NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 E 3.9388 8.3033 120.1836 56.1731 31.8006 177.7632 6 K 3.7616 8.0220 118.1784 59.3884 31.9520 177.1960 7 T 4.2521 8.8147 116.7736 67.0928 68.7017 175.8270 8 I 3.7988 7.8834 120.5799 64.6708 37.2295 178.2506 9 L 4.2203 8.4688 120.0161 57.8410 41.6061 179.0590 10 N 4.3940 9.3126 117.2319 56.7897 38.5493 177.2912 11 M 4.0616 8.3113 119.6576 58.5083 31.9126 178.4354 12 A 4.0281 7.6085 119.0998 55.5604 18.5546 179.3881 13 R 3.3820 8.0976 116.8969 59.2727 30.0432 178.4885 14 F 4.1659 8.3594 120.4784 60.9622 39.3233 177.3149 15 I 4.0001 8.2869 119.8338 63.8571 36.6553 178.5998 16 R 3.8064 7.4735 118.3239 59.2494 29.8994 179.0276 17 S 3.9571 7.7074 113.4463 61.4277 62.8172 176.3486 18 Q 3.7605 7.6588 121.2528 58.6625 28.5408 178.5438 19 A 3.9711 8.0754 121.8770 55.1499 18.5257 179.4223 20 L 3.8945 8.2049 119.0828 58.5923 41.9953 179.3802 21 T 3.8912 7.9863 115.8777 66.5902 68.3431 176.7639 22 I 3.7531 7.7287 121.8696 63.8051 36.9732 178.2401 23 L 3.9266 7.8693 121.4924 58.6379 41.9168 178.2424 24 E 3.9229 8.0489 117.9731 59.3985 28.8719 179.1640 25 K 3.8473 8.1768 117.9743 59.9710 32.3026 179.3236 26 A 4.0403 8.1670 120.7196 55.0469 18.2553 179.4965 27 N 4.2590 8.3236 115.2910 56.5417 38.4249 177.5260 28 E 3.9914 8.4845 119.2227 58.5642 29.5955 178.3390 29 L 4.4064 7.2947 115.7691 53.3287 42.9685 175.6367 30 D 4.3130 7.9768 117.5880 55.7543 38.8913 176.1182 31 A 4.5034 8.2056 122.2328 50.0741 16.5194 176.4284 32 D 4.3149 8.0172 125.3302 57.2046 41.3405 178.3326 33 E 3.9495 8.2021 117.9189 59.7689 29.5223 179.6015 34 I 3.7357 7.7115 118.8792 64.2941 37.0467 178.2334 35 A 4.0334 8.5717 122.0015 55.0083 17.8112 179.2054 36 D 4.2645 8.3793 117.0845 57.4507 41.2341 178.4203 37 I 3.8420 7.6804 120.2454 63.8134 37.1671 178.1491 38 A 4.0315 7.9788 121.9878 54.7844 18.0609 179.3788 39 E 3.7983 7.8917 117.8282 59.5046 29.8181 178.7409 40 S 3.9755 7.6622 112.8697 61.6975 62.4088 176.2690 41 I 3.8287 8.1559 122.6683 64.6093 36.7996 177.9637 42 H 4.1476 8.2742 119.1741 59.2730 29.6844 177.1827 43 D 4.3774 8.4654 121.1986 57.5704 40.6372 178.4651 44 H 4.2559 8.7113 116.8342 58.7979 28.7068 177.6965 45 A 3.9929 8.0870 122.5460 55.3398 18.2016 179.2397 46 D 4.4318 8.1598 116.4444 57.1742 41.2119 178.1383 47 E 3.9278 8.2712 120.1369 59.2587 29.6392 178.8018 48 I 3.6940 7.8894 119.9485 64.5723 37.1168 177.4312 49 Y 4.3108 8.4598 120.6351 61.1113 38.5961 178.1675 50 R 3.7163 8.2798 118.5643 59.7165 30.3342 179.0283 51 S 4.0228 8.1675 114.2177 61.7600 62.8139 177.1049 52 A 3.3960 7.9499 123.2544 55.0120 18.3096 179.7514 53 L 4.0100 8.0102 117.6629 57.5839 41.3215 179.7596 54 A 3.9152 7.6953 120.1779 55.1463 18.5229 179.3925 55 R 3.9432 7.6605 115.9492 58.8836 30.2393 177.8312 56 F 4.9659 8.4393 116.0322 57.2988 39.4972 176.0767 57 G 4.0878 7.9438 112.2875 45.7233 0.0000 173.2335 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 5 E 8.30 3.94 0.00 1.61 1.12 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 0.00 1.47 1.82 0.00 6 K 8.02 3.76 0.00 1.86 1.86 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.55 7.81 7 T 8.81 4.25 4.27 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 1.23 0.00 0.00 8 I 7.88 3.80 2.43 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.54 1.04 0.00 0.00 9 L 8.47 4.22 0.00 2.03 1.91 1.13 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 10 N 9.31 4.39 0.00 2.74 2.88 0.00 0.00 7.15 7.54 0.00 0.00 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 M 8.31 4.06 0.00 2.07 2.35 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.74 0.00 12 A 7.61 4.03 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.10 3.38 0.00 1.20 1.94 0.00 3.01 0.00 0.00 3.06 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.72 