NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 503 D 4.5561 8.2076 120.1951 53.7775 41.3821 175.8601 504 F 4.2446 8.5673 123.2525 58.9340 38.0364 176.7230 505 C 4.4638 8.2673 119.0720 58.8752 40.9433 175.3450 506 L 4.4910 7.7658 117.9854 54.4093 41.7971 176.4704 507 E 4.3137 7.7043 119.4264 54.8608 30.1824 175.0553 508 P 4.3882 0.0000 0.0000 61.4992 32.1647 174.4330 509 P 3.5969 0.0000 0.0000 62.6975 31.3861 175.2040 510 Y 4.6488 7.9396 121.9161 56.1152 39.9183 175.3831 511 T 4.1656 8.2772 125.5153 64.8858 68.8794 176.2466 512 G 3.7470 6.7820 105.5029 43.9809 0.0000 171.3315 513 P 4.3080 0.0000 0.0000 65.1171 32.0445 177.9860 514 C 4.3767 7.8563 116.1764 57.3646 40.6424 172.9897 515 H 4.7730 8.3131 117.5841 55.9008 28.8688 175.3636 516 A 4.2367 7.6948 122.0853 51.5884 20.0976 177.7727 517 R 4.6542 8.1662 118.5994 54.3275 29.7923 172.6896 518 I 4.3887 8.3749 122.5682 59.1157 39.7153 174.7792 519 I 4.3343 8.3090 128.3949 60.8822 37.8732 175.2522 520 R 4.8240 8.2679 125.3540 54.5367 34.6575 173.7847 521 Y 5.6441 9.4406 117.2285 56.6469 41.3450 175.4261 522 F 5.7279 9.4193 116.5640 55.4274 42.0495 172.8854 523 Y 4.4185 10.0553 123.0729 57.5181 39.4723 174.4156 524 N 4.6089 8.4031 126.5935 51.6754 39.2656 174.9722 525 A 3.6621 8.6114 132.6448 55.6199 18.9593 179.5740 526 K 4.0510 7.8903 116.3579 57.8132 31.7644 180.8937 527 A 4.0469 7.9891 120.8474 52.7423 18.5318 177.7044 528 G 3.7929 8.6662 103.9521 45.8325 0.0000 172.9913 529 L 4.5836 6.8978 117.5127 54.4246 44.2169 174.4093 530 C 5.0234 8.6230 117.0964 56.3789 40.8052 173.3367 531 Q 4.8767 8.5349 122.1302 54.1103 32.5377 174.6057 532 T 4.9105 8.3207 110.5872 61.1789 70.7915 173.6976 533 F 4.9946 8.8147 116.9010 56.0277 42.0273 172.9105 534 V 4.3288 8.4251 119.9135 62.0934 32.3124 174.1598 535 Y 4.7846 8.9076 130.2419 56.0029 40.4220 176.4446 536 G 3.9465 8.1703 113.5494 46.2180 0.0000 174.9583 537 G 3.8797 6.2951 107.2345 45.3424 0.0000 172.4853 538 C 4.9324 6.9410 112.0384 54.9599 44.5013 173.1247 539 R 3.8708 8.8482 116.4247 57.0910 27.0022 176.8326 540 A 4.2323 8.4374 119.3204 52.5369 18.9404 178.4355 541 K 4.3961 8.2898 120.8720 54.8332 34.0084 177.2610 542 R 3.6683 8.1452 118.0930 59.1055 30.3006 177.6947 543 N 4.8307 7.9419 117.7335 51.2394 37.3230 173.5631 544 N 5.0001 6.5636 115.9444 52.8764 41.4475 173.1931 545 F 5.0665 9.5467 124.8750 55.6370 42.5006 176.5183 546 K 4.4438 8.8616 121.7659 58.2006 32.7305 177.6816 547 S 4.4840 7.7162 112.5746 55.5409 67.2602 174.6095 548 A 3.3712 7.3740 124.1917 54.9047 18.0154 180.0325 549 E 3.7859 7.7771 116.7664 59.6268 29.6295 179.0527 550 D 4.2615 7.9731 118.8689 57.3806 40.8300 178.0098 551 C 2.4500 7.6814 118.7541 59.1743 44.5074 175.7225 552 L 3.7654 8.0083 120.9302 57.5372 40.9053 179.5167 553 R 3.7914 7.7080 117.9942 59.6480 30.1133 178.4977 554 T 4.0728 7.5783 114.2584 66.2190 69.0724 175.5254 555 C 4.5321 8.0726 116.9950 55.5263 41.6126 174.0371 556 G 3.9093 6.9307 108.7064 46.9349 0.0000 173.5684 557 G 3.7872 8.4374 111.4436 46.0965 0.0000 173.3295 558 A 4.1057 7.2792 127.5016 51.9999 18.6132 178.1976 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 4.56 0.00 2.66 2.62 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 0.00 504 F 8.57 4.24 0.00 3.39 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 0.00 505 C 8.27 4.46 0.00 2.88 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 0.00 506 L 7.77 4.49 0.00 1.67 1.74 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 507 E 7.70 4.31 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 2.41 2.45 0.00 508 P 0.00 4.39 0.00 2.08 2.00 0.00 3.77 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 1.96 1.94 0.00 509 P 0.00 3.60 0.00 0.53 0.49 0.00 3.25 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.44 0.00 510 Y 7.94 4.65 0.00 2.82 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 1.21 0.00 0.00 512 G 6.78 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 4.31 0.00 2.14 2.18 0.00 3.77 0.00 0.00 3.70 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 4.38 0.00 2.82 2.93 