NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3204 8.2649 123.5822 51.4223 19.9517 176.4924 2 V 3.5449 8.1023 112.8912 60.9453 32.4715 175.2563 3 Q 4.3375 9.0768 125.2644 56.0286 28.8229 176.7507 4 Q 4.3395 7.7275 110.4839 56.0359 28.6718 176.2375 5 N 4.9502 7.9317 115.1268 52.1069 42.1546 173.5085 6 K 4.7022 7.6534 123.0907 52.6665 35.8265 173.4017 7 P 4.5523 0.0000 0.0000 62.5264 32.4598 177.4072 8 T 4.0505 8.3516 110.6116 64.5799 68.0542 174.8262 9 R 4.2115 8.6160 122.6860 56.7081 31.6596 181.1981 10 S 3.0388 8.1547 111.3557 58.4738 64.2290 174.6214 11 K 3.8160 8.8725 131.5590 59.8760 32.3451 176.6348 12 R 4.1675 7.4020 118.2606 57.4581 30.5814 178.2506 13 G 3.7613 8.3681 112.8158 48.4899 0.0000 174.1664 14 M 4.1217 8.2082 120.1425 58.2422 32.3420 177.9617 15 R 4.0301 8.2435 113.5481 57.1572 29.6589 178.0181 16 R 3.7898 8.8721 121.5050 60.0577 29.5588 179.1559 17 S 3.2333 6.4215 106.0672 58.9382 64.8210 173.5556 18 H 4.7341 7.8604 119.1585 55.1344 29.3843 175.6909 19 D 4.5303 8.0458 118.6811 54.6255 40.7537 176.2343 20 A 4.1725 7.6126 122.5040 51.8516 18.9817 176.9010 21 L 4.3181 8.0987 120.2769 54.3089 42.8199 176.7916 22 T 4.3662 8.1099 109.4374 60.1197 69.3874 175.0637 23 A 4.3317 8.2433 132.6134 50.8108 16.7729 176.4635 24 V 3.6655 7.5137 114.4693 60.8804 32.5356 177.2411 25 T 4.3262 8.2037 115.0844 61.3298 70.3405 173.3405 26 S 4.7046 7.9192 111.7955 57.6226 64.8789 173.5435 27 L 4.7556 8.3703 127.0360 52.7167 43.2848 176.9581 28 S 3.9241 9.2441 118.8965 62.1055 63.4942 176.4602 29 V 3.0997 7.1435 117.0649 63.5563 28.0969 173.9474 30 D 4.5800 8.1806 123.5875 53.4814 39.4618 177.6919 31 K 4.0433 8.1813 122.0024 59.8971 32.2843 176.6088 32 T 4.6315 7.8292 114.6532 61.7710 68.8015 173.9747 33 S 4.5538 8.2778 114.2429 58.3424 63.0460 175.8392 34 G 4.0254 7.3362 109.1369 47.4634 0.0000 174.1522 35 E 4.1395 8.0693 112.7323 56.0848 29.5918 177.2769 36 K 4.6210 7.5624 119.6402 56.1620 32.9957 175.3381 37 H 4.9463 8.1003 119.3741 54.1524 31.7351 176.8926 38 L 3.5520 6.8065 117.6005 60.0713 42.3117 178.1633 39 R 4.3508 7.5404 117.6894 54.6388 31.9821 174.3345 40 H 4.2704 7.8421 116.7491 56.8334 29.4132 174.6212 41 H 3.8914 8.8766 128.1438 58.9243 29.7439 175.0558 42 I 4.6549 7.1106 117.8197 59.9477 40.6576 174.5610 43 T 4.0477 8.0849 118.7141 62.8975 66.2479 174.0977 44 A 4.5639 7.0037 121.0786 53.7010 22.1547 176.9114 45 D 4.4568 8.1414 114.8879 53.0434 40.5889 177.6254 46 G 3.7267 8.1539 107.5553 46.7369 0.0000 173.3993 47 Y 4.3189 8.0645 119.1843 57.6055 39.6499 174.0736 48 Y 3.7782 6.9030 121.4083 58.7416 43.3585 174.3695 49 R 4.4682 6.8050 120.1478 56.6035 37.7066 173.8890 50 G 4.1043 7.4008 106.6090 45.3456 0.0000 174.7277 51 R 4.4891 8.7608 128.7494 55.0500 31.4373 173.9535 52 K 4.1121 9.0389 125.5607 56.8503 32.2671 176.9834 53 V 3.9297 8.5404 109.6215 62.4081 32.9419 176.5672 54 I 4.4636 7.3515 113.2097 59.9098 39.2857 175.7702 55 A 3.9699 7.7493 123.5105 53.4678 18.8257 177.6339 56 K 4.4515 8.5052 117.6930 56.9668 32.2246 174.8639 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 1 A 8.26 4.32 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.10 3.54 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 0.67 0.00 0.00 0.98 0.00 0.00 3 Q 9.08 4.34 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.72 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 4 Q 7.73 4.34 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.49 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 5 N 7.93 4.95 0.00 2.61 2.61 0.00 0.00 7.25 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 K 7.65 4.70 0.00 1.94 1.83 0.00 1.62 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.48 7.81 7 P 0.00 4.55 0.00 2.24 2.22 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 8 T 8.35 4.05 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 9 R 8.62 4.21 0.00 1.82 1.87 0.00 3.28 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 10 S 8.15 3.04 0.00 3.95 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 11 K 8.87 3.82 0.00 1.71 1.86 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.48 7.81 12 