NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8313 8.4545 109.7080 44.7499 0.0000 174.7239 2 E 4.3316 7.6290 115.5318 53.4936 31.2511 175.6158 3 Y 4.9142 8.5877 121.1357 55.1728 42.3126 174.6677 4 V 4.6616 8.6248 123.1296 61.0461 35.1802 174.2300 5 V 3.7293 8.5045 127.9080 62.8647 31.7280 175.2703 6 E 4.3656 9.1968 127.9037 58.3214 31.2701 176.2929 7 K 4.5586 7.4018 118.1648 55.1364 35.9194 174.9057 8 V 4.1152 8.2468 127.2258 62.0970 31.2447 175.1909 9 L 4.3070 8.5969 129.7438 57.2333 42.6384 176.4725 10 D 4.4175 6.9252 115.4146 53.5983 44.6121 174.3217 11 R 5.1811 8.6236 121.0841 54.5679 33.3776 174.0556 12 R 4.6937 9.1599 120.4294 54.4674 33.6039 174.1664 13 V 4.6249 8.2996 119.7589 61.4395 33.6646 174.9934 14 V 4.2565 8.2593 121.8586 60.6202 34.0913 176.5128 15 K 3.9136 9.7473 124.4025 57.4839 29.5696 176.2005 16 G 3.8546 8.3806 107.2666 46.0652 0.0000 174.5664 17 K 4.3090 7.7433 122.7055 53.1581 32.7812 181.3435 18 V 4.4041 8.1847 124.8186 61.7237 32.7659 174.6279 19 E 5.3161 9.0858 126.3394 54.8636 34.2629 173.9921 20 Y 5.1076 9.0011 119.6752 56.0528 41.7200 174.6320 21 L 3.8443 8.2444 126.2269 54.1849 43.3620 175.2639 22 L 4.7848 8.3882 126.5287 52.5623 44.8855 175.3193 23 K 4.9913 8.2764 124.7944 54.4679 33.8246 175.1315 24 W 5.3023 8.5678 126.7666 54.4709 31.7428 175.5998 25 K 4.7554 8.6249 125.7841 57.6299 31.9386 177.0872 26 G 3.9010 9.2520 113.7534 45.6005 0.0000 172.4672 27 F 4.8202 7.8376 116.5430 54.9117 42.5028 175.1291 28 S 4.4595 8.4854 116.4108 57.9982 63.1255 174.8197 29 D 4.5868 8.9016 126.6474 58.0607 40.7669 179.5045 30 E 4.0826 8.3447 114.6355 58.4187 29.7004 180.7007 31 D 5.0110 7.8829 115.4701 54.4004 41.4343 176.2011 32 N 5.1236 8.1649 117.3600 53.5084 39.6768 174.1899 33 T 4.9540 8.3726 111.0928 59.6577 72.7501 172.5809 34 W 5.0043 8.9069 123.4725 56.3390 30.1605 175.5337 35 E 4.9233 9.4970 124.4188 53.6507 32.3852 174.1470 36 P 4.7944 0.0000 0.0000 62.3040 32.4199 177.4836 37 E 3.9347 9.2192 122.7549 59.9092 29.8875 179.6383 38 E 3.9789 8.4775 115.2876 58.7632 29.5418 181.4469 39 N 4.7081 7.6729 116.6115 54.1298 38.3159 176.9586 40 L 4.2915 7.5716 122.9875 54.6404 39.1954 183.2199 41 D 4.8363 7.7012 126.8412 51.7791 39.1128 178.4278 42 C 4.8275 7.2312 121.3614 56.4266 29.9831 173.3579 43 P 4.3140 0.0000 0.0000 66.3578 31.3720 179.1234 44 D 4.3523 7.9597 120.4579 58.0765 39.7670 180.7198 45 L 4.1525 7.7365 120.0553 57.6147 41.6553 179.6164 46 I 3.6323 7.7726 119.4904 64.2310 37.0342 178.0627 47 A 4.0249 8.2173 124.1773 55.9455 17.9230 179.7657 48 E 3.9052 7.8145 115.3976 61.5112 29.7676 180.9253 49 F 4.5188 7.6908 119.7321 61.1129 39.6591 176.5728 50 L 3.8382 8.3777 119.9645 58.6225 41.5473 178.5848 51 Q 4.2493 8.0019 123.4994 57.3829 28.2488 177.5159 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 G 8.45 3.83 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 0.00 0.00 0.00 2 E 7.63 4.33 0.00 2.07 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.96 0.00 3 Y 8.59 4.91 0.00 2.98 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 4 V 8.62 4.66 2.21 0.00 0.00 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 1.01 0.00 0.00 5 V 8.50 3.73 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.25 0.00 0.00 6 E 9.20 4.37 0.00 2.03 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 2.29 0.00 7 K 7.40 4.56 0.00 1.74 1.49 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.40 7.81 8 V 8.25 4.12 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 0.42 0.00 0.00 0.65 0.00 0.00 9 L 8.60 4.31 0.00 1.26 1.59 0.76 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 10 D 6.93 4.42 0.00 2.57 2.22 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 11 R 8.62 5.18 0.00 1.60 1.85 0.00 3.10 0.00 0.00 3.44 