NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 437 S 4.3984 8.3193 117.0983 58.2042 63.9610 174.5067 438 H 4.6172 8.3211 126.7689 54.0167 26.3911 172.7256 439 M 5.0972 7.6676 118.8527 53.6987 35.9747 178.0175 440 C 4.2000 9.3301 123.8667 60.2490 32.2302 174.5822 441 L 4.2171 8.9556 125.7602 56.3737 41.8248 178.1612 442 V 4.0158 7.8344 117.9687 64.3736 32.2560 176.0315 443 C 5.2148 7.5448 110.0692 56.2020 30.5523 175.1377 444 S 4.0248 8.3320 115.4820 58.7578 60.9734 169.3126 445 D 4.6025 7.5402 120.6276 53.5361 42.7738 174.5583 446 E 4.4469 8.6389 122.2467 56.3947 29.7871 176.3045 447 A 4.5068 8.5940 129.4465 52.0092 18.9927 176.9969 448 S 4.5582 8.5319 113.5961 58.4583 65.4684 174.0429 449 G 3.6218 7.2782 106.7788 45.8114 0.0000 171.1889 450 C 4.6679 8.5040 120.8963 58.5475 31.0486 172.6094 451 H 4.5740 8.6617 125.1538 55.3180 30.3781 174.8105 452 Y 3.7174 9.2283 120.5635 59.1876 35.4943 172.3346 453 G 4.1042 9.1465 106.6412 44.9071 0.0000 174.3340 454 V 4.4452 7.7356 119.2554 60.4473 35.5846 174.1448 455 L 4.6489 8.5562 129.0607 55.8372 43.0774 175.6276 456 T 5.1952 8.8283 116.2240 60.3587 73.3394 173.0015 457 C 4.8562 8.5624 117.0059 56.7619 31.7983 174.9157 458 G 3.6218 8.6893 106.0883 47.9957 0.0000 175.9055 459 S 4.2269 8.0373 116.5727 61.4926 63.0951 176.2501 460 C 4.3526 8.0993 119.9181 61.9487 27.9624 175.6268 461 K 4.1476 8.2087 121.5127 60.0208 31.7446 179.3323 462 V 3.8443 7.8547 112.0041 64.0451 31.4330 178.3896 463 F 4.1085 8.5175 120.7084 61.1672 39.2287 176.9691 464 F 4.0282 8.6077 120.1677 61.1455 39.2800 176.7183 465 K 3.3862 8.0967 119.2060 59.7400 31.9250 178.8276 466 R 3.7338 8.1130 118.1097 58.9671 29.8147 179.0055 467 A 3.3397 7.2898 120.6315 54.8240 18.1843 179.9393 468 V 3.3039 6.9245 116.7313 65.9386 31.3052 178.2067 469 E 3.9115 7.6061 117.5400 59.1889 29.4742 179.0226 470 G 3.3985 7.5158 102.6594 44.5824 0.0000 173.1884 471 Q 3.2238 7.4513 119.5179 57.1310 26.7574 173.7637 472 H 4.1964 7.7358 114.1199 55.8809 29.7162 176.1514 473 N 4.8006 7.8615 120.0943 51.8518 38.5155 172.7948 474 Y 4.8255 7.8447 118.8341 56.3105 39.6874 174.8040 475 L 4.7975 8.3214 124.1984 53.0858 44.6932 175.6598 476 C 4.2653 8.7504 125.8806 59.4515 32.1288 172.7188 477 A 4.6634 8.6448 128.0466 51.8869 20.6864 176.9537 478 G 3.8176 8.3471 105.0989 46.0029 0.0000 175.5471 479 R 4.5490 8.8361 118.1140 56.1056 32.9386 174.8157 480 N 4.9849 8.6725 113.2073 53.9769 35.9273 174.7040 481 D 4.7484 7.3128 114.2967 52.0084 39.5187 175.3798 482 C 4.3191 7.9726 116.2923 60.5608 29.0868 174.0144 483 I 3.7922 8.1890 123.9205 61.3063 37.3941 175.9143 484 I 4.2429 8.3185 126.8492 59.5270 37.7013 173.9725 485 D 5.8500 7.8849 124.0718 49.2141 42.6195 176.1554 486 K 3.8024 8.7513 118.6097 59.8050 31.7545 178.0745 487 I 4.0279 7.6834 119.0095 63.7412 37.5893 177.6263 488 R 4.0822 8.6280 117.6188 57.0738 29.9586 178.6965 489 R 3.7965 7.8492 116.2051 59.0287 29.3664 178.6940 490 K 4.0072 7.3125 118.1952 58.9498 32.0167 178.4506 491 N 4.7623 8.0114 116.3130 54.4074 39.4181 174.7523 492 C 4.5720 7.5083 119.3803 55.7548 32.4477 171.9076 493 P 4.0842 0.0000 0.0000 64.6869 30.7781 177.9322 494 A 4.2579 7.8332 119.3020 55.7264 18.4046 179.4333 495 C 4.1636 8.0528 114.5607 62.6026 28.2287 176.2299 496 R 3.8377 8.3845 121.0981 59.4746 29.5525 178.0321 497 Y 4.7645 8.7525 119.7712 60.9264 38.8503 177.2869 498 R 3.8407 8.3646 119.9324 59.8029 30.0356 178.4594 499 K 3.9796 8.4672 118.1430 59.5436 32.0310 178.8355 500 C 4.0575 8.4162 117.0255 63.0725 28.1420 176.1880 501 L 4.0246 8.2755 120.2193 58.1721 41.0662 179.8027 502 Q 3.9859 8.2046 116.5877 58.7770 28.7221 178.2959 503 A 4.2180 8.0491 120.3621 53.2215 18.4233 178.2285 504 G 3.9404 7.8357 105.7162 45.3645 0.0000 173.8653 505 M 4.2226 7.3505 