R 7.40 4.17 0.00 2.07 1.81 0.00 3.36 0.00 0.00 3.17 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 13 G 8.37 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 0.00 0.00 0.00 14 M 8.21 4.12 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.47 0.00 15 R 8.24 4.03 0.00 2.02 2.29 0.00 2.85 0.00 0.00 3.09 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.58 0.00 16 R 8.87 3.79 0.00 1.80 1.97 0.00 3.27 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 17 S 6.42 3.23 0.00 3.86 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 H 7.86 4.73 0.00 3.15 3.37 0.00 5.89 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.05 4.53 0.00 2.69 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 7.61 4.17 1.25 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 0.00 0.00 0.00 21 L 8.10 4.32 0.00 1.65 1.64 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.11 4.37 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 1.22 0.00 0.00 23 A 8.24 4.33 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.51 3.67 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 0.76 0.00 0.00 0.97 0.00 0.00 25 T 8.20 4.33 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 26 S 7.92 4.70 0.00 3.80 3.66 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 0.00 0.00 0.00 0.00 27 L 8.37 4.76 0.00 1.62 1.53 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 28 S 9.24 3.92 0.00 3.96 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 29 V 7.14 3.10 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 0.90 0.00 0.00 0.89 0.00 0.00 30 D 8.18 4.58 0.00 2.83 2.77 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 31 K 8.18 4.04 0.00 1.73 1.94 0.00 1.67 0.00 0.00 1.83 0.00 0.00 3.11 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.75 7.81 32 T 7.83 4.63 4.33 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 0.00 0.00 0.00 1.25 0.00 0.00 33 S 8.28 4.55 0.00 3.97 4.15 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 0.00 0.00 0.00 34 G 7.34 4.03 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 0.00 0.00 0.00 35 E 8.07 4.14 0.00 1.98 1.96 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 2.36 2.20 0.00 36 K 7.56 4.62 0.00 1.93 1.70 0.00 1.55 0.00 0.00 1.49 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.58 1.44 7.81 37 H 8.10 4.95 0.00 3.35 3.21 0.00 5.89 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 6.81 3.55 0.00 2.04 1.88 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.54 4.35 0.00 1.73 1.92 0.00 3.43 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 40 H 7.84 4.27 0.00 3.39 3.26 0.00 5.68 0.00 0.00 0.00 0.00 6.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 H 8.88 3.89 0.00 2.96 3.31 0.00 5.73 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.11 4.65 1.96 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.30 0.98 0.00 0.00 43 T 8.08 4.05 4.06 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 1.20 0.00 0.00 44 A 7.00 4.56 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 45 D 8.14 4.46 0.00 2.95 2.94 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 0.00 0.00 0.00 46 G 8.15 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 Y 8.06 4.32 0.00 2.92 2.80 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 48 Y 6.90 3.78 0.00 2.67 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 49 R 6.81 4.47 0.00 1.73 1.79 0.00 3.26 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.57 0.00 50 G 7.40 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 0.00 0.00 0.00 51 R 8.76 4.49 0.00 1.80 1.87 0.00 3.36 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 52 K 9.04 4.11 0.00 1.69 1.63 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.28 1.35 7.81 53 V 8.54 3.93 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 0.80 0.00 0.00 1.00 0.00 0.00 54 I 7.35 4.46 1.89 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 1.37 0.89 0.92 0.00 0.00 55 A 7.75 3.97 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.51 4.45 0.00 2.06 2.01 0.00 2.00 0.00 0.00 1.84 0.00 0.00 3.09 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.43 1.55 7.81