NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9143 8.3549 109.7368 45.9377 0.0000 174.3221 2 K 4.2790 8.6171 124.7095 55.1051 32.4672 172.4754 3 E 4.7030 8.5003 120.1078 55.0716 33.4522 174.4474 4 C 5.2924 8.5924 122.2675 55.4809 43.3636 173.7282 5 D 4.3833 8.5972 121.8173 54.9373 41.2380 175.7894 6 C 5.0625 7.8350 114.9529 55.1439 43.2816 173.6264 7 S 4.2655 8.9295 116.5306 59.5733 63.2610 175.2451 8 S 4.8520 7.8696 116.0455 55.8439 64.7608 173.2644 9 P 4.3620 0.0000 0.0000 65.0838 31.5146 177.2210 10 E 4.1289 8.0284 117.1343 57.6182 30.1824 176.4792 11 N 4.4151 7.6919 119.8816 52.9098 39.3993 173.9401 12 P 4.4570 0.0000 0.0000 65.7716 32.2612 178.2294 13 C 4.4949 9.0049 117.3618 59.4557 41.0448 173.4302 14 C 5.2982 7.7622 113.6332 55.3595 40.5000 173.7171 15 D 4.6869 8.5701 121.5386 53.8745 41.7089 177.3480 16 A 3.9743 8.6828 126.6085 55.1813 18.9348 179.2601 17 A 4.1502 8.7704 118.9826 55.5705 18.5843 179.0826 18 T 3.9491 7.8448 104.3310 62.8459 69.5296 175.9627 19 C 4.0216 8.9823 120.3236 56.5930 38.8861 171.7437 20 K 4.9802 7.4617 117.0496 53.6646 35.0672 175.2721 21 L 4.4950 8.0226 122.6237 55.4089 41.8643 177.7702 22 R 3.9977 8.5713 124.3467 58.6737 30.3065 176.0846 23 P 4.5567 0.0000 0.0000 61.8584 33.2800 176.7777 24 G 3.8340 8.3790 105.8333 45.4362 0.0000 171.7551 25 A 4.8348 7.4619 121.0904 50.7376 22.8404 176.3107 26 Q 4.4699 9.0661 117.8028 57.3046 30.0191 173.8667 27 C 5.1598 7.8508 109.9761 53.8732 45.2451 174.1169 28 G 3.7755 8.7154 106.9350 46.5368 0.0000 173.3682 29 E 4.6430 8.2964 116.3108 54.2613 33.9376 173.4519 30 G 4.0651 8.4573 104.6735 43.3125 0.0000 175.1839 31 L 3.9750 8.2115 122.4139 56.8192 42.0006 178.6334 32 C 4.5206 8.4188 117.2397 56.1062 43.7186 172.0397 33 C 4.8126 7.6988 119.2764 55.5693 42.1083 172.1109 34 E 4.6939 8.8354 127.0833 55.3883 31.8250 176.5033 35 Q 3.4133 9.3149 122.5746 57.5061 27.5523 173.9584 36 C 4.4246 8.3468 108.3919 56.6863 36.2766 172.8021 37 K 5.0743 7.8034 117.8218 54.5188 35.8337 175.4921 38 F 4.6993 9.4873 120.0027 57.0054 38.9530 176.1332 39 S 4.4881 9.0061 120.0723 57.9002 63.4512 173.6384 40 R 4.3224 8.4747 119.2559 55.4750 30.9512 175.7509 41 A 4.2940 8.3926 123.7248 53.5685 18.8473 177.9644 42 G 3.9886 8.8045 111.8235 44.8914 0.0000 174.1306 43 K 4.1371 7.5193 120.5519 56.1742 33.5317 176.1660 44 I 4.3648 8.3079 127.9267 61.7889 36.8542 174.5736 45 C 4.6055 8.9076 122.6493 56.5498 41.5314 174.2872 46 R 4.7665 7.6224 118.5782 54.4018 33.4483 173.9499 47 I 4.3218 8.3641 126.7592 59.8748 38.2258 174.2770 48 P 4.6464 0.0000 0.0000 62.2953 32.2884 175.2764 49 R 4.6857 7.8855 113.0759 55.5997 33.4489 176.3036 50 G 3.9113 8.4378 110.4007 47.2724 0.0000 174.2505 51 D 4.8078 8.9110 122.8035 52.7735 39.7672 176.1632 52 M 4.3163 7.4344 119.6980 54.5116 32.6181 174.5309 53 P 4.5878 0.0000 0.0000 62.2816 32.4729 175.7000 54 D 4.5964 8.4895 119.9957 53.5434 39.9040 175.1650 55 D 4.7831 8.3951 120.7878 53.8247 42.7826 175.1723 56 R 4.8155 8.0912 122.4726 54.1192 33.9461 176.0186 57 C 4.4678 9.1466 120.4883 57.3815 40.7957 175.3844 58 T 3.5000 8.6169 113.2901 62.9527 68.8039 175.7447 59 G 4.0805 8.5507 107.8328 45.7932 0.0000 173.1730 60 Q 4.6304 7.8055 116.8635 55.0316 30.1296 174.1106 61 S 4.7546 7.9698 107.0967 56.9741 65.1135 174.5843 62 A 3.3005 8.1795 127.9941 53.3744 18.7906 177.0237 63 D 5.0187 7.3388 113.7686 52.4354 43.2559 174.7542 64 C 4.5199 8.3414 123.9832 55.0463 43.9014 170.9375 65 P 4.3676 0.0000 0.0000 63.8645 31.8472 176.1496 66 R 4.8104 7.7657 119.3492 56.5893 37.3494 176.1712 67 Y 4.7204 7.7709 111.2347 57.5419 41.6182 173.6935 68 H 4.3476 8.2661 123.4298 57.2176 30.7232 174.1084 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 G 8.35 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 2 K 8.62 4.28 0.00 1.83 1.83 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.49 7.81 3 E 8.50 4.70 0.00 1.88 1.76 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 2.20 2.33 0.00 4 C 8.59 5.29 0.00 2.97 3.13 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 0.00 5 D 8.60 4.38 0.00 2.69 2.73 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 6 C 7.83 5.06 0.00 3.02 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.93 4.27 0.00 3.95 3.90 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 0.00 0.00 0.00 8 S 7.87 4.85 0.00 3.85 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 9 P 0.00 4.36 0.00 2.17 2.18 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 10 E 8.03 4.13 0.00 1.96 2.04 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 2.31 2.35 0.00 11 N 7.69 4.42 0.00 2.73 2.74 0.00 0.00 6.92 7.80 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 12 P 0.00 4.46 0.00 2.22 2.16 0.00 3.82 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 13 C 9.00 4.49 0.00 2.98 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 14 C 7.76 5.30 0.00 2.91 