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.70 0.00 12 R 9.16 4.69 0.00 1.54 1.58 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.14 0.00 13 V 8.30 4.62 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 0.80 0.00 0.00 0.88 0.00 0.00 14 V 8.26 4.26 1.95 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 0.51 0.00 0.00 0.78 0.00 0.00 15 K 9.75 3.91 0.00 1.79 1.80 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.36 7.81 16 G 8.38 3.85 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 0.00 0.00 0.00 17 K 7.74 4.31 0.00 1.70 1.71 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.33 1.24 7.81 18 V 8.18 4.40 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 0.59 0.00 0.00 0.89 0.00 0.00 19 E 9.09 5.32 0.00 1.89 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 2.25 2.22 0.00 20 Y 9.00 5.11 0.00 2.75 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.24 3.84 0.00 0.27 0.82 -0.10 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.39 4.78 0.00 0.88 0.54 0.54 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 23 K 8.28 4.99 0.00 1.76 1.64 0.00 1.61 0.00 0.00 1.94 0.00 0.00 3.08 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.27 7.81 24 W 8.57 5.30 0.00 3.28 3.08 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 0.00 0.00 0.00 0.00 25 K 8.62 4.76 0.00 1.81 1.92 0.00 1.75 0.00 0.00 1.60 0.00 0.00 3.08 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.62 7.81 26 G 9.25 3.90 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 0.00 0.00 0.00 27 F 7.84 4.82 0.00 3.30 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 28 S 8.49 4.46 0.00 3.91 3.82 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 29 D 8.90 4.59 0.00 2.77 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.34 4.08 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 2.17 0.00 31 D 7.88 5.01 0.00 2.97 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.16 5.12 0.00 2.56 2.62 0.00 0.00 6.54 8.24 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 33 T 8.37 4.95 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 34 W 8.91 5.00 0.00 3.19 3.14 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 35 E 9.50 4.92 0.00 1.91 1.91 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 2.37 2.62 0.00 36 P 0.00 4.79 0.00 2.22 2.00 0.00 3.68 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.11 0.00 37 E 9.22 3.93 0.00 2.48 2.42 0.00 0.00 0.00 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 2.35 0.00 38 E 8.48 3.98 0.00 2.00 1.95 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 2.24 1.91 0.00 39 N 7.67 4.71 0.00 2.73 3.00 0.00 0.00 6.97 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 40 L 7.57 4.29 0.00 1.73 1.53 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 41 D 7.70 4.84 0.00 2.69 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.23 4.83 0.00 2.76 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.31 0.00 2.24 2.29 0.00 3.67 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 2.05 2.01 0.00 44 D 7.96 4.35 0.00 2.71 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 45 L 7.74 4.15 0.00 1.69 1.61 0.84 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.77 3.63 1.79 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.57 0.94 0.00 0.00 47 A 8.22 4.02 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 48 E 7.81 3.91 0.00 2.10 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 2.27 2.22 0.00 49 F 7.69 4.52 0.00 3.18 3.37 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 0.00 50 L 8.38 3.84 0.00 1.68 1.68 0.97 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 51 Q 8.00 4.25 0.00 2.15 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.55 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00