NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 516 K 4.3000 8.2993 120.1351 55.9620 34.2116 176.2305 517 P 4.3293 0.0000 0.0000 61.2561 32.2891 173.8209 518 T 4.6696 8.6233 109.5254 59.8109 74.3313 175.6846 519 M 4.1358 8.4379 119.3789 58.8342 32.1673 177.6605 520 H 4.2840 8.0176 116.5084 58.6325 28.9418 177.6222 521 S 4.1513 8.0596 115.8451 61.2035 62.6882 176.3167 522 L 3.9344 7.5373 122.8139 58.1595 41.9440 179.0258 523 R 3.9930 7.8939 117.6964 59.4085 29.7638 178.7753 524 L 4.0191 7.8752 119.3958 57.9849 42.4476 178.9929 525 V 3.7705 7.8814 119.2263 64.8707 30.9619 178.5558 526 I 3.6606 7.3868 119.0261 63.6662 38.3553 177.7615 527 E 4.4199 7.8702 119.1155 54.2253 26.2525 174.8286 528 S 4.7417 7.1940 115.5787 59.5139 70.0800 175.3606 529 S 4.2896 7.6413 115.0084 57.7604 63.5526 173.3624 530 P 4.5540 0.0000 0.0000 62.4643 29.4444 174.9791 531 L 4.3665 7.2948 119.2239 54.9160 44.1487 176.4200 532 S 4.8244 7.8486 115.0073 58.5281 63.3595 174.2190 533 R 4.2309 8.5553 114.4058 58.8992 30.4645 178.0778 534 A 3.9984 7.8494 120.0132 55.3253 18.4790 179.3203 535 E 4.0627 8.1454 115.3832 59.2801 29.5413 179.0516 536 K 3.9351 8.0280 119.7816 59.2703 32.3609 178.2774 537 A 3.9634 8.2327 120.8176 55.1741 18.3606 179.0835 538 A 3.9340 8.4163 119.3828 55.6332 18.4618 179.1924 539 Y 3.8054 8.2765 117.7905 60.8844 38.8994 178.1279 540 V 3.5607 8.2152 119.5221 66.1233 31.5057 178.0924 541 K 3.8970 8.2705 118.1276 59.6517 31.7037 179.4103 542 S 4.0002 7.5831 114.0228 61.4551 62.9695 176.3468 543 L 3.8365 7.8048 123.2434 58.1975 41.6044 179.1067 544 S 4.1603 8.0542 114.3398 61.3444 62.7329 176.3515 545 K 4.1749 7.4988 118.0248 56.6288 31.7549 176.0899 546 C 4.3439 7.6010 113.8175 58.6205 30.1266 172.0467 547 K 4.4078 8.1502 122.2363 57.7361 38.4849 175.6128 548 T 4.4455 7.9101 106.7814 60.5741 67.7036 173.6685 549 D 4.8465 8.9925 118.8832 53.5249 46.7520 177.3200 550 Q 4.0605 8.1660 121.3776 58.2415 28.9145 177.7806 551 E 3.8501 7.6971 120.9076 59.3181 29.7464 178.7697 552 V 3.5993 7.7911 117.7538 65.8098 31.4595 177.6907 553 K 3.8830 8.5508 119.4580 59.5932 32.1061 178.4366 554 A 4.0320 7.9131 120.9169 55.4464 18.1040 179.8232 555 V 3.6796 7.9215 116.5673 66.2099 31.4654 177.9797 556 M 4.1388 8.4569 118.6157 58.5551 32.1742 177.6920 557 E 4.2028 8.5518 121.3280 58.5284 29.7167 178.5680 558 L 3.9243 7.7515 119.9611 58.0460 42.2276 178.7903 559 V 3.1298 7.2410 118.2563 66.1088 30.7956 177.5585 560 E 3.8799 7.7951 117.5588 59.7036 29.4883 179.3407 561 E 3.9693 7.9992 117.9988 59.3868 29.4871 178.7419 562 D 4.3239 8.4400 118.4207 57.5482 41.2121 178.6518 563 I 3.6596 7.5822 119.7999 64.4646 37.0101 178.1834 564 E 4.2378 7.8155 116.5905 58.2803 29.1427 178.8372 565 S 4.4543 7.6381 115.1379 60.7147 63.4426 175.9725 566 L 3.9415 7.9889 121.8589 58.6310 41.8541 178.7937 567 T 4.0149 8.3408 114.7113 64.0396 68.6040 174.5346 568 N 4.6342 7.6406 121.9725 53.7310 39.2147 173.8412 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 516 K 8.30 4.30 0.00 1.77 1.94 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.44 7.81 517 P 0.00 4.33 0.00 2.26 2.06 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 518 T 8.62 4.67 4.29 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 1.30 0.00 0.00 519 M 8.44 4.14 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.55 0.00 520 H 8.02 4.28 0.00 3.23 3.33 0.00 5.68 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 521 S 8.06 4.15 0.00 4.10 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 522 L 7.54 3.93 0.00 1.86 1.89 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 523 R 7.89 3.99 0.00 2.13 2.02 0.00 3.31 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 524 L 7.88 4.02 0.00 1.88 1.80 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 525 V 7.88 3.77 2.12 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 0.73 0.00 0.00 0.92 0.00 0.00 526 I 7.39 3.66 2.04 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.84 0.99 