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 15 D 8.57 4.69 0.00 2.76 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.68 3.97 1.29 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 0.00 0.00 0.00 17 A 8.77 4.15 1.31 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 0.00 0.00 18 T 7.84 3.95 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 19 C 8.98 4.02 0.00 3.19 3.35 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 20 K 7.46 4.98 0.00 1.94 1.56 0.00 1.79 0.00 0.00 1.99 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.51 7.81 21 L 8.02 4.50 0.00 1.76 1.63 1.01 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 22 R 8.57 4.00 0.00 1.82 1.98 0.00 3.25 0.00 0.00 3.52 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 23 P 0.00 4.56 0.00 2.18 2.10 0.00 3.77 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 24 G 8.38 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 A 7.46 4.83 1.30 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 0.00 0.00 26 Q 9.07 4.47 0.00 2.33 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.38 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 27 C 7.85 5.16 0.00 3.00 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 28 G 8.72 3.78 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 0.00 0.00 0.00 29 E 8.30 4.64 0.00 1.88 1.77 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 2.18 2.27 0.00 30 G 8.46 4.07 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 0.00 0.00 0.00 31 L 8.21 3.97 0.00 1.60 1.71 0.90 0.82 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 32 C 8.42 4.52 0.00 2.82 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 33 C 7.70 4.81 0.00 2.77 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 34 E 8.84 4.69 0.00 1.95 1.77 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 2.16 2.32 0.00 35 Q 9.31 3.41 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.80 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 36 C 8.35 4.42 0.00 3.21 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 37 K 7.80 5.07 0.00 1.97 1.82 0.00 1.80 0.00 0.00 1.68 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.55 7.81 38 F 9.49 4.70 0.00 2.90 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 39 S 9.01 4.49 0.00 3.88 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 40 R 8.47 4.32 0.00 1.94 2.05 0.00 3.02 0.00 0.00 3.34 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 41 A 8.39 4.29 1.33 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 0.00 0.00 0.00 42 G 8.80 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 0.00 0.00 0.00 43 K 7.52 4.14 0.00 1.89 1.74 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.41 7.81 44 I 8.31 4.36 1.85 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 1.38 0.90 0.96 0.00 0.00 45 C 8.91 4.61 0.00 2.94 3.16 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 46 R 7.62 4.77 0.00 1.84 1.74 0.00 3.17 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 47 I 8.36 4.32 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.54 0.91 0.00 0.00 48 P 0.00 4.65 0.00 2.27 2.24 0.00 3.74 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 49 R 7.89 4.69 0.00 1.95 2.01 0.00 3.08 0.00 0.00 3.34 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 50 G 8.44 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 51 D 8.91 4.81 0.00 2.77 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 52 M 7.43 4.32 0.00 2.04 2.22 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.53 0.00 53 P 0.00 4.59 0.00 2.38 2.10 0.00 3.79 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 1.89 0.00 54 D 8.49 4.60 0.00 2.71 2.73 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 55 D 8.40 4.78 0.00 2.89 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.09 4.82 0.00 1.55 1.61 0.00 2.54 0.00 0.00 2.96 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.42 0.00 57 C 9.15 4.47 0.00 2.90 3.01 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 58 T 8.62 3.50 4.18 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 0.96 0.00 0.00 59 G 8.55 4.08 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 0.00 0.00 0.00 60 Q 7.81 4.63 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 61 S 7.97 4.75 0.00 3.85 3.71 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 62 A 8.18 3.30 0.78 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 0.00 0.00 63 D 7.34 5.02 0.00 2.57 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 C 8.34 4.52 0.00 2.93 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 65 P 0.00 4.37 0.00 2.24 2.01 0.00 3.81 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 66 R 7.77 4.81 0.00 1.78 1.98 0.00 3.27 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 67 Y 7.77 4.72 0.00 2.88 2.89 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 68 H 8.27 4.35 0.00 3.23 3.27 0.00 5.81 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