NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 403 E 4.3053 8.4449 120.2252 56.2025 30.0042 175.2200 404 R 4.1428 9.0241 124.0909 54.2480 31.5429 175.9499 405 P 4.1388 0.0000 0.0000 66.0393 32.4989 178.3151 406 L 4.1282 7.8136 116.1101 56.5323 42.4589 179.0903 407 D 4.3212 8.5572 120.1879 57.2444 40.5258 178.6612 408 V 3.5503 7.5971 116.9368 65.9924 31.8474 177.6171 409 I 3.6784 7.4050 119.0156 64.6870 37.0929 177.9312 410 H 4.0723 8.0544 118.8420 59.0481 29.4314 176.7247 411 R 4.3413 7.7738 117.4237 57.2389 30.4308 177.6261 412 S 4.5437 7.9213 114.9086 57.2165 63.3119 173.8425 413 L 4.2186 6.8432 121.6731 56.5365 41.7674 176.8393 414 D 4.4882 9.5734 122.3288 54.8842 39.1563 173.4513 415 K 4.7143 7.9817 118.9567 54.4978 35.8040 174.9186 416 D 5.1523 8.4364 121.1951 54.2972 42.3799 176.2592 417 V 4.9705 9.2306 115.4991 59.5589 36.8143 173.8934 418 L 4.9320 8.9102 124.6054 53.3938 44.5149 175.2244 419 V 4.6594 9.0365 127.0566 61.4222 33.4226 174.8571 420 I 4.4031 8.6489 131.3858 59.9991 37.4338 176.0654 421 L 4.4438 8.0694 127.1424 54.3879 42.1070 178.0348 422 K 3.6700 9.0574 119.9951 61.4227 31.4456 179.8827 423 K 3.5618 7.6395 110.9328 58.6331 32.1437 176.5869 424 G 4.1568 8.3134 114.6038 46.0889 0.0000 172.2999 425 F 5.1743 7.3346 115.4328 55.2392 41.5697 173.7220 426 E 5.0608 8.7556 114.6182 55.4207 33.4823 173.8993 427 F 5.4802 9.2439 118.8509 55.7779 42.3228 174.5788 428 R 5.0553 9.4549 123.0815 53.9476 33.2097 175.3960 429 G 4.1069 7.7585 110.6757 46.5362 0.0000 170.7086 430 R 4.9391 7.7271 120.5091 54.7716 31.1722 175.6297 431 L 4.5847 8.7236 130.5816 55.3289 42.8289 176.7999 432 I 4.5872 8.5600 119.5569 59.8662 38.7303 175.0316 433 G 4.0753 7.4972 109.5203 46.5652 0.0000 171.5793 434 Y 5.6870 8.1302 117.4647 57.6594 40.5467 171.1442 435 D 4.6862 7.9849 117.4075 52.5765 42.1359 175.8209 436 I 3.7527 8.4930 111.1239 64.6662 37.5157 176.7594 437 H 4.3955 8.2616 116.6783 56.3868 28.7740 176.3732 438 L 3.9630 8.2228 118.9434 55.0691 39.5267 173.4673 439 N 4.8511 8.3026 116.7564 53.5848 39.5551 174.5609 440 V 4.9768 8.6419 115.8570 59.4900 36.1949 174.6028 441 V 4.7635 8.4414 122.0234 61.2050 34.1218 174.3213 442 L 5.3711 8.7752 127.0556 52.8868 45.2996 175.3091 443 A 5.0422 8.6987 123.4509 50.3671 22.2492 175.8439 444 D 4.6425 8.7752 118.1907 55.4283 39.0720 173.5755 445 A 5.1841 8.7205 120.9113 50.8447 22.2639 177.4432 446 E 5.2689 9.0405 116.5837 54.9734 33.4087 174.3158 447 M 4.6074 9.0220 123.5780 55.2805 34.0859 174.8161 448 I 4.8334 8.9100 126.7405 59.7357 40.2635 174.3018 449 Q 4.4949 8.9274 130.0347 54.1274 30.5060 175.3744 450 D 4.3061 9.3927 128.8998 55.6561 38.0892 174.4930 451 G 3.9791 8.2397 101.5660 45.9704 0.0000 172.4916 452 E 4.5783 7.7586 118.3730 53.8347 33.1006 175.2420 453 V 4.1135 8.4719 123.0157 63.4089 31.4766 175.7740 454 V 4.2802 8.2158 120.5769 61.3075 32.7561 175.4007 455 K 4.3640 7.4851 120.4648 55.8421 35.7215 173.8574 456 R 5.1665 7.8091 121.0420 54.7970 34.1622 174.3771 457 Y 4.6244 9.7197 121.7092 55.9844 41.2476 176.7757 458 G 3.5883 9.0180 111.4877 49.2211 0.0000 173.1065 459 K 5.2280 7.8754 118.8403 55.2893 35.5517 175.2110 460 I 4.3134 8.7064 126.0530 59.8261 41.9680 173.3037 461 V 4.5456 8.2792 129.6257 61.6686 32.4749 174.6947 462 I 4.2138 8.3258 130.2457 59.5193 39.0750 175.6479 463 R 4.3796 8.6355 127.7899 56.0245 30.5312 177.0096 464 G 4.1571 10.3190 116.1058 47.5141 0.0000 174.6579 465 D 4.3477 8.1272 117.9296 56.8174 41.3761 176.3543 466 N 4.6543 8.3290 114.9583 53.0742 38.9982 174.5503 467 V 4.1824 