NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.6750 8.3344 116.7466 58.7122 63.7790 173.3557 2 H 4.1998 8.1924 119.2142 55.4779 31.6769 172.9569 3 L 4.8065 8.1482 124.7772 53.8038 41.1735 174.9391 4 V 4.2988 8.5505 123.2863 60.0605 33.4817 175.8901 5 K 4.3108 8.8571 125.7154 56.5107 32.7705 177.0628 6 C 4.5881 8.5458 124.7534 56.8198 40.4468 173.8790 7 A 4.2861 8.6534 125.5732 51.6191 18.6209 178.1117 8 E 3.9363 8.9082 118.5624 59.7281 29.0545 179.6827 9 K 4.0022 8.1317 118.0136 59.0759 32.6896 177.7084 10 E 4.5155 8.3457 118.5667 56.4898 30.4986 178.0350 11 K 3.9688 7.5945 118.2236 59.5818 32.3420 178.7503 12 T 3.8146 7.7674 108.6969 63.0664 69.2952 175.0650 13 F 3.9772 7.9865 124.7906 60.5732 39.3361 174.3922 14 C 4.8055 7.5700 116.7661 55.0659 43.3819 174.0889 15 V 3.9471 8.0363 119.5047 61.1201 33.7657 174.8086 16 N 4.0336 9.2619 113.6190 55.0366 35.5004 175.0839 17 G 3.7476 8.1602 100.8760 45.9956 0.0000 173.7187 18 G 3.5134 7.6554 107.5688 45.9968 0.0000 174.5325 19 E 4.2334 8.8519 126.5661 55.6420 29.8233 174.6786 20 C 4.7576 8.2586 125.4347 56.2859 45.5070 172.1503 21 F 5.4434 9.3398 123.6859 55.9777 43.7819 173.2357 22 M 5.0234 9.1158 118.7555 54.0455 35.7436 174.6837 23 V 3.9798 8.4151 126.2626 61.8483 31.1348 174.9653 24 K 4.3507 9.0943 129.0690 56.3302 31.4562 175.1298 25 D 4.6253 8.0750 124.5487 51.6000 42.0681 176.3401 26 L 4.3714 8.1454 122.2162 53.4960 40.2697 175.2041 27 S 4.6565 7.4980 114.9943 59.4584 68.6305 174.0247 28 N 4.5826 7.4989 116.6164 51.7030 37.7053 173.1745 29 P 4.2312 0.0000 0.0000 64.2593 32.1717 177.6730 30 S 4.4931 6.9065 108.0331 57.4545 65.3155 177.1500 31 R 3.7974 8.1324 119.2801 56.5524 30.5187 177.6505 32 Y 4.9918 8.2593 121.0832 57.2150 40.0322 175.2007 33 L 4.6283 9.2631 123.7139 54.3848 45.3219 174.0486 34 C 5.4016 8.9893 124.5788 55.3588 36.8886 175.0780 35 K 4.4044 9.2340 125.4093 55.8789 30.6427 176.1860 36 C 4.8842 8.3409 121.1465 56.0627 41.5664 173.3561 37 Q 4.2603 8.4422 119.8034 54.8998 28.9639 174.7095 38 P 4.2880 0.0000 0.0000 65.7823 31.4960 176.7936 39 G 4.1386 9.3682 115.5400 45.8424 0.0000 172.3278 40 F 5.0619 7.8780 115.2386 55.8484 43.5110 174.1057 41 T 4.5730 9.0955 116.5367 61.1451 70.7968 173.5647 42 G 4.2194 8.8752 110.2248 44.6626 0.0000 174.4764 43 A 3.9451 8.4933 122.3925 54.9180 18.5472 179.0295 44 R 4.0182 7.7856 111.8068 55.2031 30.7060 176.8992 45 C 4.5637 7.7884 114.7097 58.2867 38.3092 174.3296 46 T 4.0899 7.9376 109.7926 63.8982 69.7170 175.0546 47 E 4.5846 8.0838 122.8614 54.8494 30.7302 176.1932 48 N 4.2091 8.7057 122.2417 52.6749 38.5187 174.4673 49 V 4.4490 7.6829 112.8581 58.4987 36.2822 173.3513 50 P 4.1142 0.0000 0.0000 63.6059 31.1305 176.5602 51 M 4.1170 8.6416 123.9138 57.3804 32.4717 176.6611 52 K 4.5294 7.4557 116.0180 55.5436 36.0103 176.2179 53 V 3.9782 7.4944 109.6802 60.8926 30.2870 177.7074 54 Q 4.8276 7.5536 123.1585 54.5915 26.9310 172.9886 55 N 4.3626 7.8626 123.3769 53.3850 43.1233 176.9966 56 Q 4.3527 7.6605 120.3565 54.3078 27.2563 176.4865 57 E 4.0378 7.8972 118.8145 59.1385 30.4237 179.3289 58 K 4.0530 8.1013 117.2576 59.1015 32.3351 177.5102 59 A 4.2352 7.4435 119.9672 52.1055 19.0096 176.6899 60 E 4.4289 8.4191 118.1661 56.4339 29.4090 177.9962 61 E 4.2853 7.9394 117.6966 58.1854 31.2145 177.8202 62 L 3.8006 7.8087 118.4647 57.0696 41.9986 176.3493 63 Y 4.4004 7.4266 118.9067 58.2697 38.9663 174.8324 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 S 8.33 4.68 0.00 3.76 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 2 H 8.19 4.20 0.00 3.35 3.15 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.15 4.81 0.00 1.26 1.33 0.68 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 4 V 8.55 4.30 2.14 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 0.85 0.00 0.00 0.98 0.00 0.00 5 K 8.86 4.31 0.00 1.86 1.76 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.79 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.24 1.08 7.81 6 C 8.55 4.59 0.00 2.86 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 7 A 8.65 4.29 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 8 E 8.91 3.94 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 9 K 8.13 4.00 0.00 1.94 2.00 0.00 1.55 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.55 7.81 10 E 8.35 4.52 0.00 2.16 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 2.32 2.32 0.00 11 K 7.59 3.97 0.00 1.94 2.28 0.00 1.27 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.58 1.39 7.81 12 T 7.77 3.81 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 13 F 7.99 