NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9302 8.3549 109.7358 45.0037 0.0000 173.8235 3 K 3.8702 8.5841 123.5058 55.6458 32.8405 170.7699 4 V 4.5392 8.5367 121.1583 61.4148 35.8727 173.4958 5 Y 5.1351 8.7314 123.0228 56.0531 41.7089 174.6072 6 K 4.5782 8.3385 121.2999 54.5090 35.9897 174.9321 7 K 5.0648 8.4992 123.7340 54.6376 35.2420 175.8667 8 V 4.5851 8.6398 116.4935 59.5289 35.7578 174.0553 9 E 5.0050 8.7821 124.5845 54.8926 30.8111 174.8974 10 L 4.9247 9.1786 126.3603 52.8499 46.4445 175.8632 11 V 4.7089 8.3298 119.7610 61.2737 33.5844 174.8359 12 G 4.1732 8.6760 116.2870 45.4660 0.0000 171.7635 13 T 5.8005 7.8887 112.6678 59.1090 72.2546 172.9815 14 S 4.6331 8.1477 113.1716 58.2005 65.2217 176.2328 15 E 4.4939 9.1661 124.3899 57.5963 30.1263 177.7000 16 E 4.1943 8.2926 118.6976 57.2827 30.1296 176.5708 17 G 3.3829 7.3685 104.8199 44.2068 0.0000 173.3791 18 L 3.7747 7.3294 118.1665 57.9620 41.4857 179.5089 19 E 3.8882 8.0989 117.6367 59.3997 29.2761 179.2836 20 A 3.9180 7.8591 119.9581 54.9687 18.5584 179.2580 21 A 3.9187 7.9750 119.2505 55.3784 18.4261 179.8177 22 I 3.4806 7.7150 118.1475 64.7338 37.1166 178.6814 23 Q 3.8446 8.0995 118.4987 58.7445 28.5269 178.7210 24 A 3.9158 8.2697 121.8541 55.1305 18.4499 179.5204 25 A 3.8725 7.9048 119.0891 55.3572 18.4937 179.8794 26 L 3.8479 7.9954 117.3511 57.6514 41.4171 179.4144 27 A 3.9362 8.3780 120.2894 55.4291 18.6564 179.4335 28 R 3.9110 7.9223 116.6808 59.3476 30.1222 178.4416 29 A 3.9322 7.9758 120.9778 55.0004 18.2041 179.2991 30 R 4.1702 7.7593 112.0233 57.9686 29.6857 178.3563 31 K 4.1921 7.7248 119.3021 58.1941 32.3405 177.2777 32 T 4.5273 7.7255 105.4494 60.4569 70.2845 173.5242 33 L 4.4652 7.7101 122.0783 52.8435 44.2636 175.9986 34 R 4.4552 8.0688 120.8115 55.6604 32.7509 175.1166 35 H 4.1526 8.4474 113.5750 56.8688 26.0394 175.3803 36 L 4.5226 8.1390 118.8068 55.4382 42.2109 176.2830 37 D 5.1900 9.5689 123.6458 55.3759 42.8642 176.3907 38 W 5.4614 7.7834 113.2608 55.2439 31.8299 173.1001 39 F 5.3195 8.2738 114.1804 55.4015 41.1153 173.9228 40 E 4.7075 9.3429 118.9439 54.6791 33.4210 175.0439 41 V 4.2319 8.7773 125.2893 63.1000 31.7626 175.2772 42 K 4.5540 9.3818 127.3038 57.7327 34.0413 176.3764 43 E 4.8660 7.9123 116.6726 54.9178 34.5852 174.6055 44 I 5.0580 8.2418 121.1623 60.1837 40.7690 174.8610 45 R 4.6156 8.9603 126.0208 56.4593 34.9358 173.7311 46 G 4.2496 8.1136 105.9894 47.0748 0.0000 172.7033 47 T 4.7406 7.9240 110.0830 60.0720 71.6085 173.5820 48 I 4.7675 8.2453 123.1280 59.7841 39.8107 175.2981 49 G 4.3350 9.3524 116.6681 43.6070 0.0000 173.0899 50 E 3.9170 8.8173 117.1663 58.7554 29.5193 177.7967 51 A 4.5890 7.8095 119.3813 51.8688 20.3656 176.0113 52 G 4.0515 7.3794 106.2927 44.4795 0.0000 177.7017 53 V 3.9445 8.3707 124.2870 62.6342 31.3602 174.4503 54 K 4.1932 8.5128 130.3101 57.9333 32.3338 175.7886 55 E 4.7578 8.0637 119.6053 54.5066 33.5278 173.4097 56 Y 4.7617 9.2954 124.4282 57.4747 40.0088 174.5674 57 Q 4.8364 9.5428 122.0900 54.2624 32.6555 174.5529 58 V 4.6881 8.8327 125.6519 60.9694 33.8808 174.6515 59 V 4.5471 8.5971 129.8730 62.4131 32.5926 174.8750 60 L 5.2864 9.3839 127.4455 54.3735 44.5698 174.6654 61 E 5.0709 9.3364 119.9999 54.8738 32.1007 175.1174 62 V 4.5081 8.8702 124.3123 60.9973 34.2838 174.2411 63 G 2.9284 8.4328 116.5488 43.8117 0.0000 172.2874 64 F 5.6472 8.0974 118.6264 54.9712 41.8818 173.8073 65 R 4.2458 8.8474 121.2461 56.2311 30.6207 175.8151 66 L 4.6052 8.2924 125.9708 53.8959 43.1150 176.0897 67 E 4.3226 8.5722 122.0159 54.9857 30.5641 176.9629 68 E 4.2215 8.5291 124.8294 56.3510 27.9027 176.5458 69 T 4.2274 7.8851 119.9229 63.2960 69.5825 174.0469 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 2 G 8.35 3.93 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 0.00 0.00 0.00 3 K 8.58 3.87 0.00 1.78 1.41 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.47 7.81 4 V 8.54 4.54 1.99 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 1.09 0.00 0.00 0.90 0.00 0.00 5 Y 8.73 5.14 0.00 3.01 3.05 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 0.00 6 K 8.34 4.58 0.00 1.54 0.74 0.00 1.60 0.00 0.00 1.88 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.15 1.29 7.81 7 K 8.50 5.06 0.00 1.62 1.61 0.00 2.09 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.07 1.41 7.81 8 V 8.64 4.59 2.15 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 0.95 0.00 0.00 1.07 0.00 0.00 9 E 8.78 5.01 0.00 1.99 1.86 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 2.23 2.34 0.00 10 L 9.18 4.92 0.00 1.52 1.48 0.88 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.33 4.71 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 0.80 0.00 0.00 0.94 0.00 0.00 12 G 8.68 4.17 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 0.00 13 T 7.89 5.80 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 14 S 8.15 4.63 0.00 3.89 3.77 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 