NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 446 K 4.2133 8.3144 120.1327 55.8910 34.2588 175.4074 447 K 4.0631 7.8118 119.2105 54.8643 33.4564 174.0233 448 Q 4.3543 9.1320 128.4288 53.6348 28.9708 175.0000 449 K 4.1257 8.2262 122.0384 55.8974 32.7796 177.3369 450 W 4.3289 8.9034 123.9439 56.7614 29.7316 177.0145 451 T 4.3452 8.7900 114.5088 60.7756 70.8256 176.1015 452 V 3.5492 8.1666 120.7829 66.0806 31.3767 177.6061 453 E 3.5155 7.9150 118.3745 59.2957 29.4519 178.4508 454 E 3.6887 7.8238 118.3538 59.5924 29.5337 179.6678 455 S 4.3782 8.3715 115.1509 61.6300 62.7884 176.5972 456 E 4.0174 8.2016 121.4329 59.1239 29.0401 179.4409 457 W 4.0894 7.6211 119.2186 59.4499 28.9784 178.7707 458 V 3.7671 8.1767 118.3582 65.9858 31.0530 178.0209 459 K 3.7855 8.3851 119.1863 59.4800 32.0984 178.5704 460 A 4.1255 8.4558 121.6311 55.0924 18.2521 179.8861 461 G 3.7617 7.9708 104.6058 47.0437 0.0000 176.2154 462 V 3.4035 7.7134 120.8066 65.6611 31.1535 178.2285 463 Q 3.9210 7.9000 117.1106 58.4003 28.5401 178.1736 464 K 3.9461 7.8646 120.0127 58.7061 32.4898 177.5622 465 Y 4.6199 8.4112 114.3810 56.4111 39.5561 177.1817 466 G 3.9946 7.6850 104.8553 45.0569 0.0000 172.9040 467 E 3.5806 7.9920 118.5860 57.0823 30.0210 177.1931 468 G 3.6197 6.8413 109.7162 45.6848 0.0000 174.3148 469 N 4.4355 6.3263 118.4950 52.3879 36.3962 176.6354 470 W 4.4228 7.0167 122.8076 59.8404 29.7192 178.1812 471 A 4.0011 8.0697 120.1181 55.0846 17.8716 179.3640 472 A 3.6656 7.7071 118.7649 55.1822 18.2599 179.8113 473 I 3.9821 7.5580 118.1310 64.6479 37.0084 178.5193 474 S 4.3197 8.2663 113.2215 61.4704 62.2664 175.8931 475 K 4.1237 7.9362 121.4007 59.3139 32.0468 178.0189 476 N 4.3010 8.1641 116.2216 54.4624 39.4601 174.2507 477 Y 4.1787 7.1521 117.8818 55.1115 40.8420 174.1285 478 P 4.3587 0.0000 0.0000 62.2041 30.7084 176.8302 479 F 4.5009 7.5371 116.1553 58.4581 39.9633 175.4461 480 V 4.3376 8.4295 123.0148 62.1954 33.0262 175.0240 481 N 4.2745 8.9474 124.6750 54.5657 36.1601 174.1057 482 R 4.6173 8.0593 114.6479 54.2600 33.6117 175.9759 483 T 4.5949 8.0401 111.2105 59.7788 72.6850 175.4560 484 A 4.0537 8.3660 122.6820 55.2228 18.2633 180.1530 485 V 3.3971 7.6828 116.4166 66.3963 31.6339 178.0122 486 M 4.1237 8.0148 118.4528 58.4518 31.7735 178.8529 487 I 3.4848 7.7829 119.9806 63.9980 37.2928 178.2695 488 K 2.0000 7.3694 120.3784 58.9229 31.8577 178.5554 489 D 4.1459 7.9612 119.3894 57.2760 40.6955 178.8018 490 R 3.3134 7.5906 119.4429 58.7105 29.7021 178.3943 491 W 4.2951 7.9158 128.4054 60.3041 30.7483 177.8726 492 R 3.6962 7.7621 118.6351 59.7066 29.4868 178.7077 493 T 3.7317 7.4954 115.2848 66.8115 68.3386 176.6305 494 M 3.8867 8.1376 120.9662 58.2408 31.8949 179.0283 495 K 3.5529 7.5298 118.6634 59.3643 31.9295 179.6801 496 R 3.8884 7.4873 117.0826 58.6388 30.0252 178.1266 497 L 4.3744 7.5768 116.1822 53.9756 41.9357 177.3714 498 G 3.8245 7.5195 106.9687 46.5278 0.0000 174.6117 499 M 4.2527 7.9953 118.4064 55.5107 32.4880 176.2816 500 N 4.5822 7.6995 121.3229 53.0005 37.6316 174.8496 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 446 K 8.31 4.21 0.00 1.74 1.95 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.50 7.81 447 K 7.81 4.06 0.00 1.74 1.66 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.33 1.55 7.81 448 Q 9.13 4.35 0.00 1.87 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.69 0.00 0.00 0.00 0.00 0.00 2.20 2.28 0.00 449 K 8.23 4.13 0.00 1.75 1.80 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.43 7.81 450 W 8.90 4.33 0.00 3.27 3.25 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 0.00 451 T 8.79 4.35 4.19 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 1.21 0.00 0.00 452 V 8.17 3.55 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 0.98 0.00 0.00 0.92 0.00 0.00 453 E 7.92 3.52 0.00 1.80 1.54 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 0.00 1.47 1.83 0.00 454 E 7.82 3.69 0.00 2.45 2.51 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 2.45 2.27 0.00 455 S 8.37 4.38 0.00 4.07 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 0.00 456 E 8.20 4.02 0.00 1.95 1.97 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 2.31 2.58 0.00 457 W 7.62 4.09 0.00 3.35 