NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.5112 8.1593 117.3355 62.7646 69.3502 171.6622 2 I 3.2780 8.1235 118.0246 59.4074 37.7181 174.2918 3 I 4.4464 8.0228 119.4150 59.0542 40.1918 176.3759 4 N 5.0012 8.4566 120.3916 53.1804 38.0067 175.5716 5 V 3.8513 7.4081 118.3114 63.2989 32.3636 175.1850 6 K 4.9059 8.4553 122.4094 55.8189 33.8498 174.7893 7 C 4.8949 8.2148 113.1267 54.9172 44.0354 173.7135 8 T 4.2588 7.9986 109.3999 61.5375 70.2869 174.4241 9 S 4.5540 7.4585 113.8562 55.7236 65.2766 174.7578 10 P 4.3755 0.0000 0.0000 64.7854 30.7394 178.7708 11 K 3.9677 7.9380 118.9019 59.4960 32.0796 177.9553 12 Q 4.2491 7.8352 115.2481 57.4512 29.0242 176.8963 13 C 4.5138 8.0912 118.4730 59.0219 41.5536 175.9150 14 L 3.9682 7.6416 120.8328 57.1879 41.0245 177.3615 15 P 4.2747 0.0000 0.0000 65.1279 31.6383 176.5277 16 P 4.4102 0.0000 0.0000 66.0541 29.8434 178.2828 17 C 4.7431 8.4680 116.5124 57.2339 41.9188 173.9722 18 K 4.5802 8.5192 121.0428 56.8963 32.1659 176.6382 19 A 4.4168 7.6105 118.5258 52.9432 19.4286 177.5188 20 Q 4.0048 7.8208 117.4398 58.0244 29.7395 176.5915 21 F 4.3734 7.5458 114.6859 57.5647 40.0158 177.2417 22 G 3.9598 6.8857 107.6882 46.5999 0.0000 172.8693 23 Q 4.2808 8.6972 124.0905 56.4169 29.0249 177.2445 24 S 4.5006 7.8093 110.0041 58.5647 64.6027 173.5817 25 A 3.7164 8.2002 122.9284 52.5630 18.7785 177.0438 26 G 4.0198 8.4043 109.5571 45.6363 0.0000 172.2928 27 A 5.8040 8.4129 125.9603 49.5326 23.0580 174.3726 28 K 4.6638 8.1714 116.7561 55.7585 37.4718 175.6334 29 C 5.6450 8.3263 120.0355 56.3647 44.8004 173.9056 30 M 4.1148 9.4957 126.7792 55.3831 31.1639 177.3975 31 N 4.0862 7.2235 124.1968 52.6345 35.0413 174.3188 32 G 4.6385 7.3016 120.9128 46.3672 0.0000 171.0040 33 K 5.4610 6.8709 116.4335 55.6124 37.2864 175.3743 34 C 5.1523 8.5357 119.9069 56.5254 42.5705 172.9799 35 K 4.3996 8.7748 120.3930 55.6921 35.2770 173.8653 36 C 4.7522 8.5319 125.0061 55.5487 41.5388 173.0629 37 Y 4.6442 8.2038 121.7589 55.1585 39.3720 173.0780 38 P 4.0887 0.0000 0.0000 62.7794 32.3825 176.2297 39 H 4.2627 8.4449 122.0375 56.7202 29.7135 172.9577 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 T 8.16 4.51 4.40 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 2 I 8.12 3.28 1.80 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.37 0.78 0.00 0.00 3 I 8.02 4.45 1.87 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 1.48 0.85 1.00 0.00 0.00 4 N 8.46 5.00 0.00 2.82 2.93 0.00 0.00 6.08 7.67 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 5 V 7.41 3.85 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 1.12 0.00 0.00 0.93 0.00 0.00 6 K 8.46 4.91 0.00 1.90 1.78 0.00 1.26 0.00 0.00 0.80 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.38 7.81 7 C 8.21 4.89 0.00 3.05 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 8 T 8.00 4.26 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 S 7.46 4.55 0.00 3.96 3.94 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 10 P 0.00 4.38 0.00 2.19 2.14 0.00 3.60 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 2.12 2.29 0.00 11 K 7.94 3.97 0.00 1.82 1.80 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.53 7.81 12 Q 7.84 4.25 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 13 C 8.09 4.51 0.00 3.13 3.12 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 0.00 0.00 0.00 14 L 7.64 3.97 0.00 1.89 1.72 1.09 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.27 0.00 2.03 2.13 0.00 3.69 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.16 0.00 16 P 0.00 4.41 0.00 2.28 2.31 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.02 0.00 17 C 8.47 4.74 0.00 3.19 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 18 K 8.52 4.58 0.00 1.94 1.99 0.00 1.74 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.54 7.81 19 A 7.61 4.42 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 20 Q 7.82 4.00 0.00 1.83 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.80 0.00 0.00 0.00 0.00 0.00 1.79 2.12 0.00 21 F 7.55 4.37 0.00 3.12 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 22 G 6.89 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 23 Q 8.70 4.28 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 24 S 7.81 4.50 0.00 4.01 3.97 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 25 A 8.20 3.72 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.40 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 0.00 0.00 0.00 27 A 8.41 5.80 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 28 K 8.17 4.66 0.00 1.70 1.72 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.45 7.81 29 C 8.33 5.64 0.00 2.94 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 M 9.50 4.11 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.52 0.00 31 N 7.22 4.09 0.00 2.77 3.02 0.00 0.00 7.01 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 32 G 7.30 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 6.87 5.46 0.00 1.75 1.65 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.26 7.81 34 C 8.54 5.15 0.00 2.84 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 35 K 8.77 4.40 0.00 1.67 1.41 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.30 1.01 7.81 36 C 8.53 4.75 0.00 3.13 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 37 Y 8.20 4.64 0.00 3.07 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 38 P 0.00 4.09 0.00 1.99 2.11 0.00 3.75 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.26 0.00 39 H 8.44 4.26 0.00 3.02 3.10 0.00 5.76 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