NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 438 R 4.2707 8.2549 119.7027 54.9129 31.7411 174.8716 439 P 3.8433 0.0000 0.0000 62.8238 31.6255 171.6844 440 C 4.3747 9.4239 128.7342 58.7403 30.1694 171.9860 441 L 4.2500 8.2407 125.2301 54.9339 41.2371 177.8737 442 V 4.1427 7.9350 118.1852 64.1661 33.4104 176.1406 443 C 4.7273 7.6900 110.6237 57.0051 30.3738 174.5625 444 S 4.2242 8.0269 113.5957 58.7010 60.2047 171.2088 445 D 4.5926 7.6165 119.8709 52.5995 42.1506 175.3060 446 E 3.9469 8.5000 120.6508 56.2411 29.3358 177.1463 447 A 4.3785 8.3779 127.6809 51.8090 19.3154 177.2225 448 S 4.3486 9.3528 116.2821 58.7318 63.6569 174.1454 449 G 4.2790 8.0683 108.0705 42.9793 0.0000 171.6246 450 C 4.0513 8.0825 117.9349 60.5441 28.5240 173.6962 451 H 5.0425 9.1030 121.7111 55.6918 31.6300 173.1904 452 Y 3.8543 9.6215 118.8749 59.3215 35.6716 172.6724 453 G 4.3034 8.5426 109.4254 45.3703 0.0000 174.8244 454 V 4.5082 8.4255 119.0425 60.3237 35.7104 174.5948 455 L 4.3724 8.4785 128.2569 55.9562 42.8871 175.8398 456 T 5.0132 8.1309 115.1873 59.4646 72.9309 173.3501 457 C 4.9224 8.4737 118.2268 57.3923 32.7464 174.2025 458 G 3.7875 8.4908 106.0318 48.5221 0.0000 175.3035 459 S 4.1641 8.2894 117.0727 61.7652 62.8123 176.2431 460 C 3.8861 8.1509 118.4274 63.8035 28.0713 175.5150 461 K 3.9594 8.1877 120.8349 59.1616 31.5939 178.4676 462 V 3.6039 7.8496 117.1706 66.2687 31.6614 177.8327 463 F 3.9826 8.2297 120.0730 61.7168 38.8863 177.0635 464 F 4.6206 8.5473 119.3872 60.4044 39.1362 177.1528 465 K 3.6714 7.6413 119.4082 59.5336 31.9192 179.0430 466 R 3.8403 8.2654 116.9924 58.8399 29.9629 178.6017 467 A 3.8193 7.7662 120.2442 55.0010 18.6074 178.9320 468 V 3.4285 6.7567 115.3338 66.2733 31.6160 177.8623 469 E 4.5392 7.7832 116.6829 56.2626 29.1322 176.6179 470 G 3.9157 7.4252 107.1091 43.0948 0.0000 173.2403 471 Q 3.8194 8.3783 125.0243 56.4404 29.2762 174.8902 472 H 4.5545 8.0404 120.9248 55.5219 33.2594 173.6872 473 N 4.7716 7.4222 114.9698 53.5153 39.6658 172.6527 474 Y 4.4748 7.6276 116.8433 57.2716 38.6443 175.2303 475 L 4.7676 8.4184 126.7127 52.9715 44.6456 175.6244 476 C 4.3760 8.7508 125.6312 59.4385 32.2232 172.4729 477 A 4.9275 8.5555 126.2320 51.8532 20.2140 176.2138 478 G 4.3424 7.5408 112.1923 47.0951 0.0000 174.4009 479 R 4.6080 8.4019 120.0920 55.6658 31.2590 174.2341 480 N 4.2894 8.5361 111.0794 54.0375 35.8826 175.0180 481 D 4.7196 7.7702 111.0454 53.1660 40.2212 175.3334 482 C 4.2640 8.1206 116.6402 60.7908 28.7400 173.6263 483 I 4.0686 7.9828 123.1409 60.9118 37.6425 175.9479 484 I 4.4848 8.0571 123.6806 59.9305 39.9251 173.9170 485 D 5.6053 8.0494 126.7590 51.7412 44.0732 175.6461 486 K 3.8995 8.8338 120.1669 60.6604 32.4722 179.6584 487 I 3.8802 7.7264 116.4350 64.0173 37.9908 177.2294 488 R 4.0889 7.8345 117.6525 57.6739 29.6964 178.1309 489 R 3.6889 7.3581 114.1992 60.0567 29.6702 177.8776 490 K 4.0045 8.0467 117.6873 58.8815 32.5871 177.4598 491 N 3.7506 7.2857 111.1151 56.8061 38.3983 175.3297 492 C 4.4318 8.4084 129.0006 58.2340 33.0008 171.2704 493 P 4.2969 0.0000 0.0000 65.1786 31.0620 178.3819 494 A 4.1411 8.0278 119.2984 55.5256 18.2730 179.4162 495 C 4.0506 7.9742 114.4656 62.9426 28.3494 175.7925 496 R 3.7149 7.7409 120.2773 59.8610 29.2637 177.8380 497 Y 4.5099 8.3368 118.1219 60.8213 39.1976 177.5420 498 R 3.7347 8.1222 119.4001 58.8327 30.0619 178.4934 499 K 4.0264 8.2112 118.8669 58.7394 32.3351 177.3113 500 C 4.7080 7.9553 116.6886 59.1727 28.7475 173.6013 501 L 4.5032 7.2031 120.6569 56.4601 48.5723 175.9340 502 Q 3.9177 7.9010 118.4115 58.4413 29.5855 176.6119 503 A 4.3005 7.4540 121.8009 50.6564 17.4041 175.0766 504 G 3.5023 6.8342 