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.18 3.77 2.42 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 1.21 0.00 0.00 1.23 0.00 0.00 459 K 8.39 3.79 0.00 2.16 2.03 0.00 2.05 0.00 0.00 1.77 0.00 0.00 3.18 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.76 7.81 460 A 8.46 4.13 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.97 3.76 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 0.00 0.00 0.00 462 V 7.71 3.40 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 0.68 0.00 0.00 -0.23 0.00 0.00 463 Q 7.90 3.92 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.73 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 464 K 7.86 3.95 0.00 1.74 1.73 0.00 1.62 0.00 0.00 1.27 0.00 0.00 2.61 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.32 1.10 7.81 465 Y 8.41 4.62 0.00 2.98 2.83 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 0.00 466 G 7.69 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 0.00 467 E 7.99 3.58 0.00 1.96 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 2.44 2.37 0.00 468 G 6.84 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 0.00 469 N 6.33 4.44 0.00 2.76 2.53 0.00 0.00 6.85 7.55 0.00 0.00 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 W 7.02 4.42 0.00 3.38 3.30 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 0.00 471 A 8.07 4.00 1.30 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 0.00 472 A 7.71 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 473 I 7.56 3.98 2.23 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.82 1.27 0.00 0.00 474 S 8.27 4.32 0.00 3.89 4.12 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 0.00 475 K 7.94 4.12 0.00 1.80 1.91 0.00 1.80 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.42 7.81 476 N 8.16 4.30 0.00 2.87 2.74 0.00 0.00 7.09 7.59 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 0.00 477 Y 7.15 4.18 0.00 2.60 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 0.00 0.00 0.00 478 P 0.00 4.36 0.00 1.83 1.76 0.00 2.20 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.39 0.00 479 F 7.54 4.50 0.00 3.15 3.11 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 0.00 480 V 8.43 4.34 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 0.87 0.00 0.00 1.08 0.00 0.00 481 N 8.95 4.27 0.00 2.99 2.84 0.00 0.00 6.93 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 0.00 482 R 8.06 4.62 0.00 1.67 1.70 0.00 3.22 0.00 0.00 2.34 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 483 T 8.04 4.59 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 1.22 0.00 0.00 484 A 8.37 4.05 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 0.00 485 V 7.68 3.40 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 1.09 0.00 0.00 0.93 0.00 0.00 486 M 8.01 4.12 0.00 2.49 2.37 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.67 0.00 487 I 7.78 3.48 1.94 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.64 0.98 0.00 0.00 488 K 7.37 2.00 0.00 0.79 1.38 0.00 1.36 0.00 0.00 1.52 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.79 1.28 7.81 489 D 7.96 4.15 0.00 2.83 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 490 R 7.59 3.31 0.00 0.67 0.93 0.00 2.60 0.00 0.00 2.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.12 0.00 491 W 7.92 4.30 0.00 3.33 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 0.00 492 R 7.76 3.70 0.00 1.86 1.96 0.00 3.09 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 493 T 7.50 3.73 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 1.09 0.00 0.00 494 M 8.14 3.89 0.00 1.71 1.87 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 2.59 2.51 0.00 495 K 7.53 3.55 0.00 1.54 1.58 0.00 1.52 0.00 0.00 1.67 0.00 0.00 2.67 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.72 0.25 7.81 496 R 7.49 3.89 0.00 1.85 1.91 0.00 3.07 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.78 0.00 497 L 7.58 4.37 0.00 1.52 1.63 0.86 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 498 G 7.52 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 0.00 499 M 8.00 4.25 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.43 0.00 500 N 7.70 4.58 0.00 2.74 1.84 0.00 0.00 5.94 7.56 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