7.5101 119.3835 62.0465 32.5222 174.9991 468 L 4.5319 8.5239 128.5718 56.6969 43.4501 175.9696 469 A 4.5935 7.3788 116.9426 51.1994 22.5731 175.2208 470 I 5.0039 8.2795 119.3202 59.5921 41.0542 175.0667 471 S 4.5934 9.2070 121.2251 55.6900 65.2897 171.3069 472 P 4.7349 0.0000 0.0000 62.7974 31.9202 176.5963 473 T 4.2536 8.6899 114.2252 61.7948 68.5756 174.5197 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 403 E 8.44 4.31 0.00 1.97 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 2.21 2.34 0.00 404 R 9.02 4.14 0.00 1.99 1.82 0.00 3.16 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 405 P 0.00 4.14 0.00 2.15 2.09 0.00 3.57 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 2.11 2.14 0.00 406 L 7.81 4.13 0.00 1.69 1.68 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 407 D 8.56 4.32 0.00 2.78 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 0.00 408 V 7.60 3.55 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 0.83 0.00 0.00 0.91 0.00 0.00 409 I 7.40 3.68 1.48 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.42 0.25 0.00 0.00 410 H 8.05 4.07 0.00 3.39 3.45 0.00 5.77 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 0.00 411 R 7.77 4.34 0.00 1.98 1.96 0.00 3.21 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.90 0.00 412 S 7.92 4.54 0.00 4.00 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 0.00 413 L 6.84 4.22 0.00 1.70 1.64 0.90 1.12 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 0.00 414 D 9.57 4.49 0.00 2.75 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 0.00 415 K 7.98 4.71 0.00 1.71 1.69 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.57 1.53 7.81 416 D 8.44 5.15 0.00 2.65 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 0.00 417 V 9.23 4.97 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 0.87 0.00 0.00 0.96 0.00 0.00 418 L 8.91 4.93 0.00 1.72 1.62 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 419 V 9.04 4.66 2.34 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 1.06 0.00 0.00 0.99 0.00 0.00 420 I 8.65 4.40 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.59 0.88 0.00 0.00 421 L 8.07 4.44 0.00 1.25 1.27 0.57 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 422 K 9.06 3.67 0.00 1.55 1.79 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.43 1.47 7.81 423 K 7.64 3.56 0.00 1.34 1.57 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.42 1.36 7.81 424 G 8.31 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 0.00 0.00 0.00 0.00 425 F 7.33 5.17 0.00 3.21 3.28 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 0.00 426 E 8.76 5.06 0.00 2.17 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 2.37 2.32 0.00 427 F 9.24 5.48 0.00 3.08 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 0.00 428 R 9.45 5.06 0.00 1.95 1.82 0.00 3.26 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 429 G 7.76 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 0.00 0.00 0.00 0.00 430 R 7.73 4.94 0.00 1.96 1.85 0.00 3.26 0.00 0.00 3.11 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 431 L 8.72 4.58 0.00 1.85 1.72 1.09 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 432 I 8.56 4.59 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.85 0.98 0.00 0.00 433 G 7.50 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 0.00 434 Y 8.13 5.69 0.00 3.00 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 0.00 435 D 7.98 4.69 0.00 2.74 2.76 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 0.00 0.00 0.00 0.00 436 I 8.49 3.75 1.83 