0.00 0.00 0.00 0.00 444 Q 8.33 3.96 0.00 2.26 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.74 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 445 L 8.27 4.10 0.00 1.85 1.75 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 446 T 7.69 4.52 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 1.22 0.00 0.00 447 G 7.79 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 0.00 448 M 8.12 4.41 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.57 0.00 449 T 8.42 4.37 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 450 V 8.56 4.69 1.76 0.00 0.00 0.00 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 0.87 0.00 0.00 451 T 8.15 4.73 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 1.10 0.00 0.00 452 I 8.15 3.79 0.99 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 0.69 0.15 -0.45 0.00 0.00 453 I 7.84 4.84 1.91 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 0.99 0.59 0.94 0.00 0.00 454 S 8.34 4.42 0.00 3.82 3.65 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 0.00 455 N 8.88 4.51 0.00 2.75 2.85 0.00 0.00 6.70 7.54 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 0.00 456 T 7.79 4.52 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 1.23 0.00 0.00 457 C 8.74 4.92 0.00 3.01 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 0.00 458 S 7.84 4.41 0.00 4.00 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 0.00 459 S 8.42 3.80 0.00 3.70 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 0.00 460 G 8.92 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 0.00 461 S 7.92 4.53 0.00 4.01 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 0.00 462 G 8.26 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 0.00 0.00 0.00 463 F 7.62 4.95 0.00 3.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 464 A 8.32 4.36 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 465 E 8.30 4.88 0.00 1.99 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 2.23 2.27 0.00 466 V 8.33 4.80 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 0.65 0.00 0.00 0.21 0.00 0.00 467 Q 8.59 4.48 0.00 2.03 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 2.19 2.28 0.00 468 F 8.85 5.11 0.00 2.92 2.97 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 0.00 469 N 9.07 4.69 0.00 2.66 2.69 0.00 0.00 6.92 7.11 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 * Residues marked with a * may have inaccurate shift predictions.