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 0.00 0.00 0.00 515 H 8.31 4.77 0.00 3.08 3.22 0.00 5.71 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 0.00 516 A 7.69 4.24 1.18 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 0.00 0.00 0.00 517 R 8.17 4.65 0.00 1.73 1.76 0.00 3.34 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 1.45 1.53 0.00 518 I 8.37 4.39 2.01 0.00 0.00 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 1.21 0.66 0.98 0.00 0.00 519 I 8.31 4.33 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 1.27 0.43 0.74 0.00 0.00 520 R 8.27 4.82 0.00 0.95 1.97 0.00 3.42 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.56 0.00 521 Y 9.44 5.64 0.00 3.20 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 0.00 522 F 9.42 5.73 0.00 3.09 2.93 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 0.00 0.00 0.00 523 Y 10.06 4.42 0.00 2.95 3.18 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 0.00 524 N 8.40 4.61 0.00 2.21 2.45 0.00 0.00 6.66 7.93 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 0.00 525 A 8.61 3.66 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 4.05 0.00 1.74 1.74 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.26 7.81 527 A 7.99 4.05 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 8.67 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 0.00 529 L 6.90 4.58 0.00 1.68 1.70 0.78 0.60 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 0.00 530 C 8.62 5.02 0.00 2.91 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 8.53 4.88 0.00 1.27 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.82 0.00 0.00 0.00 0.00 0.00 2.11 1.91 0.00 532 T 8.32 4.91 4.04 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 0.64 0.00 0.00 533 F 8.81 4.99 0.00 3.04 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 8.43 4.33 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 0.71 0.00 0.00 0.91 0.00 0.00 535 Y 8.91 4.78 0.00 2.52 2.69 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 0.00 0.00 0.00 536 G 8.17 3.95 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 0.00 0.00 0.00 537 G 6.30 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 0.00 0.00 0.00 538 C 6.94 4.93 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 8.85 3.87 0.00 2.21 2.29 0.00 3.30 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 540 A 8.44 4.23 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 0.00 541 K 8.29 4.40 0.00 1.76 1.72 0.00 1.48 0.00 0.00 1.55 0.00 0.00 2.56 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.17 1.16 7.81 542 R 8.15 3.67 0.00 1.15 0.68 0.00 2.30 0.00 0.00 2.79 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.29 0.00 543 N 7.94 4.83 0.00 3.19 2.89 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 6.56 5.00 0.00 2.68 2.58 0.00 0.00 7.09 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 9.55 5.07 0.00 3.23 2.98 0.00 0.00 0.00 0.00 0.00 0.00 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 8.86 4.44 0.00 1.84 1.95 0.00 1.78 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.49 7.81 547 S 7.72 4.48 0.00 3.98 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 7.37 3.37 0.95 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 0.00 0.00 549 E 7.78 3.79 0.00 1.98 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 7.97 4.26 0.00 2.91 2.86 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 0.00 551 C 7.68 2.45 0.00 2.91 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 0.00 552 L 8.01 3.77 0.00 1.57 1.61 0.87 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 553 R 7.71 3.79 0.00 1.85 1.99 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 1.62 0.00 554 T 7.58 4.07 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 1.60 0.00 0.00 555 C 8.07 4.53 0.00 2.64 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 0.00 0.00 0.00 0.00 556 G 6.93 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 557 G 8.44 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 0.00 558 A 7.28 4.11 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