NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 503 D 4.5794 8.2076 120.1961 53.7675 41.4908 175.8545 504 F 4.1632 8.6485 123.3425 59.0509 38.0170 176.8250 505 C 4.4271 8.3896 119.5886 58.9886 40.9131 175.4321 506 L 4.3546 7.7528 118.0350 54.7408 41.8583 176.8002 507 E 4.2615 7.6583 118.6408 55.2257 30.0852 175.1479 508 P 4.4152 0.0000 0.0000 61.2874 32.1627 174.7442 509 P 3.6423 0.0000 0.0000 62.6410 31.4361 175.2951 510 Y 4.6624 7.9097 121.9321 56.0863 39.9470 175.3787 511 T 4.1665 8.2827 125.5289 64.8388 68.8678 176.1899 512 G 3.7481 6.7194 105.4966 44.0292 0.0000 171.2832 513 P 4.3296 0.0000 0.0000 64.9710 32.0204 177.9029 514 C 4.4623 7.8638 116.2498 57.1336 40.6447 173.0885 515 E 4.1999 8.3331 119.6751 56.4024 29.5984 176.3758 516 A 4.2128 7.8405 121.5800 51.5623 20.2819 177.7695 517 R 4.6457 8.1508 118.5815 54.3365 29.7255 172.8124 518 I 4.3876 8.3391 122.3945 59.1238 39.7156 174.9101 519 I 4.3558 8.3079 128.4893 60.9421 37.8565 175.2828 520 R 4.8076 8.3416 125.3419 54.5535 34.6004 173.7399 521 Y 5.6499 9.2979 117.0657 56.6768 41.2993 175.4396 522 F 5.7564 9.4450 116.5928 55.4754 42.0252 172.8394 523 Y 4.3921 9.9249 123.1615 57.4598 39.5835 174.4391 524 N 4.6420 8.2708 126.5047 51.6121 39.2683 174.9020 525 A 3.7508 8.6139 132.4881 55.5194 19.0154 179.6440 526 K 4.0638 7.8449 116.2870 57.7060 31.7540 181.0971 527 A 4.1185 8.0009 120.3963 52.2870 18.7842 177.6738 528 G 3.8225 8.4812 103.8151 45.7177 0.0000 173.0426 529 L 4.5592 6.8708 117.7923 54.4178 44.2329 174.3997 530 C 4.9913 8.5994 117.0451 56.3353 39.9775 173.4244 531 Q 4.8634 8.4634 122.3905 54.1180 32.3104 174.7607 532 T 4.9415 8.2997 110.6888 61.2471 70.8765 173.5567 533 F 4.9692 8.8036 116.6682 56.1709 41.9855 172.7607 534 V 4.3845 8.4124 119.7022 61.8723 32.4763 174.0884 535 Y 4.7922 8.8307 129.9185 55.9461 40.5627 176.3453 536 G 3.9575 8.1659 113.2721 46.1193 0.0000 174.9893 537 G 3.8637 6.5388 107.6204 45.2943 0.0000 172.4598 538 C 4.9377 6.8030 111.9168 54.8286 44.6715 173.0817 539 R 3.8454 8.8086 116.0368 57.2269 26.9313 176.9408 540 A 4.2684 8.3416 119.3750 52.3913 19.0930 178.3563 541 K 4.4086 8.3274 121.1269 54.8827 33.9642 177.2613 542 R 3.7146 8.1605 118.1152 59.0272 30.3505 177.6648 543 N 4.8282 7.9436 117.8165 51.2490 37.3415 173.4353 544 N 5.0609 6.5504 116.1092 52.7619 41.7573 173.2229 545 F 5.0762 9.4485 124.5725 55.6554 42.7173 176.3212 546 K 4.3131 8.8736 121.7164 58.2732 32.7820 177.7268 547 S 4.4911 7.7207 112.4990 55.5004 67.2663 174.6018 548 A 3.3470 7.3619 124.0764 54.8729 18.0628 180.0254 549 E 3.7705 7.7735 116.8030 59.6208 29.6185 179.0485 550 D 4.2729 8.0235 118.8674 57.3481 40.8840 177.9415 551 C 2.4500 7.6026 118.5701 59.1937 43.5810 175.7213 552 L 3.8107 7.8366 120.6763 57.6066 40.9417 179.4556 553 R 3.7695 7.6083 117.5845 59.7128 30.0949 178.4860 554 T 4.0730 7.5864 114.1308 66.2241 68.7362 175.5455 555 C 4.5237 7.9763 115.6512 55.2986 41.8079 174.4398 556 G 3.6187 7.1424 109.3541 46.9828 0.0000 173.4680 557 G 3.6262 8.8550 113.4933 46.8022 0.0000 173.1531 558 A 4.2096 7.9203 124.5751 52.1123 19.1450 176.4430 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 503 D 8.21 4.58 0.00 2.66 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.65 4.16 0.00 3.40 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 0.00 505 C 8.39 4.43 0.00 2.86 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 0.00 506 L 7.75 4.35 0.00 1.72 1.74 0.93 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 507 E 7.66 4.26 0.00 2.16 1.90 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 2.42 2.49 0.00 508 P 0.00 4.42 0.00 1.97 1.90 0.00 3.66 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 509 P 0.00 3.64 0.00 0.49 0.49 0.00 3.25 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.44 0.00 510 Y 7.91 4.66 0.00 2.83 2.96 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.28 4.17 4.13 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 1.18 0.00 0.00 512 G 6.72 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 0.00 0.00 0.00 513 P 0.00 4.33 0.00 2.17 2.19 0.00 3.76 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 