15 E 9.17 4.49 0.00 2.02 1.99 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 2.40 2.33 0.00 16 E 8.29 4.19 0.00 2.02 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 2.35 2.28 0.00 17 G 7.37 3.38 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 0.00 18 L 7.33 3.77 0.00 1.55 1.63 0.84 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.10 3.89 0.00 1.99 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 2.38 2.42 0.00 20 A 7.86 3.92 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 21 A 7.98 3.92 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.72 3.48 1.86 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 1.40 0.63 0.31 0.00 0.00 23 Q 8.10 3.84 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 24 A 8.27 3.92 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 25 A 7.90 3.87 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.00 3.85 0.00 1.73 1.65 0.63 0.60 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 27 A 8.38 3.94 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 28 R 7.92 3.91 0.00 1.93 2.04 0.00 3.12 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 29 A 7.98 3.93 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 30 R 7.76 4.17 0.00 1.95 2.02 0.00 3.04 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 1.78 1.63 0.00 31 K 7.72 4.19 0.00 1.89 1.87 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.55 7.81 32 T 7.73 4.53 4.16 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 1.16 0.00 0.00 33 L 7.71 4.47 0.00 1.36 0.73 0.53 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 34 R 8.07 4.46 0.00 1.72 1.53 0.00 3.34 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.55 0.00 35 H 8.45 4.15 0.00 3.66 3.50 0.00 5.62 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.14 4.52 0.00 1.69 1.68 0.88 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 37 D 9.57 5.19 0.00 3.04 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 38 W 7.78 5.46 0.00 3.23 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 39 F 8.27 5.32 0.00 3.01 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 40 E 9.34 4.71 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.57 0.00 41 V 8.78 4.23 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 0.83 0.00 0.00 1.12 0.00 0.00 42 K 9.38 4.55 0.00 1.76 1.85 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.23 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.57 7.81 43 E 7.91 4.87 0.00 1.89 1.79 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 2.31 2.36 0.00 44 I 8.24 5.06 1.91 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 1.38 0.63 0.98 0.00 0.00 45 R 8.96 4.62 0.00 1.69 1.82 0.00 3.28 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 46 G 8.11 4.25 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 0.00 47 T 7.92 4.74 4.20 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 1.18 0.00 0.00 48 I 8.25 4.77 1.84 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 1.23 0.61 0.94 0.00 0.00 49 G 9.35 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 0.00 0.00 0.00 0.00 50 E 8.82 3.92 0.00 1.96 2.02 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 2.30 2.24 0.00 51 A 7.81 4.59 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 52 G 7.38 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 0.00 0.00 0.00 0.00 53 V 8.37 3.94 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 -0.28 0.00 0.00 0.75 0.00 0.00 54 K 8.51 4.19 0.00 1.79 1.76 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.33 7.81 55 E 8.06 4.76 0.00 1.96 1.64 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 2.16 2.27 0.00 56 Y 9.30 4.76 0.00 3.05 2.83 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 57 Q 9.54 4.84 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 58 V 8.83 4.69 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 1.01 0.00 0.00 0.95 0.00 0.00 59 V 8.60 4.55 2.19 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 0.79 0.00 0.00 0.95 0.00 0.00 60 L 9.38 5.29 0.00 1.92 1.73 0.79 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 61 E 9.34 5.07 0.00 1.92 1.86 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 2.27 2.26 0.00 62 V 8.87 4.51 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 0.96 0.00 0.00 0.91 0.00 0.00 63 G 8.43 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 0.00 0.00 0.00 64 F 8.10 5.65 0.00 3.43 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 65 R 8.85 4.25 0.00 1.89 1.87 0.00 3.05 0.00 0.00 3.05 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.12 0.00 66 L 8.29 4.61 0.00 1.59 1.55 0.88 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.57 4.32 0.00 1.98 1.89 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 2.26 2.36 0.00 68 E 8.53 4.22 0.00 1.89 1.88 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 2.28 2.31 0.00 69 T 7.89 4.23 4.25 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 1.22 0.00 0.00