NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 446 K 4.2908 8.3149 120.1343 56.1027 33.5206 174.9366 447 K 4.1100 8.5345 123.1056 55.0412 33.1189 174.8797 448 Q 4.4046 8.5008 122.6290 53.5442 30.2538 175.1655 449 K 4.0942 8.4422 124.6619 56.0727 32.8292 176.4301 450 W 4.3086 8.8756 126.2327 56.6985 29.9029 176.9733 451 T 4.3789 8.7275 114.1641 60.6104 70.9140 176.3722 452 V 3.5454 8.0794 120.2030 66.0495 31.6881 177.3649 453 E 3.4643 7.9143 118.4420 59.2919 29.4007 178.4806 454 E 3.8851 7.8028 118.3147 59.6201 29.5618 179.6378 455 S 4.3669 8.3648 115.1665 61.6735 62.7941 176.6234 456 E 4.0696 8.3419 121.4536 59.0569 29.1389 179.4344 457 W 4.1144 7.8427 118.8578 59.4624 28.9567 178.7133 458 V 3.7548 8.3350 118.3422 65.9083 31.0979 177.8949 459 K 3.7392 8.3347 119.0751 59.6139 32.0149 178.5716 460 A 4.1330 8.4290 121.4864 55.0480 18.2917 179.8465 461 G 3.7204 8.2330 104.7300 47.0442 0.0000 176.1599 462 V 3.3567 7.7481 120.9597 65.4536 31.1406 177.9788 463 Q 3.8745 7.6040 118.3834 58.9145 29.0066 177.9048 464 K 3.8580 8.0174 119.5371 59.4575 32.4380 177.8036 465 Y 4.4208 8.2696 114.4215 56.9544 39.2317 176.8795 466 G 3.8510 7.6142 107.1510 45.1909 0.0000 172.6350 467 E 3.4913 8.0795 122.6882 57.1143 30.1186 176.9035 468 G 3.6076 6.6077 113.9334 45.2176 0.0000 173.7607 469 N 4.4987 6.6554 119.4100 51.9862 37.4092 176.1502 470 W 4.4211 7.1137 120.6846 59.5735 29.8110 178.3189 471 A 4.0046 8.0826 120.2878 55.0473 17.6819 179.3258 472 A 3.6764 7.7164 117.5522 55.3144 18.6318 179.4425 473 I 3.9955 7.4310 117.8849 64.6758 36.9825 178.6724 474 S 4.3344 8.4573 113.6000 60.4989 62.3059 175.2838 475 K 4.4620 7.7426 118.3484 56.8929 32.9705 176.5096 476 N 4.7650 7.7416 116.2501 53.1280 39.1196 173.6303 477 Y 4.2090 7.3614 115.4305 55.1938 41.7398 175.0870 478 P 4.0397 0.0000 0.0000 61.9293 30.5520 177.2415 479 F 4.6738 7.7664 117.1573 57.6782 39.4233 175.4477 480 V 4.4086 8.0132 122.3960 62.2946 34.0059 175.2395 481 N 4.3436 9.0922 123.3368 54.4494 35.8443 174.0471 482 R 4.4858 7.4498 113.5789 54.1485 33.0554 176.5777 483 T 4.3960 8.2684 113.4010 60.4470 71.8853 175.5144 484 A 4.0401 8.3787 122.4508 55.2696 18.2567 180.0450 485 V 3.4043 7.6820 116.3851 66.3372 31.6835 178.0376 486 M 4.0865 7.9660 118.1699 58.3821 31.7870 178.8641 487 I 3.4384 7.6766 120.0486 63.9951 37.2489 178.2093 488 K 2.0000 7.2366 120.3241 59.0175 31.7555 178.5817 489 D 4.1691 7.7442 119.0336 57.1102 40.5776 178.7633 490 R 3.3365 7.4042 119.4426 58.6188 29.7306 178.3313 491 W 4.3288 7.9130 128.3820 60.3048 30.7409 177.8483 492 R 3.6932 7.8011 118.6643 59.7448 29.5060 178.5726 493 T 3.7178 7.5690 115.3246 66.8884 68.3750 176.4442 494 M 3.8757 8.0660 120.8459 58.3655 31.7618 179.0192 495 K 3.6235 7.5737 118.5730 59.3399 31.8708 179.6814 496 R 3.8767 7.4538 117.4711 58.5245 30.0271 178.0138 497 L 4.4312 7.5739 116.2428 53.6852 41.9202 176.6894 498 G 3.7887 7.5808 106.7697 47.3287 0.0000 174.5287 499 M 4.4798 8.2345 117.3104 54.4892 32.7579 176.1919 500 N 4.4252 7.7302 122.0374 52.9046 37.7290 174.8766 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 4.29 0.00 1.76 1.81 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.47 7.81 447 K 8.53 4.11 0.00 1.84 1.77 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.49 7.81 448 Q 8.50 4.40 0.00 1.86 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.91 0.00 0.00 0.00 0.00 0.00 2.21 2.16 0.00 449 K 8.44 4.09 0.00 1.72 1.73 0.00 1.72 0.00 0.00 1.81 0.00 0.00 3.14 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.61 7.81 450 W 8.88 4.31 0.00 3.32 3.26 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 0.00 451 T 8.73 4.38 4.18 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 1.16 0.00 0.00 452 V 8.08 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 7.91 3.46 0.00 1.75 1.53 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 1.47 1.47 0.00 454 E 7.80 3.89 0.00 2.46 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.27 0.00 455 S 8.36 4.37 0.00 4.08 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 0.00 456 E 8.34 4.07 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 2.51 