110.6273 43.4565 0.0000 173.9271 505 M 3.0569 7.1068 121.2646 55.9931 30.0400 175.1926 506 N 5.2572 8.9919 126.7913 51.4345 41.6989 174.1110 507 L 4.6680 8.7292 123.1442 54.4537 43.2556 172.8404 508 E 3.9692 9.5824 126.8742 55.1962 30.1015 173.8867 509 A 3.8733 8.8152 125.3370 54.0229 18.9558 177.4058 510 R 4.1111 8.6927 119.2054 56.8343 30.4085 176.2627 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 438 R 8.25 4.27 0.00 1.77 1.92 0.00 3.21 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.70 0.00 439 P 0.00 3.84 0.00 2.33 1.97 0.00 3.72 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 2.09 2.11 0.00 440 C 9.42 4.37 0.00 3.17 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 0.00 441 L 8.24 4.25 0.00 1.63 1.62 0.89 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 442 V 7.93 4.14 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 0.69 0.00 0.00 0.83 0.00 0.00 443 C 7.69 4.73 0.00 3.01 2.99 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 0.00 444 S 8.03 4.22 0.00 4.01 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 0.00 445 D 7.62 4.59 0.00 2.59 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 446 E 8.50 3.95 0.00 1.99 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 2.31 2.25 0.00 447 A 8.38 4.38 1.25 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 0.00 448 S 9.35 4.35 0.00 4.02 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 0.00 449 G 8.07 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 0.00 0.00 0.00 0.00 450 C 8.08 4.05 0.00 2.99 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 0.00 451 H 9.10 5.04 0.00 3.26 3.53 0.00 5.76 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 0.00 452 Y 9.62 3.85 0.00 3.18 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.54 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 0.00 0.00 0.00 0.00 454 V 8.43 4.51 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 0.98 0.00 0.00 1.00 0.00 0.00 455 L 8.48 4.37 0.00 1.79 1.52 0.87 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 456 T 8.13 5.01 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 1.20 0.00 0.00 457 C 8.47 4.92 0.00 3.20 3.09 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 0.00 458 G 8.49 3.79 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 0.00 0.00 0.00 459 S 8.29 4.16 0.00 3.89 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 0.00 460 C 8.15 3.89 0.00 2.97 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 K 8.19 3.96 0.00 2.18 1.96 0.00 1.62 0.00 0.00 1.54 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.95 1.79 7.81 462 V 7.85 3.60 2.15 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 1.02 0.00 0.00 1.10 0.00 0.00 463 F 8.23 3.98 0.00 3.15 3.18 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 0.00 464 F 8.55 4.62 0.00 3.31 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 0.00 465 K 7.64 3.67 0.00 1.82 1.88 0.00 1.78 0.00 0.00 1.88 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.53 7.81 466 R 8.27 3.84 0.00 1.64 1.91 0.00 3.21 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 467 A 7.77 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 468 V 6.76 3.43 1.67 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 0.83 0.00 0.00 0.14 0.00 0.00 469 E 7.78 4.54 0.00 1.95 1.88 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 2.25 2.35 0.00 470 G 7.43 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 0.00 471 Q 8.38 3.82 0.00 1.90 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.61 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 472 H 8.04 4.55 0.00 2.68 2.18 0.00 5.99 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 