NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.7424 8.1593 117.3251 63.6169 69.9471 172.6119 3 I 4.5655 8.8739 119.5714 58.1480 41.7158 172.3245 4 Q 5.0276 9.3768 124.2450 54.3066 31.8899 175.3554 5 L 4.8857 9.0876 126.1385 53.2295 45.5574 175.4583 6 T 4.7098 8.3867 119.1221 62.6618 70.6293 174.0947 7 V 4.5786 8.6439 126.4086 60.1761 31.4684 174.0264 8 P 4.3394 0.0000 0.0000 64.8293 31.7261 177.4734 9 T 4.3017 7.8804 106.2234 61.5996 68.8422 174.7278 10 I 3.8328 7.6394 122.9639 61.9221 36.1071 175.3367 11 A 4.4613 8.4559 128.9151 53.2611 20.1078 176.2766 12 C 4.6366 7.4635 109.6283 56.3195 33.5144 174.1038 13 E 3.8992 8.7641 119.8744 59.4493 29.0062 178.3422 14 A 4.0016 7.9953 120.3470 55.2674 18.4054 179.2902 15 C 4.2713 8.2963 115.8858 62.2855 28.2536 175.7911 16 A 3.8320 7.9344 122.3586 55.2814 17.9319 179.3789 17 E 3.8369 8.3692 117.5546 59.1663 29.6865 178.7319 18 A 3.9994 8.0416 120.9222 55.1878 18.4618 179.8566 19 V 3.4029 7.7161 116.7110 66.3412 31.5598 178.2861 20 T 3.8180 8.1157 115.8684 66.7544 68.2288 176.7550 21 K 3.9646 8.5237 120.4749 59.2647 31.7948 179.2926 22 A 3.9771 7.7666 120.3789 55.1049 18.6201 179.6363 23 V 3.6955 7.7682 116.6770 66.3089 31.2396 178.4189 24 Q 4.2285 8.2818 117.7905 58.9409 28.2608 178.4545 25 N 4.4098 8.3270 117.0119 55.7469 38.5741 176.4522 26 E 4.5794 7.9578 118.6600 56.7129 30.2766 175.9957 27 D 4.3241 7.5775 118.0466 53.0523 42.6642 175.4649 28 A 4.1444 8.5801 130.8108 54.7952 18.5669 178.0028 29 Q 4.1881 8.0874 113.0350 56.8467 29.2542 176.1782 30 A 4.4295 7.8798 120.9735 52.1466 19.3284 177.0600 31 T 4.4530 8.4276 118.2868 62.1679 70.5726 174.0793 32 V 4.7376 8.5265 128.1155 61.7819 34.1973 174.9414 33 Q 4.7045 9.1532 128.7212 53.7220 31.2844 170.9043 34 V 4.6023 8.4012 124.0836 60.2433 33.7807 174.3369 35 D 4.6852 8.9278 129.2563 52.7607 41.2986 177.0815 36 L 4.0804 8.6436 127.4675 57.6234 41.8224 178.9525 37 T 3.9536 7.8292 108.7799 64.5233 68.8724 175.4737 38 S 4.2592 8.8862 117.5207 57.3511 63.8541 174.6959 39 K 3.8719 8.1118 119.9221 57.2421 30.1201 174.4453 40 K 4.6743 7.6088 119.0458 55.7192 33.7138 175.9588 41 V 4.6505 9.3100 125.6350 61.5270 33.8539 174.1670 42 T 5.0520 8.9570 125.6740 62.0229 70.6261 173.7447 43 I 4.9940 8.9757 127.3081 59.7023 41.4072 174.6429 44 T 4.8118 8.7240 123.2080 62.2324 70.6812 173.0561 45 S 4.8874 8.3500 119.3100 57.0315 65.0410 174.4013 46 A 4.1762 8.3535 126.5943 53.8877 18.4711 178.5536 47 L 4.2231 7.9891 116.9170 54.4274 42.3678 178.0098 48 G 3.9113 8.9597 109.3626 43.9801 0.0000 174.7017 49 E 3.9742 8.5785 120.4483 59.1248 29.5173 178.5029 50 E 3.9261 8.1296 119.0132 59.2419 29.7966 178.5669 51 Q 3.9977 8.0446 117.6697 58.9472 28.7533 178.7492 52 L 3.9993 7.9532 119.9067 57.9185 41.7292 179.7192 53 R 3.9329 8.2780 118.2902 59.5510 29.8784 179.3664 54 T 3.8802 8.2989 115.6008 66.6456 67.9928 176.7762 55 A 4.0249 8.0887 122.7001 55.0963 18.4298 179.8445 56 I 3.7596 8.1416 118.4565 64.3843 37.2409 178.3826 57 A 4.2717 8.0323 122.9868 54.8470 18.0336 179.7955 58 S 4.2087 8.3670 112.0746 60.7306 62.9894 175.7915 59 A 4.4345 7.3972 121.3621 51.9693 18.6679 177.7102 60 G 3.8886 7.7472 105.6683 45.1266 0.0000 173.2949 61 Y 4.5497 8.1574 117.3331 55.6661 40.3690 175.1320 62 E 4.3059 8.8131 124.7867 56.0289 30.4358 176.2798 63 V 4.4989 8.0176 121.5658 60.9472 33.6213 175.4331 64 E 4.1742 8.8922 125.6701 56.7775 29.2310 176.6410 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 T 8.16 4.74 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 1.25 0.00 0.00 3 I 8.87 4.57 1.87 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 1.11 1.39 0.91 0.00 0.00 4 Q 9.38 5.03 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.74 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 5 L 9.09 4.89 0.00 1.56 1.50 0.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 6 T 8.39 4.71 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 7 V 8.64 4.58 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.93 0.00 0.00 8 P 0.00 4.34 0.00 2.10 2.12 0.00 3.76 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 9 T 7.88 4.30 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 1.24 0.00 0.00 10 I 7.64 3.83 1.84 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.54 0.82 0.00 0.00 11 A 8.46 4.46 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 12 C 7.46 4.64 0.00 3.13 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 13 E 8.76 3.90 0.00 2.09 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 2.37 2.44 0.00 14 A 8.00 4.00 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 15 C 8.30 4.27 0.00 3.13 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.93 3.83 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 17 E 8.37 3.84 0.00 2.20 1.94 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 2.30 2.36 0.00 18 A 8.04 4.