0.00 14 F 8.36 4.17 0.00 3.18 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 15 I 8.29 4.00 2.02 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.77 0.92 0.00 0.00 16 R 7.47 3.81 0.00 1.85 1.83 0.00 2.92 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.63 0.00 17 S 7.71 3.96 0.00 3.75 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 18 Q 7.66 3.76 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.28 2.05 0.00 19 A 8.08 3.97 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 20 L 8.20 3.89 0.00 1.98 1.62 0.82 1.07 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 21 T 7.99 3.89 4.35 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 1.18 0.00 0.00 22 I 7.73 3.75 2.06 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 1.06 0.90 0.00 0.00 23 L 7.87 3.93 0.00 1.73 1.88 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.05 3.92 0.00 2.19 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 2.48 2.48 0.00 25 K 8.18 3.85 0.00 1.74 1.88 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.68 7.81 26 A 8.17 4.04 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 27 N 8.32 4.26 0.00 2.91 2.86 0.00 0.00 6.99 7.66 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 28 E 8.48 3.99 0.00 2.01 2.01 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 2.34 2.35 0.00 29 L 7.29 4.41 0.00 1.75 1.69 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 30 D 7.98 4.31 0.00 2.80 2.75 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 31 A 8.21 4.50 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 32 D 8.02 4.31 0.00 2.69 2.75 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 33 E 8.20 3.95 0.00 2.00 2.01 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 2.40 2.41 0.00 34 I 7.71 3.74 1.99 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 1.57 0.76 0.91 0.00 0.00 35 A 8.57 4.03 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 36 D 8.38 4.26 0.00 2.99 2.75 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 37 I 7.68 3.84 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.76 0.92 0.00 0.00 38 A 7.98 4.03 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.89 3.80 0.00 2.05 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 0.00 2.27 2.50 0.00 40 S 7.66 3.98 0.00 3.90 4.02 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 41 I 8.16 3.83 2.02 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 1.44 1.01 0.92 0.00 0.00 42 H 8.27 4.15 0.00 3.17 3.51 0.00 5.58 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.47 4.38 0.00 2.72 2.67 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 44 H 8.71 4.26 0.00 3.13 3.32 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.09 3.99 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.16 4.43 0.00 2.82 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 47 E 8.27 3.93 0.00 2.33 2.17 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 2.33 2.40 0.00 48 I 7.89 3.69 2.11 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.70 0.96 0.00 0.00 49 Y 8.46 4.31 0.00 3.00 3.17 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 50 R 8.28 3.72 0.00 1.87 1.93 0.00 3.22 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.95 0.00 51 S 8.17 4.02 0.00 3.98 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 52 A 7.95 3.40 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 53 L 8.01 4.01 0.00 1.55 1.56 0.19 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 54 A 7.70 3.92 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 55 R 7.66 3.94 0.00 1.79 1.48 0.00 3.38 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 56 F 8.44 4.97 0.00 3.12 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 57 G 7.94 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 0.00 0.00 0.00 0.00