NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.6715 8.4244 118.2208 53.0812 38.6410 173.4218 2 F 4.3176 8.0821 119.0588 56.6039 41.6241 167.8833 3 V 4.2105 8.1769 128.0878 60.9745 35.3004 175.3555 4 C 4.4395 8.3575 123.5144 55.5341 35.8739 170.9115 5 P 4.6395 0.0000 0.0000 60.5115 32.8596 173.1468 6 P 4.2932 0.0000 0.0000 64.5439 31.1374 177.5465 7 G 4.1084 8.8477 107.8293 46.2504 0.0000 173.1805 8 Q 4.9306 7.5815 117.4332 54.1864 31.6140 175.1572 9 T 4.8503 8.6586 112.0712 59.4347 72.5180 172.9947 10 F 5.0477 8.9036 125.0041 58.8470 40.4796 174.3947 11 Q 4.2073 8.1976 123.3804 54.7562 32.7777 176.2598 12 T 3.5865 8.3161 119.6408 65.5568 68.8903 175.0336 13 C 4.6392 7.5280 120.9568 54.3812 44.0487 172.6353 14 A 4.3549 8.7188 123.9627 50.3705 20.9052 175.5957 15 S 4.2763 8.7679 116.8848 58.9961 64.0225 174.1969 16 S 4.7290 8.4827 117.2319 59.1831 62.9719 174.4800 17 C 4.9229 7.5062 114.6568 52.9864 40.5100 171.6138 18 P 4.7888 0.0000 0.0000 63.5019 32.4188 177.3340 19 K 4.6597 8.5873 121.0740 56.4928 35.2633 175.5907 20 T 5.2137 8.5424 110.9273 60.1372 72.1865 173.6381 21 C 4.3192 8.3679 116.9524 59.9752 40.4371 175.5043 22 E 3.9876 7.9328 120.6208 59.2813 28.8384 177.4899 23 T 4.0272 7.3080 109.6958 59.4672 69.5310 176.6483 24 R 4.0231 7.9667 122.9027 56.0046 29.3327 177.5001 25 N 4.4772 8.1306 115.1548 55.2813 38.7440 175.5292 26 K 4.6215 7.7735 115.7392 54.8955 34.0896 175.9453 27 L 4.7463 8.0466 120.8917 54.1522 42.3604 176.5082 28 V 4.4462 7.6793 108.7875 60.2392 35.8085 173.9275 29 L 3.8902 7.5617 125.8054 58.0529 42.0511 176.1223 30 C 5.0963 7.2683 114.1269 56.5260 43.0294 171.9799 31 D 4.4982 8.0791 117.3339 53.4745 42.3399 176.6164 32 K 4.1566 8.1296 116.4304 58.4720 32.9061 176.1514 33 K 4.2920 7.6313 119.4862 56.1511 36.1276 173.5789 34 C 5.2537 8.7297 123.7907 55.6477 38.9789 171.5912 35 N 4.6807 8.0857 119.4896 51.9788 40.3766 174.4524 36 Q 5.1584 8.2817 125.6938 54.2630 27.1967 175.1601 37 R 3.8186 7.1982 124.8648 55.0460 35.1177 174.1054 38 C 5.2309 9.2633 123.9853 56.4009 45.3792 174.1070 39 G 4.3590 8.7877 107.3669 45.6222 0.0000 172.3519 40 C 4.6413 9.1085 120.9973 56.3668 40.1683 174.1709 41 I 3.9022 8.1650 120.5153 61.5177 37.1611 176.3879 42 S 5.1867 7.7989 117.5678 57.3384 60.5393 172.7019 43 G 3.8710 7.8474 122.9712 45.3130 0.0000 170.3586 44 T 4.6709 6.9348 111.3727 60.9661 71.7093 174.2141 45 V 4.3721 8.2894 112.5594 60.1718 36.9498 173.2212 46 L 3.9895 9.3144 127.3603 56.7561 41.8245 179.6856 47 K 4.6548 8.4837 126.5512 58.4104 34.5460 175.1613 48 S 4.7935 7.4673 111.9225 56.1422 66.9013 175.1296 49 K 4.0264 8.1253 119.8516 60.2658 32.3452 176.9431 50 D 4.6118 7.3617 113.1116 53.6117 43.4643 174.7954 51 S 4.6016 7.6776 119.1026 58.6839 64.0028 175.0139 52 S 4.6592 8.4024 117.6875 58.2818 64.3337 172.9615 53 E 5.4098 7.8530 121.2429 56.1059 33.3072 172.9388 54 C 5.2302 8.5941 125.0292 55.6358 42.1712 173.7313 55 V 4.5253 8.4925 116.9843 59.7345 34.6204 175.2366 56 H 4.9266 8.5583 119.3605 54.7562 29.0064 174.8683 57 P 4.2671 0.0000 0.0000 66.2711 30.6496 178.8184 58 S 4.2870 8.0475 112.5101 60.5671 63.0348 176.1514 59 K 4.1693 7.1804 118.3166 59.0829 32.3578 176.0973 60 C 4.1909 8.0273 119.5023 57.5442 41.2536 173.9365 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 N 8.42 4.67 0.00 2.81 2.91 0.00 0.00 5.80 6.55 0.00 0.00 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 F 8.08 4.32 0.00 2.98 2.79 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 0.00 0.00 0.00 3 V 8.18 4.21 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 0.77 0.00 0.00 0.85 0.00 0.00 4 C 8.36 4.44 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 5 P 0.00 4.64 0.00 2.44 2.16 0.00 3.44 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 6 P 0.00 4.29 0.00 2.23 2.23 0.00 3.72 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 1.98 0.00 7 G 8.85 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.58 4.93 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.95 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 9 T 8.66 4.85 4.32 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 1.25 0.00 0.00 10 F 8.90 5.05 0.00 3.17 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.20 4.21 0.00 1.79 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.19 2.45 0.00 12 T 8.32 3.59 4.12 0.00 0.00 0.00 0.00 0.00 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 13 C 7.53 4.64 0.00 2.88 2.91 