NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 T 4.1212 8.1744 115.2140 61.5944 68.5068 172.7101 7 V 3.5125 7.8298 124.9167 61.4488 32.2758 175.3096 8 F 4.5051 8.0370 125.6410 57.0190 40.7318 175.4591 9 S 4.4812 9.4150 118.8496 57.8717 65.0265 175.3954 10 Q 3.9738 8.6637 121.0301 59.3873 27.9632 179.3828 11 A 4.0300 7.9410 120.9428 55.1001 18.4363 179.5887 12 Q 3.8794 8.0183 116.4281 59.0232 28.8538 178.8066 13 L 3.3984 7.7936 119.8213 58.0430 41.7157 179.2562 14 C 4.0070 8.3815 116.6239 62.9965 27.8519 176.2892 15 A 3.9801 7.5490 120.9660 54.8256 18.0054 179.7372 16 L 3.7049 7.4443 117.4933 57.7595 41.5175 179.8816 17 K 4.1366 8.0857 118.7877 59.4523 31.4393 178.8514 18 D 4.3132 8.1379 118.3060 57.3673 41.0721 178.4161 19 R 3.9525 7.7886 119.1431 59.4654 29.9530 178.0458 20 F 4.1844 8.2266 119.2669 61.6729 39.3178 176.8568 21 Q 3.9794 7.9212 116.7183 58.3886 28.4841 178.5229 22 K 4.3164 7.4025 118.1188 57.2503 32.5636 177.4673 23 Q 4.3945 8.2708 116.7203 54.2169 30.7764 175.2775 24 K 3.5286 8.6265 122.7570 58.0065 32.3676 176.4589 25 Y 4.5730 7.8577 115.3183 56.1106 39.8508 174.5627 26 L 4.6916 8.0419 125.0627 52.7772 43.8171 177.4508 27 S 4.4177 8.3333 117.2521 57.9348 64.8875 175.7119 28 L 4.0440 8.3530 121.1315 58.1845 41.3955 179.4207 29 Q 3.9562 8.1669 117.3010 59.5784 28.7576 179.6089 30 Q 4.6304 7.8922 119.5306 58.7587 28.6749 178.7797 31 M 4.1080 7.9414 119.4812 58.0346 31.9915 178.5123 32 Q 4.0039 8.5015 120.1718 59.2751 29.3178 177.9003 33 E 3.9109 8.5263 119.9226 59.6011 29.5079 179.2491 34 L 3.9782 7.8537 119.9261 58.0936 42.0696 178.9812 35 S 4.1720 8.1402 114.4629 61.6636 62.7005 176.6857 36 S 4.1152 8.0699 118.2462 61.1904 62.4881 176.5794 37 I 3.7674 7.9141 122.4169 63.0841 36.9108 177.3383 38 L 4.4261 7.8638 117.4653 53.5227 41.9642 176.1580 39 N 4.1995 7.5099 116.3240 54.3563 37.8326 173.5447 40 L 4.5951 7.8714 116.5442 52.7972 43.9342 176.2850 41 S 4.6142 9.0941 114.0563 57.4527 64.4422 173.6857 42 Y 4.2711 8.6826 128.7764 61.1401 38.5172 178.7025 43 K 3.6376 8.1358 119.6374 59.4207 32.3354 178.4464 44 Q 4.0576 7.6997 117.5998 58.9888 28.6324 178.9660 45 V 3.7252 8.0418 119.1901 65.9500 31.6426 177.6834 46 K 3.8500 7.9893 119.3939 60.0394 31.8690 178.6375 47 T 3.8934 7.8995 115.7596 66.3860 68.2815 176.3684 48 W 3.9747 8.2160 129.9058 60.4177 30.6224 177.8689 49 F 3.7400 8.8473 117.9758 60.6153 38.4295 177.2783 50 Q 3.9842 8.1580 118.9530 59.5785 28.7398 178.4053 51 N 4.3037 8.3165 117.4413 56.1581 38.2146 177.5557 52 Q 3.4985 7.0200 118.6976 58.5702 28.9801 178.5344 53 R 4.4300 7.7050 119.0625 59.7400 30.0108 179.0574 54 M 4.1824 7.8503 116.7461 57.9720 31.9011 178.6248 55 K 4.0876 7.5472 118.3944 58.3746 32.7620 176.9115 56 C 4.5728 7.6038 111.5714 56.4434 32.7407 175.0254 57 K 4.0549 8.6437 121.8798 59.7279 31.7563 178.8825 58 R 4.1799 7.6710 112.3588 57.2312 29.5497 176.7383 59 W 5.0107 8.0530 117.8810 57.0537 30.0843 176.1841 60 Q 4.4439 8.1312 122.9483 56.0849 28.2621 175.3966 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 6 T 8.17 4.12 4.13 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 0.98 0.00 0.00 7 V 7.83 3.51 2.05 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 0.90 0.00 0.00 0.90 0.00 0.00 8 F 8.04 4.51 0.00 2.97 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 9 S 9.41 4.48 0.00 4.00 4.01 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 10 Q 8.66 3.97 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 11 A 7.94 4.03 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 12 Q 8.02 3.88 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.73 0.00 0.00 0.00 0.00 0.00 2.53 2.40 0.00 13 L 7.79 3.40 0.00 1.85 1.58 0.98 0.31 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 14 C 8.38 4.01 0.00 2.92 2.95 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 15 A 7.55 3.98 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 16 L 7.44 3.70 0.00 0.77 0.13 -0.66 0.68 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 17 K 8.09 4.14 0.00 1.90 1.87 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.62 1.56 7.81 18 D 8.14 4.31 0.00 2.96 2.78 