118.7238 55.3330 32.2723 175.7624 506 N 4.9345 8.4757 118.6627 52.7214 42.6393 174.7005 507 L 4.0898 8.9413 126.0157 57.5670 42.2501 177.7774 508 E 4.4827 7.9710 119.6886 55.4677 28.7641 177.1730 509 A 4.1067 7.9067 123.4966 55.3136 19.4806 179.8432 510 R 4.0293 8.2237 116.0889 59.9675 30.4918 178.6184 511 K 3.9553 8.4208 120.3626 58.6997 31.7986 179.3129 512 T 4.2027 7.5238 114.1538 60.9686 68.3156 176.3750 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 437 S 8.32 4.40 0.00 3.65 3.77 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 0.00 0.00 0.00 438 H 8.32 4.62 0.00 3.35 3.50 0.00 5.56 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 439 M 7.67 5.10 0.00 1.86 1.94 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.68 0.00 440 C 9.33 4.20 0.00 3.02 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 0.00 441 L 8.96 4.22 0.00 1.66 1.70 0.91 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 442 V 7.83 4.02 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 0.84 0.00 0.00 0.96 0.00 0.00 443 C 7.54 5.21 0.00 3.05 3.04 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 0.00 444 S 8.33 4.02 0.00 4.07 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 0.00 445 D 7.54 4.60 0.00 2.80 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 8.64 4.45 0.00 2.03 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 2.32 2.43 0.00 447 A 8.59 4.51 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 0.00 448 S 8.53 4.56 0.00 3.91 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 0.00 449 G 7.28 3.62 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 0.00 450 C 8.50 4.67 0.00 2.87 2.80 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 0.00 0.00 0.00 0.00 451 H 8.66 4.57 0.00 3.14 2.69 0.00 5.82 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 452 Y 9.23 3.72 0.00 3.11 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 0.00 453 G 9.15 4.10 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 0.00 454 V 7.74 4.45 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 0.91 0.00 0.00 0.92 0.00 0.00 455 L 8.56 4.65 0.00 1.80 1.55 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 456 T 8.83 5.20 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 1.27 0.00 0.00 457 C 8.56 4.86 0.00 3.17 3.24 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 0.00 458 G 8.69 3.62 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 0.00 459 S 8.04 4.23 0.00 4.09 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 0.00 460 C 8.10 4.35 0.00 3.06 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 0.00 461 K 8.21 4.15 0.00 1.75 2.08 0.00 1.16 0.00 0.00 1.10 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.56 7.81 462 V 7.85 3.84 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 0.79 0.00 0.00 1.12 0.00 0.00 463 F 8.52 4.11 0.00 3.27 3.37 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 0.00 0.00 0.00 0.00 464 F 8.61 4.03 0.00 3.48 3.38 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 0.00 465 K 8.10 3.39 0.00 1.87 1.96 0.00 1.37 0.00 0.00 1.57 0.00 0.00 3.32 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.43 7.81 466 R 8.11 3.73 0.00 1.90 1.85 0.00 3.33 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 467 A 7.29 3.34 0.11 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 0.00 468 V 6.92 3.30 1.60 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 0.85 0.00 0.00 0.28 0.00 0.00 469 E 7.61 3.91 0.00 1.81 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 2.22 2.35 0.00 470 G 7.52 3.40 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 0.00 471 Q 7.45 3.22 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.87 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 472 H 7.74 4.20 0.00 2.11 1.89 0.00 5.61 