NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.9934 8.3249 119.4872 57.5273 39.9415 173.5614 2 E 4.5016 8.7584 123.3002 54.4820 32.7107 173.8383 3 N 4.6068 8.6640 121.8179 53.4380 39.6889 174.1290 4 R 4.7022 8.3471 122.7232 55.9271 30.1804 178.4945 5 V 3.8097 8.1459 114.7295 64.8028 31.4458 178.0502 6 A 4.3239 7.9208 121.8438 54.5846 18.1428 179.3468 7 E 3.9392 8.1377 116.5874 59.4768 29.5669 179.4562 8 K 4.0910 7.7196 117.2508 59.7198 31.6407 179.2331 9 Q 4.0930 8.5438 118.6557 58.8855 28.2180 179.1108 10 K 3.9356 7.8781 119.9191 59.5170 32.1279 178.4335 11 L 3.7798 7.9061 119.4824 58.2775 41.9843 178.5580 12 F 4.2757 8.2652 115.8446 59.1540 39.2084 177.0270 13 Q 4.5110 7.9564 115.8648 54.9234 28.9923 175.2564 14 E 3.8869 7.3016 121.4537 56.4392 30.1328 177.7420 15 D 4.7428 8.5752 129.2274 54.7486 38.3734 175.8561 16 N 4.6814 7.9177 113.0560 51.9079 38.1193 176.4110 17 G 3.9203 8.0638 104.4042 46.5562 0.0000 173.6151 18 L 4.5054 7.7313 119.0716 52.2199 43.0711 175.1154 19 P 4.4997 0.0000 0.0000 62.0810 32.2327 177.4249 20 V 3.6519 8.6018 119.7445 65.4021 30.9718 177.4956 21 H 4.6300 8.1572 112.7920 56.4816 28.8300 175.2976 22 L 4.6659 8.0624 119.2256 54.2449 43.5528 178.2326 23 K 3.9600 7.7432 118.1305 58.7850 32.1751 177.9919 24 G 3.7388 8.2760 107.0774 46.9656 0.0000 174.3068 25 G 3.6568 6.6079 107.2196 45.3032 0.0000 174.0043 26 A 4.3268 8.3560 121.8159 54.1618 19.1577 179.5711 27 T 3.9491 7.8672 108.3023 64.7272 69.0418 176.4237 28 D 4.4395 8.1509 121.4942 57.2677 40.7825 178.0959 29 N 4.4394 8.1579 117.1487 56.6863 39.0830 176.8123 30 I 3.7212 7.5830 114.5970 63.9863 37.6083 177.9572 31 L 3.9752 8.4644 121.4235 57.6160 41.4448 178.7786 32 Y 4.2865 8.5888 119.5199 61.1433 38.7558 178.6391 33 R 3.5439 8.2403 118.9528 58.8287 29.9735 179.3665 34 V 3.5166 8.1662 118.7015 66.1844 31.5087 178.0644 35 T 3.8250 8.1423 115.7843 67.1405 68.3255 176.3427 36 M 3.9470 8.1236 120.6901 58.7862 31.8958 179.2340 37 T 3.8207 7.7737 115.6851 66.6169 68.7128 176.8516 38 L 4.0306 8.0816 121.0867 57.9375 41.5218 179.4607 39 C 4.1418 8.2513 116.6908 62.8125 28.1259 176.2422 40 L 4.0843 8.1715 120.7611 57.6348 41.1993 179.7946 41 G 3.7012 8.5959 106.1945 47.8864 0.0000 175.8613 42 G 3.8408 8.6319 109.1982 47.9106 0.0000 175.8529 43 T 4.0142 8.3226 118.1986 66.2399 68.3879 176.9496 44 L 4.0724 8.0641 121.1543 57.8137 41.6818 178.7034 45 Y 4.4487 8.5300 119.9873 60.8826 38.7601 177.9829 46 S 3.8967 8.4966 114.3688 61.5649 62.3719 176.1749 47 L 4.0360 8.0194 121.4401 57.8558 41.2408 178.9044 48 Y 4.2494 8.1270 119.4050 61.0861 38.7524 177.8190 49 C 3.7274 8.0161 117.5595 62.6809 28.1703 175.9087 50 L 4.0453 8.0449 121.8496 58.2412 41.4594 179.2963 51 G 3.7807 8.0993 104.6440 47.4587 0.0000 175.3046 52 W 4.1528 8.3344 130.6727 60.3999 30.6160 178.1094 53 A 4.0032 8.4971 120.0754 54.9406 17.8962 179.2050 54 S 4.0370 8.0196 111.3116 59.2646 63.4609 174.1828 55 F 4.4441 7.2311 121.7171 54.3157 40.8034 173.5210 56 P 3.9801 0.0000 0.0000 63.5878 30.9375 175.5276 57 H 4.5625 8.4500 121.1131 53.8898 29.7593 174.4905 58 K 4.2040 8.4971 123.0860 56.3927 32.1983 176.6087 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 F 8.32 4.99 0.00 2.93 2.97 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 0.00 0.00 0.00 2 E 8.76 4.50 0.00 2.01 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 0.00 2.21 2.46 0.00 3 N 8.66 4.61 0.00 2.71 2.78 0.00 0.00 6.86 7.65 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 4 R 8.35 4.70 0.00 1.99 2.11 0.00 3.26 0.00 0.00 3.52 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 5 V 8.15 3.81 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 0.83 0.00 0.00 0.95 0.00 0.00 6 A 7.92 4.32 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 7 E 8.14 3.94 0.00 2.20 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 2.41 2.42 0.00 8 K 7.72 4.09 0.00 2.17 2.02 0.00 1.65 0.00 0.00 1.85 0.00 0.00 3.09 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.79 7.81 9 Q 8.54 4.09 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.69 0.00 10 K 7.88 3.94 0.00 2.02 2.01 0.00 1.53 0.00 0.00 1.57 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.47 7.81 11 L 7.91 3.78 0.00 1.49 1.65 0.69 