2.46 0.00 457 W 7.84 4.11 0.00 3.46 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 3.75 2.44 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 1.22 0.00 0.00 1.25 0.00 0.00 459 K 8.33 3.74 0.00 2.21 2.08 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.24 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.77 7.81 460 A 8.43 4.13 1.41 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 0.00 0.00 461 G 8.23 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 3.36 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 -0.06 0.00 0.00 463 Q 7.60 3.87 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 464 K 8.02 3.86 0.00 1.70 1.63 0.00 1.67 0.00 0.00 1.37 0.00 0.00 2.87 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.30 1.07 7.81 465 Y 8.27 4.42 0.00 3.02 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 0.00 466 G 7.61 3.85 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 0.00 0.00 0.00 467 E 8.08 3.49 0.00 1.92 1.84 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 2.44 2.54 0.00 468 G 6.61 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 6.66 4.50 0.00 2.74 2.64 0.00 0.00 6.84 7.05 0.00 0.00 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 7.11 4.42 0.00 3.40 3.31 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 0.00 471 A 8.08 4.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.72 3.68 0.81 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 0.00 0.00 473 I 7.43 4.00 2.20 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 1.78 1.19 1.22 0.00 0.00 474 S 8.46 4.33 0.00 3.99 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 0.00 475 K 7.74 4.46 0.00 1.93 1.88 0.00 1.54 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.53 1.35 7.81 476 N 7.74 4.77 0.00 2.56 2.58 0.00 0.00 6.69 7.58 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 0.00 477 Y 7.36 4.21 0.00 2.50 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 0.00 0.00 0.00 478 P 0.00 4.04 0.00 1.45 1.84 0.00 2.20 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 479 F 7.77 4.67 0.00 3.13 3.06 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 0.00 0.00 0.00 480 V 8.01 4.41 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 1.07 0.00 0.00 1.06 0.00 0.00 481 N 9.09 4.34 0.00 2.89 2.87 0.00 0.00 6.87 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 7.45 4.49 0.00 1.76 1.73 0.00 2.75 0.00 0.00 2.96 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.40 0.00 483 T 8.27 4.40 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 8.38 4.04 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.92 0.00 0.00 486 M 7.97 4.09 0.00 2.53 2.39 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.68 0.00 487 I 7.68 3.44 1.92 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.86 0.92 0.00 0.00 488 K 7.24 2.00 0.00 0.79 1.33 0.00 1.35 0.00 0.00 1.52 0.00 0.00 2.78 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.69 1.19 7.81 489 D 7.74 4.17 0.00 2.75 2.55 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 0.00 0.00 0.00 0.00 490 R 7.40 3.34 0.00 0.67 0.97 0.00 2.66 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 0.61 1.24 0.00 491 W 7.91 4.33 0.00 3.33 3.07 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 0.00 492 R 7.80 3.69 0.00 1.85 1.94 0.00 3.10 0.00 0.00 3.12 7.55 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 7.57 3.72 4.18 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 1.10 0.00 0.00 494 M 8.07 3.88 0.00 1.75 1.89 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.52 0.00 495 K 7.57 3.62 0.00 1.60 1.59 0.00 1.40 0.00 0.00 1.39 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.78 0.36 7.81 496 R 7.45 3.88 0.00 1.82 1.91 0.00 3.23 0.00 0.00 3.11 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 497 L 7.57 4.43 0.00 1.54 1.63 0.87 0.94 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 0.00 498 G 7.58 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 0.00 499 M 8.23 4.48 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.40 0.00 500 N 7.73 4.43 0.00 2.28 1.81 0.00 0.00 5.99 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