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 473 N 7.86 4.80 0.00 2.54 2.64 0.00 0.00 7.02 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 7.84 4.83 0.00 3.17 2.85 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 0.00 0.00 0.00 0.00 475 L 8.32 4.80 0.00 1.59 1.57 0.96 0.95 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 0.00 476 C 8.75 4.27 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 8.64 4.66 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 0.00 478 G 8.35 3.82 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 0.00 0.00 0.00 479 R 8.84 4.55 0.00 2.01 1.86 0.00 3.27 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 480 N 8.67 4.98 0.00 2.89 2.93 0.00 0.00 6.86 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 0.00 481 D 7.31 4.75 0.00 2.78 2.67 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 0.00 482 C 7.97 4.32 0.00 2.97 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 8.19 3.79 1.86 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 1.40 0.46 0.89 0.00 0.00 484 I 8.32 4.24 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.40 0.83 0.00 0.00 485 D 7.88 5.85 0.00 2.82 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 0.00 486 K 8.75 3.80 0.00 1.75 1.88 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.54 7.81 487 I 7.68 4.03 1.85 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 1.62 0.70 0.89 0.00 0.00 488 R 8.63 4.08 0.00 1.97 2.03 0.00 3.11 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 489 R 7.85 3.80 0.00 1.78 2.08 0.00 2.98 0.00 0.00 3.17 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.55 0.00 490 K 7.31 4.01 0.00 1.60 1.88 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.43 7.81 491 N 8.01 4.76 0.00 2.77 2.84 0.00 0.00 6.66 8.18 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 0.00 492 C 7.51 4.57 0.00 2.85 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 0.00 493 P 0.00 4.08 0.00 0.89 1.28 0.00 3.54 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.96 0.00 494 A 7.83 4.26 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 0.00 495 C 8.05 4.16 0.00 2.98 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 0.00 496 R 8.38 3.84 0.00 1.62 1.70 0.00 2.58 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.38 0.00 497 Y 8.75 4.76 0.00 3.56 3.41 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 0.00 498 R 8.36 3.84 0.00 2.03 2.16 0.00 3.16 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 1.79 1.70 0.00 499 K 8.47 3.98 0.00 2.03 1.87 0.00 1.74 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.73 7.81 500 C 8.42 4.06 0.00 3.64 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 0.00 501 L 8.28 4.02 0.00 1.82 1.69 1.19 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 502 Q 8.20 3.99 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 503 A 8.05 4.22 1.35 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 0.00 0.00 0.00 504 G 7.84 3.94 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 0.00 0.00 0.00 505 M 7.35 4.22 0.00 0.60 1.15 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.27 0.00 506 N 8.48 4.93 0.00 2.72 2.71 0.00 0.00 7.20 7.06 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 0.00 507 L 8.94 4.09 0.00 1.65 1.69 0.71 0.21 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 0.00 508 E 7.97 4.48 0.00 2.11 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 2.37 2.39 0.00 509 A 7.91 4.11 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 0.00 510 R 8.22 4.03 0.00 1.86 2.03 0.00 3.28 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 511 K 8.42 3.96 0.00 1.77 1.77 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.37 1.05 7.81 512 T 7.52 4.20 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 1.21 0.00 0.00