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 19 R 7.79 3.95 0.00 2.03 2.26 0.00 3.27 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.91 0.00 20 F 8.23 4.18 0.00 2.95 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 21 Q 7.92 3.98 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.70 0.00 0.00 0.00 0.00 0.00 2.41 2.77 0.00 22 K 7.40 4.32 0.00 1.87 1.85 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.22 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.69 7.81 23 Q 8.27 4.39 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 7.00 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 24 K 8.63 3.53 0.00 1.65 1.52 0.00 1.13 0.00 0.00 1.43 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.93 0.21 7.81 25 Y 7.86 4.57 0.00 2.86 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.04 4.69 0.00 1.16 1.39 0.62 0.70 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 27 S 8.33 4.42 0.00 4.05 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 28 L 8.35 4.04 0.00 1.70 1.72 0.94 1.03 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 29 Q 8.17 3.96 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 30 Q 7.89 4.63 0.00 2.25 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.24 0.00 31 M 7.94 4.11 0.00 2.26 2.39 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.29 0.00 32 Q 8.50 4.00 0.00 2.05 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 33 E 8.53 3.91 0.00 2.17 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 0.00 2.33 2.42 0.00 34 L 7.85 3.98 0.00 1.89 1.91 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.14 4.17 0.00 4.37 4.31 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 36 S 8.07 4.12 0.00 4.10 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 0.00 37 I 7.91 3.77 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 1.52 0.68 0.91 0.00 0.00 38 L 7.86 4.43 0.00 1.80 1.69 0.89 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 39 N 7.51 4.20 0.00 2.81 2.90 0.00 0.00 7.05 7.63 0.00 0.00 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 L 7.87 4.60 0.00 1.71 1.68 1.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 41 S 9.09 4.61 0.00 3.87 3.89 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 42 Y 8.68 4.27 0.00 3.03 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 43 K 8.14 3.64 0.00 1.88 1.81 0.00 1.80 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.52 7.81 44 Q 7.70 4.06 0.00 2.52 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 45 V 8.04 3.73 2.27 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 1.24 0.00 0.00 1.01 0.00 0.00 46 K 7.99 3.85 0.00 1.32 1.45 0.00 1.38 0.00 0.00 1.48 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.43 7.81 47 T 7.90 3.89 4.37 0.00 0.00 0.00 0.00 0.00 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 48 W 8.22 3.97 0.00 3.64 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 49 F 8.85 3.74 0.00 3.33 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 50 Q 8.16 3.98 0.00 2.25 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 51 N 8.32 4.30 0.00 2.47 2.65 0.00 0.00 7.10 7.92 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 52 Q 7.02 3.50 0.00 1.12 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.96 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 53 R 7.70 4.43 0.00 1.84 2.07 0.00 2.83 0.00 0.00 2.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.92 0.00 54 M 7.85 4.18 0.00 1.99 2.10 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 2.64 2.96 0.00 55 K 7.55 4.09 0.00 1.93 1.84 0.00 1.53 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.40 1.47 7.81 56 C 7.60 4.57 0.00 2.73 2.54 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 0.00 0.00 0.00 0.00 57 K 8.64 4.05 0.00 1.77 1.89 0.00 1.64 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.38 7.81 58 R 7.67 4.18 0.00 1.90 1.94 0.00 2.95 0.00 0.00 3.18 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.44 0.00 59 W 8.05 5.01 0.00 3.65 3.25 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 60 Q 8.13 4.44 0.00 2.34 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.55 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00