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 12 F 8.27 4.28 0.00 3.21 3.15 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 0.00 0.00 0.00 0.00 13 Q 7.96 4.51 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.86 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 14 E 7.30 3.89 0.00 2.12 1.83 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 2.29 2.26 0.00 15 D 8.58 4.74 0.00 2.70 2.63 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 0.00 0.00 0.00 0.00 16 N 7.92 4.68 0.00 2.76 2.85 0.00 0.00 6.31 7.00 0.00 0.00 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 8.06 3.92 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 0.00 0.00 0.00 18 L 7.73 4.51 0.00 1.79 1.55 0.88 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.50 0.00 2.19 2.15 0.00 3.63 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 1.79 1.82 0.00 20 V 8.60 3.65 2.11 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 0.84 0.00 0.00 0.93 0.00 0.00 21 H 8.16 4.63 0.00 3.25 3.42 0.00 5.47 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.06 4.67 0.00 1.52 1.60 0.75 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 23 K 7.74 3.96 0.00 2.02 2.09 0.00 1.99 0.00 0.00 1.99 0.00 0.00 3.06 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.34 1.36 7.81 24 G 8.28 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 25 G 6.61 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.36 4.33 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 27 T 7.87 3.95 4.28 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 1.23 0.00 0.00 28 D 8.15 4.44 0.00 2.82 3.03 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 0.00 0.00 0.00 29 N 8.16 4.44 0.00 2.80 2.95 0.00 0.00 6.94 7.73 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 30 I 7.58 3.72 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.11 0.96 0.00 0.00 31 L 8.46 3.98 0.00 2.01 1.85 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 8.59 4.29 0.00 3.07 3.30 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 33 R 8.24 3.54 0.00 1.95 1.86 0.00 3.39 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.92 0.00 34 V 8.17 3.52 2.25 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 1.10 0.00 0.00 0.94 0.00 0.00 35 T 8.14 3.82 4.39 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 1.24 0.00 0.00 36 M 8.12 3.95 0.00 1.81 1.72 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.41 0.00 37 T 7.77 3.82 4.39 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 1.18 0.00 0.00 38 L 8.08 4.03 0.00 1.81 1.72 0.92 1.17 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 39 C 8.25 4.14 0.00 3.10 2.98 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 0.00 0.00 0.00 0.00 40 L 8.17 4.08 0.00 1.67 1.71 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.60 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.63 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.32 4.01 4.42 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 0.00 0.00 1.24 0.00 0.00 44 L 8.06 4.07 0.00 1.94 1.78 0.94 0.56 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 45 Y 8.53 4.45 0.00 2.98 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 46 S 8.50 3.90 0.00 3.86 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 47 L 8.02 4.04 0.00 2.12 1.80 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 8.13 4.25 0.00 3.16 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 C 8.02 3.73 0.00 2.96 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 4.05 0.00 1.68 1.90 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.10 3.78 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 0.00 0.00 0.00 52 W 8.33 4.15 0.00 2.82 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 53 A 8.50 4.00 1.42 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 0.00 0.00 0.00 0.00 0.00 54 S 8.02 4.04 0.00 3.70 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 55 F 7.23 4.44 0.00 2.84 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.98 0.00 2.09 2.02 0.00 3.75 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 57 H 8.45 4.56 0.00 2.44 2.91 0.00 5.86 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 8.50 4.20 0.00 1.69 1.70 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.46 7.81