0.00 473 N 7.42 4.77 0.00 2.56 2.59 0.00 0.00 6.94 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 0.00 474 Y 7.63 4.47 0.00 3.07 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 0.00 475 L 8.42 4.77 0.00 1.58 1.56 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 476 C 8.75 4.38 0.00 3.02 2.84 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 0.00 477 A 8.56 4.93 1.26 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 0.00 0.00 0.00 478 G 7.54 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 0.00 0.00 0.00 0.00 479 R 8.40 4.61 0.00 1.89 1.88 0.00 3.37 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 480 N 8.54 4.29 0.00 2.86 2.88 0.00 0.00 6.94 8.10 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 0.00 481 D 7.77 4.72 0.00 2.71 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 0.00 482 C 8.12 4.26 0.00 2.96 2.89 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 0.00 483 I 7.98 4.07 1.85 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 1.40 0.73 0.93 0.00 0.00 484 I 8.06 4.48 1.80 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.54 0.79 0.00 0.00 485 D 8.05 5.61 0.00 2.70 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.83 3.90 0.00 1.69 1.82 0.00 1.87 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.57 7.81 487 I 7.73 3.88 1.86 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 1.51 0.92 0.90 0.00 0.00 488 R 7.83 4.09 0.00 1.96 1.90 0.00 3.21 0.00 0.00 3.37 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 489 R 7.36 3.69 0.00 1.89 2.16 0.00 3.04 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.59 0.00 490 K 8.05 4.00 0.00 1.77 1.95 0.00 1.80 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.47 7.81 491 N 7.29 3.75 0.00 2.76 2.69 0.00 0.00 6.92 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 0.00 492 C 8.41 4.43 0.00 2.99 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 0.00 493 P 0.00 4.30 0.00 1.91 1.61 0.00 3.73 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.21 0.00 494 A 8.03 4.14 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 0.00 495 C 7.97 4.05 0.00 2.96 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 0.00 496 R 7.74 3.71 0.00 1.76 1.41 0.00 2.21 0.00 0.00 2.42 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.40 0.00 497 Y 8.34 4.51 0.00 3.17 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 0.00 498 R 8.12 3.73 0.00 2.24 1.87 0.00 3.17 0.00 0.00 3.21 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 499 K 8.21 4.03 0.00 1.90 1.72 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.37 1.40 7.81 500 C 7.96 4.71 0.00 3.30 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 0.00 501 L 7.20 4.50 0.00 1.39 1.49 0.89 0.84 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 0.00 502 Q 7.90 3.92 0.00 2.20 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.09 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 503 A 7.45 4.30 1.18 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 0.00 0.00 0.00 504 G 6.83 3.50 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 0.00 505 M 7.11 3.06 0.00 1.53 2.04 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.81 0.00 506 N 8.99 5.26 0.00 2.72 2.77 0.00 0.00 7.05 7.77 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 0.00 507 L 8.73 4.67 0.00 1.76 1.80 1.03 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 508 E 9.58 3.97 0.00 2.15 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 2.31 2.43 0.00 509 A 8.82 3.87 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 0.00 510 R 8.69 4.11 0.00 1.93 1.89 0.00 3.25 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00