NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 501 R 4.3825 8.2544 119.6581 56.1402 31.9866 174.9538 502 V 3.7841 9.0550 124.0027 61.3002 31.9569 172.5684 503 C 5.2278 8.3594 128.5359 53.5755 45.9262 171.3359 504 P 4.5151 0.0000 0.0000 63.2470 31.3212 175.9969 505 K 4.4730 8.2515 117.9509 56.6247 32.6889 176.8772 506 I 4.0442 7.5471 118.0188 60.0808 39.0090 174.2993 507 L 4.3477 8.2682 128.2217 54.4076 42.6757 175.6445 508 M 4.8935 8.4400 125.2223 54.0876 35.5717 173.9192 509 E 4.6060 9.0125 125.7587 56.8801 30.2434 174.8845 510 C 4.8727 8.8657 115.5270 54.7558 44.8860 174.5989 511 K 4.1843 9.2631 119.3661 56.5668 33.9893 176.6300 512 K 4.7132 7.7111 115.9578 54.7049 35.9218 176.5544 513 D 4.4782 8.8358 119.7970 57.6905 40.7922 179.1703 514 S 4.3242 7.9385 111.5402 60.3428 63.1453 174.8212 515 D 4.4567 7.9166 120.6530 56.4482 40.8418 175.9758 516 C 4.6962 7.7503 116.3376 55.6718 42.8057 173.2162 517 L 4.4215 8.2537 120.6592 55.2676 43.4329 179.1171 518 A 3.5811 8.0769 124.8408 53.8855 18.0105 177.7664 519 E 4.6612 8.5410 116.0074 58.6156 29.6652 175.2970 520 C 4.8450 8.1382 116.5289 56.9150 42.3333 172.8059 521 I 4.6424 8.6368 114.4137 59.2148 41.2841 173.2173 522 C 4.9082 9.1549 123.3806 55.2136 45.1708 173.5905 523 L 4.4222 8.7534 126.9426 53.6844 42.4373 177.5903 524 E 3.8462 8.9065 120.9077 60.1272 29.2853 177.5460 525 H 4.5895 8.2322 112.4396 56.0204 28.6809 175.6905 526 G 3.7693 8.8837 107.6994 45.3354 0.0000 172.7950 527 Y 5.2029 7.4990 115.3716 55.6984 42.1194 175.8390 528 C 4.9537 9.3254 120.3222 57.4515 41.9180 174.1769 529 G 3.8574 8.9184 108.1781 47.1300 0.0000 173.2944 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 501 R 8.25 4.38 0.00 1.72 1.94 0.00 3.17 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 502 V 9.05 3.78 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 0.95 0.00 0.00 0.93 0.00 0.00 503 C 8.36 5.23 0.00 2.98 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 0.00 504 P 0.00 4.52 0.00 2.22 2.05 0.00 3.81 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 505 K 8.25 4.47 0.00 1.76 1.85 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.41 7.81 506 I 7.55 4.04 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.77 0.93 0.00 0.00 507 L 8.27 4.35 0.00 1.57 1.55 0.55 0.68 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 0.00 508 M 8.44 4.89 0.00 2.14 1.88 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 509 E 9.01 4.61 0.00 1.84 1.69 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 1.92 2.36 0.00 510 C 8.87 4.87 0.00 3.09 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 0.00 511 K 9.26 4.18 0.00 1.70 1.84 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.29 7.81 512 K 7.71 4.71 0.00 1.86 1.83 0.00 1.51 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.63 1.44 7.81 513 D 8.84 4.48 0.00 2.72 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 514 S 7.94 4.32 0.00 3.97 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 0.00 515 D 7.92 4.46 0.00 2.82 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 0.00 516 C 7.75 4.70 0.00 3.22 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 0.00 517 L 8.25 4.42 0.00 1.72 1.58 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 518 A 8.08 3.58 1.01 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 0.00 0.00 519 E 8.54 4.66 0.00 2.16 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 2.25 2.25 0.00 520 C 8.14 4.84 0.00 2.96 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 0.00 521 I 8.64 4.64 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.64 0.92 0.00 0.00 522 C 9.15 4.91 0.00 3.07 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 0.00 523 L 8.75 4.42 0.00 1.90 1.62 0.97 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 524 E 8.91 3.85 0.00 1.91 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 2.18 2.31 0.00 525 H 8.23 4.59 0.00 3.29 3.42 0.00 5.77 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 526 G 8.88 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 0.00 0.00 0.00 527 Y 7.50 5.20 0.00 2.92 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 0.00 528 C 9.33 4.95 0.00 2.90 3.05 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 0.00 0.00 0.00 0.00 529 G 8.92 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 0.00 0.00 0.00