3.98 0.00 2.64 2.90 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 14 C 7.57 4.81 0.00 2.97 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 15 V 8.04 3.95 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 0.83 0.00 0.00 0.90 0.00 0.00 16 N 9.26 4.03 0.00 1.81 1.54 0.00 0.00 6.89 7.86 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 17 G 8.16 3.75 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 0.00 0.00 0.00 18 G 7.66 3.51 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 0.00 19 E 8.85 4.23 0.00 2.26 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 2.30 2.39 0.00 20 C 8.26 4.76 0.00 2.95 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 F 9.34 5.44 0.00 3.24 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 22 M 9.12 5.02 0.00 2.06 1.87 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 23 V 8.42 3.98 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 0.93 0.00 0.00 0.99 0.00 0.00 24 K 9.09 4.35 0.00 1.87 1.77 0.00 1.89 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.54 7.81 25 D 8.08 4.63 0.00 2.64 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 8.15 4.37 0.00 1.65 1.66 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.50 4.66 0.00 3.75 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 28 N 7.50 4.58 0.00 2.63 2.75 0.00 0.00 7.41 7.87 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 29 P 0.00 4.23 0.00 1.97 2.07 0.00 3.64 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.07 0.00 30 S 6.91 4.49 0.00 3.48 3.20 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 0.00 31 R 8.13 3.80 0.00 1.81 1.97 0.00 2.73 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.55 0.00 32 Y 8.26 4.99 0.00 2.92 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 33 L 9.26 4.63 0.00 1.72 1.63 1.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 34 C 8.99 5.40 0.00 2.97 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 35 K 9.23 4.40 0.00 2.01 1.88 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.13 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.51 1.63 7.81 36 C 8.34 4.88 0.00 2.92 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 37 Q 8.44 4.26 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.02 0.00 0.00 0.00 0.00 0.00 2.39 2.27 0.00 38 P 0.00 4.29 0.00 2.21 2.13 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 39 G 9.37 4.14 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 0.00 40 F 7.88 5.06 0.00 2.99 2.92 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 0.00 0.00 0.00 41 T 9.10 4.57 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 1.27 0.00 0.00 42 G 8.88 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.49 3.95 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.79 4.02 0.00 1.66 1.67 0.00 3.01 0.00 0.00 3.14 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.27 0.00 45 C 7.79 4.56 0.00 2.99 3.10 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.94 4.09 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 1.13 0.00 0.00 47 E 8.08 4.58 0.00 2.18 1.90 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 2.29 2.30 0.00 48 N 8.71 4.21 0.00 2.14 2.45 0.00 0.00 5.83 7.58 0.00 0.00 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 V 7.68 4.45 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 0.73 0.00 0.00 0.83 0.00 0.00 50 P 0.00 4.11 0.00 1.99 2.08 0.00 3.61 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 51 M 8.64 4.12 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.61 0.00 52 K 7.46 4.53 0.00 1.91 1.80 0.00 1.49 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.27 1.54 7.81 53 V 7.49 3.98 2.20 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 0.80 0.00 0.00 0.94 0.00 0.00 54 Q 7.55 4.83 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 55 N 7.86 4.36 0.00 2.88 2.82 0.00 0.00 6.85 7.25 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 56 Q 7.66 4.35 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 57 E 7.90 4.04 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 2.47 2.27 0.00 58 K 8.10 4.05 0.00 1.75 1.88 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.39 7.81 59 A 7.44 4.24 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 60 E 8.42 4.43 0.00 1.97 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 2.34 2.39 0.00 61 E 7.94 4.29 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.24 0.00 62 L 7.81 3.80 0.00 1.36 1.01 0.98 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 7.43 4.40 0.00 2.94 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