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.72 3.40 1.98 0.00 0.00 0.00 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 0.40 0.00 0.00 20 T 8.12 3.82 4.34 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 1.19 0.00 0.00 21 K 8.52 3.96 0.00 1.91 1.86 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.58 7.81 22 A 7.77 3.98 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 23 V 7.77 3.70 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 1.02 0.00 0.00 0.96 0.00 0.00 24 Q 8.28 4.23 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 25 N 8.33 4.41 0.00 2.74 2.89 0.00 0.00 7.00 8.51 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 26 E 7.96 4.58 0.00 2.10 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 2.51 2.45 0.00 27 D 7.58 4.32 0.00 2.72 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.58 4.14 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 29 Q 8.09 4.19 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 30 A 7.88 4.43 1.26 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 0.00 0.00 0.00 31 T 8.43 4.45 4.23 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 0.00 0.00 1.20 0.00 0.00 32 V 8.53 4.74 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.92 0.00 0.00 33 Q 9.15 4.70 0.00 1.73 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.53 0.00 0.00 0.00 0.00 0.00 2.18 2.13 0.00 34 V 8.40 4.60 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 0.88 0.00 0.00 0.87 0.00 0.00 35 D 8.93 4.69 0.00 2.82 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 36 L 8.64 4.08 0.00 1.67 1.71 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 37 T 7.83 3.95 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 38 S 8.89 4.26 0.00 3.97 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 39 K 8.11 3.87 0.00 1.99 2.13 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.55 7.81 40 K 7.61 4.67 0.00 1.69 1.71 0.00 1.61 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.38 7.81 41 V 9.31 4.65 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 1.02 0.00 0.00 0.89 0.00 0.00 42 T 8.96 5.05 4.23 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 0.00 0.00 1.20 0.00 0.00 43 I 8.98 4.99 1.86 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 1.21 0.83 0.90 0.00 0.00 44 T 8.72 4.81 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 45 S 8.35 4.89 0.00 3.83 3.67 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 46 A 8.35 4.18 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 47 L 7.99 4.22 0.00 1.62 1.62 0.92 0.82 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 48 G 8.96 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.58 3.97 0.00 2.05 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 2.37 0.00 50 E 8.13 3.93 0.00 2.12 1.93 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 2.38 2.46 0.00 51 Q 8.04 4.00 0.00 2.32 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 52 L 7.95 4.00 0.00 1.86 1.71 0.92 0.99 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 53 R 8.28 3.93 0.00 2.05 1.99 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 54 T 8.30 3.88 4.43 0.00 0.00 0.00 0.00 0.00 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 55 A 8.09 4.02 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 56 I 8.14 3.76 1.91 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 1.45 1.00 1.01 0.00 0.00 57 A 8.03 4.27 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 58 S 8.37 4.21 0.00 3.85 3.95 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 59 A 7.40 4.43 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.75 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 0.00 0.00 0.00 61 Y 8.16 4.55 0.00 3.00 2.88 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 0.00 0.00 0.00 62 E 8.81 4.31 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 2.30 2.23 0.00 63 V 8.02 4.50 2.10 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 0.89 0.00 0.00 0.96 0.00 0.00 64 E 8.89 4.17 0.00 2.00 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 2.36 2.41 0.00