1.96 2.01 0.00 514 C 7.86 4.46 0.00 2.81 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 0.00 515 E 8.33 4.20 0.00 1.89 1.89 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 2.18 2.19 0.00 516 A 7.84 4.21 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.15 4.65 0.00 1.73 1.76 0.00 3.33 0.00 0.00 3.19 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.00 518 I 8.34 4.39 2.03 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 1.22 0.54 0.98 0.00 0.00 519 I 8.31 4.36 1.81 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.41 0.73 0.00 0.00 520 R 8.34 4.81 0.00 0.97 1.91 0.00 3.43 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.55 0.00 521 Y 9.30 5.65 0.00 3.21 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 0.00 522 F 9.44 5.76 0.00 3.17 2.97 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 0.00 0.00 0.00 523 Y 9.92 4.39 0.00 2.98 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 0.00 524 N 8.27 4.64 0.00 2.24 2.46 0.00 0.00 6.68 7.37 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 0.00 525 A 8.61 3.75 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 0.00 526 K 7.84 4.06 0.00 1.79 1.74 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.26 7.81 527 A 8.00 4.12 1.19 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 0.00 0.00 0.00 528 G 8.48 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 0.00 529 L 6.87 4.56 0.00 1.67 1.69 0.80 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 530 C 8.60 4.99 0.00 2.90 3.19 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 0.00 531 Q 8.46 4.86 0.00 1.27 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.04 1.81 0.00 532 T 8.30 4.94 4.05 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 0.61 0.00 0.00 533 F 8.80 4.97 0.00 3.12 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 0.00 534 V 8.41 4.38 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 0.71 0.00 0.00 0.90 0.00 0.00 535 Y 8.83 4.79 0.00 2.51 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 536 G 8.17 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 537 G 6.54 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 0.00 538 C 6.80 4.94 0.00 3.05 2.97 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 0.00 0.00 0.00 539 R 8.81 3.85 0.00 2.20 2.32 0.00 3.31 0.00 0.00 3.33 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 540 A 8.34 4.27 1.04 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 0.00 0.00 541 K 8.33 4.41 0.00 1.77 1.72 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.17 1.22 7.81 542 R 8.16 3.71 0.00 1.26 0.87 0.00 2.21 0.00 0.00 2.77 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.30 0.00 543 N 7.94 4.83 0.00 3.17 2.88 0.00 0.00 6.70 7.79 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 0.00 544 N 6.55 5.06 0.00 2.69 2.58 0.00 0.00 7.08 7.02 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 0.00 545 F 9.45 5.08 0.00 3.32 2.97 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 0.00 0.00 0.00 546 K 8.87 4.31 0.00 1.84 1.95 0.00 1.77 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.49 7.81 547 S 7.72 4.49 0.00 3.99 3.88 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 0.00 0.00 0.00 548 A 7.36 3.35 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 549 E 7.77 3.77 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 550 D 8.02 4.27 0.00 2.89 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 0.00 551 C 7.60 2.45 0.00 2.80 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 0.00 552 L 7.84 3.81 0.00 1.78 1.60 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 553 R 7.61 3.77 0.00 1.87 2.00 0.00 3.24 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 1.63 0.00 554 T 7.59 4.07 4.09 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 1.59 0.00 0.00 555 C 7.98 4.52 0.00 2.58 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 0.00 0.00 0.00 0.00 556 G 7.14 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 0.00 557 G 8.86 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 558 A 7.92 4.21 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00