0.00 0.00 527 E 7.87 4.42 0.00 1.97 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 2.35 2.34 0.00 528 S 7.19 4.74 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 0.00 529 S 7.64 4.29 0.00 3.89 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 530 P 0.00 4.55 0.00 2.17 2.09 0.00 3.74 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 1.97 1.97 0.00 531 L 7.29 4.37 0.00 1.63 1.68 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 532 S 7.85 4.82 0.00 3.84 3.80 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 0.00 533 R 8.56 4.23 0.00 1.86 1.95 0.00 3.36 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 534 A 7.85 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 0.00 535 E 8.15 4.06 0.00 2.23 2.24 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 2.37 2.38 0.00 536 K 8.03 3.94 0.00 1.96 2.09 0.00 1.75 0.00 0.00 1.84 0.00 0.00 3.08 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.55 7.81 537 A 8.23 3.96 1.38 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 0.00 0.00 538 A 8.42 3.93 1.40 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 0.00 539 Y 8.28 3.81 0.00 3.17 3.08 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 0.00 0.00 0.00 0.00 540 V 8.22 3.56 2.31 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 1.05 0.00 0.00 1.07 0.00 0.00 541 K 8.27 3.90 0.00 1.97 1.79 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.50 7.81 542 S 7.58 4.00 0.00 3.61 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 0.00 543 L 7.80 3.84 0.00 0.97 1.59 0.90 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 544 S 8.05 4.16 0.00 3.95 3.89 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 0.00 545 K 7.50 4.17 0.00 1.84 1.91 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.41 7.81 546 C 7.60 4.34 0.00 3.11 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 0.00 547 K 8.15 4.41 0.00 1.81 1.87 0.00 1.54 0.00 0.00 1.84 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.25 1.30 7.81 548 T 7.91 4.45 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 0.00 549 D 8.99 4.85 0.00 2.80 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 550 Q 8.17 4.06 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.96 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 551 E 7.70 3.85 0.00 2.27 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 552 V 7.79 3.60 2.09 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 1.15 0.00 0.00 0.92 0.00 0.00 553 K 8.55 3.88 0.00 1.87 1.93 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.61 7.81 554 A 7.91 4.03 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 0.00 555 V 7.92 3.68 2.25 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 0.95 0.00 0.00 0.99 0.00 0.00 556 M 8.46 4.14 0.00 2.15 2.24 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.75 0.00 557 E 8.55 4.20 0.00 2.09 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 0.00 2.31 2.40 0.00 558 L 7.75 3.92 0.00 1.87 2.00 0.95 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 559 V 7.24 3.13 2.07 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 0.76 0.00 0.00 0.27 0.00 0.00 560 E 7.80 3.88 0.00 2.17 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 2.50 0.00 561 E 8.00 3.97 0.00 2.18 1.99 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 2.32 2.46 0.00 562 D 8.44 4.32 0.00 2.71 2.72 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 0.00 563 I 7.58 3.66 1.83 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 1.79 0.57 0.88 0.00 0.00 564 E 7.82 4.24 0.00 2.07 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 0.00 2.33 2.48 0.00 565 S 7.64 4.45 0.00 4.03 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 566 L 7.99 3.94 0.00 1.56 1.68 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 567 T 8.34 4.01 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 1.20 0.00 0.00 568 N 7.64 4.63 0.00 2.85 2.82 0.00 0.00 6.85 7.25 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