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 14 A 8.72 4.35 1.19 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 0.00 0.00 15 S 8.77 4.28 0.00 4.12 3.76 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 0.00 0.00 0.00 0.00 16 S 8.48 4.73 0.00 3.90 3.87 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 0.00 0.00 0.00 0.00 17 C 7.51 4.92 0.00 3.08 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 18 P 0.00 4.79 0.00 2.10 2.11 0.00 3.75 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 19 K 8.59 4.66 0.00 1.88 2.04 0.00 1.38 0.00 0.00 1.91 0.00 0.00 2.92 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.37 7.81 20 T 8.54 5.21 4.30 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 1.24 0.00 0.00 21 C 8.37 4.32 0.00 3.03 3.21 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 0.00 0.00 0.00 0.00 22 E 7.93 3.99 0.00 1.87 1.97 0.00 0.00 0.00 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 2.25 0.00 23 T 7.31 4.03 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 24 R 7.97 4.02 0.00 1.99 2.12 0.00 3.22 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.81 0.00 25 N 8.13 4.48 0.00 2.73 2.88 0.00 0.00 6.86 7.37 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 26 K 7.77 4.62 0.00 1.76 1.78 0.00 1.61 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.49 7.81 27 L 8.05 4.75 0.00 1.69 1.65 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 28 V 7.68 4.45 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 0.64 0.00 0.00 0.92 0.00 0.00 29 L 7.56 3.89 0.00 1.78 1.66 0.93 0.99 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 30 C 7.27 5.10 0.00 3.01 2.89 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 31 D 8.08 4.50 0.00 2.71 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 32 K 8.13 4.16 0.00 1.87 1.92 0.00 1.54 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.40 1.48 7.81 33 K 7.63 4.29 0.00 1.77 1.60 0.00 1.59 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.36 7.81 34 C 8.73 5.25 0.00 2.85 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 35 N 8.09 4.68 0.00 2.76 2.67 0.00 0.00 6.57 7.57 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 36 Q 8.28 5.16 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.78 0.00 0.00 0.00 0.00 0.00 2.50 2.21 0.00 37 R 7.20 3.82 0.00 1.73 1.78 0.00 3.21 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.50 0.00 38 C 9.26 5.23 0.00 3.37 3.22 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 39 G 8.79 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 0.00 0.00 0.00 0.00 40 C 9.11 4.64 0.00 2.86 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 41 I 8.16 3.90 1.85 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.87 0.93 0.00 0.00 42 S 7.80 5.19 0.00 3.83 3.81 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 43 G 7.85 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 6.93 4.67 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 0.89 0.00 0.00 45 V 8.29 4.37 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 0.57 0.00 0.00 0.97 0.00 0.00 46 L 9.31 3.99 0.00 1.79 1.75 1.01 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.48 4.65 0.00 2.06 1.86 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.47 7.81 48 S 7.47 4.79 0.00 3.86 3.72 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 49 K 8.13 4.03 0.00 1.74 1.90 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.43 7.81 50 D 7.36 4.61 0.00 2.57 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 S 7.68 4.60 0.00 3.93 3.72 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 52 S 8.40 4.66 0.00 3.83 3.76 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 0.00 0.00 0.00 0.00 53 E 7.85 5.41 0.00 2.16 1.73 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 2.21 2.27 0.00 54 C 8.59 5.23 0.00 2.91 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.49 4.53 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 0.73 0.00 0.00 0.96 0.00 0.00 56 H 8.56 4.93 0.00 3.08 3.20 0.00 5.63 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.27 0.00 2.27 2.33 0.00 3.85 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 58 S 8.05 4.29 0.00 4.04 4.04 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 59 K 7.18 4.17 0.00 1.91 1.91 0.00 1.83 0.00 0.00 1.83 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.53 7.81 60 C 8.03 4.19 0.00 3.15 3.06 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 0.00 0.00 0.00 0.00