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 1.25 0.23 0.90 0.00 0.00 437 H 8.26 4.40 0.00 3.42 3.36 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 438 L 8.22 3.96 0.00 1.97 1.85 0.91 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 439 N 8.30 4.85 0.00 2.95 2.76 0.00 0.00 6.80 7.68 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 0.00 440 V 8.64 4.98 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 0.81 0.00 0.00 0.92 0.00 0.00 441 V 8.44 4.76 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 0.96 0.00 0.00 0.91 0.00 0.00 442 L 8.78 5.37 0.00 1.56 1.51 0.94 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 443 A 8.70 5.04 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 0.00 444 D 8.78 4.64 0.00 2.80 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 0.00 445 A 8.72 5.18 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 0.00 446 E 9.04 5.27 0.00 2.10 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 0.00 2.27 2.34 0.00 447 M 9.02 4.61 0.00 2.15 2.28 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.05 0.00 448 I 8.91 4.83 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.21 1.00 0.00 0.00 449 Q 8.93 4.49 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.32 0.00 0.00 0.00 0.00 0.00 2.20 2.33 0.00 450 D 9.39 4.31 0.00 2.84 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 0.00 451 G 8.24 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 0.00 0.00 0.00 452 E 7.76 4.58 0.00 2.09 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 2.21 2.21 0.00 453 V 8.47 4.11 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 0.85 0.00 0.00 1.02 0.00 0.00 454 V 8.22 4.28 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 0.70 0.00 0.00 0.85 0.00 0.00 455 K 7.49 4.36 0.00 1.75 1.63 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.76 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.59 1.11 7.81 456 R 7.81 5.17 0.00 1.54 1.70 0.00 3.17 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 457 Y 9.72 4.62 0.00 2.83 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 0.00 458 G 9.02 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 0.00 0.00 0.00 459 K 7.88 5.23 0.00 1.75 1.64 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.43 7.81 460 I 8.71 4.31 1.51 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.64 0.57 0.00 0.00 461 V 8.28 4.55 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 0.82 0.00 0.00 0.89 0.00 0.00 462 I 8.33 4.21 1.80 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.15 0.92 0.00 0.00 463 R 8.64 4.38 0.00 1.83 1.81 0.00 3.20 0.00 0.00 3.33 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 464 G 10.32 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 0.00 0.00 0.00 0.00 465 D 8.13 4.35 0.00 2.61 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 0.00 466 N 8.33 4.65 0.00 2.79 2.78 0.00 0.00 6.45 7.27 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 0.00 467 V 7.51 4.18 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 0.74 0.00 0.00 0.97 0.00 0.00 468 L 8.52 4.53 0.00 1.60 1.84 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 469 A 7.38 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 0.00 470 I 8.28 5.00 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.71 0.89 0.00 0.00 471 S 9.21 4.59 0.00 3.81 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 0.00 472 P 0.00 4.73 0.00 1.97 1.97 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 473 T 8.69 4.25 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 1.29 0.00 0.00