NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7700 8.3549 109.7379 46.6308 0.0000 174.5778 2 S 3.6914 7.6282 122.2310 55.8244 59.8239 173.3889 3 S 4.2876 8.5954 121.5385 59.2712 65.7554 176.0961 4 G 3.8229 8.0625 108.5564 45.2428 0.0000 175.9860 5 S 4.3831 8.9384 111.6033 58.6046 64.2761 173.4325 6 S 4.7223 8.1753 115.7820 56.5032 65.8027 174.6268 7 G 5.0744 7.9995 121.6792 47.2996 0.0000 172.4275 8 Q 4.6122 7.4784 116.0169 54.7920 33.0603 174.0261 9 L 4.6454 8.2638 116.8527 54.9608 43.6332 178.9708 10 S 4.2030 8.3805 115.6832 61.9603 62.4584 176.6656 11 S 4.1543 8.0611 116.0224 61.4721 62.7362 176.1649 12 E 4.0663 8.2812 122.0665 58.8657 29.3527 179.1402 13 I 3.7989 7.7651 119.7033 64.4609 37.0776 178.0872 14 E 4.0628 8.0333 119.4215 59.4997 29.0453 179.6572 15 R 3.9824 7.5399 117.2408 59.1651 30.4174 178.8072 16 L 4.3671 8.0571 119.0006 57.9496 41.5972 179.3333 17 M 4.5826 7.9661 119.7912 57.9096 31.6267 178.5595 18 S 4.1062 7.6568 112.5723 61.5889 62.5586 176.0638 19 Q 4.0164 7.5847 119.6302 58.2585 28.4734 176.2639 20 G 3.5118 7.3735 107.3256 45.4202 0.0000 173.9993 21 Y 4.3162 7.2607 119.4245 58.0466 38.6168 175.6294 22 S 4.4238 8.5909 117.9146 57.7994 64.8069 174.2219 23 Y 4.2395 8.7439 127.1050 61.1300 38.3469 178.6635 24 Q 3.7756 8.1252 118.1102 59.2056 28.8546 178.4625 25 D 4.3043 8.0448 119.1087 57.3807 40.8909 178.7828 26 I 3.5966 7.9850 120.4691 64.4510 37.0681 178.4852 27 Q 3.7887 7.8015 118.6181 58.9436 28.5578 178.8510 28 K 3.7877 8.1689 119.5245 59.4456 32.0402 179.1925 29 A 3.8557 8.1148 120.9806 55.0909 18.2489 179.5952 30 L 3.8373 7.7457 117.4909 57.9130 41.7125 179.6875 31 V 3.5403 7.9833 118.3605 66.4360 31.2613 178.2778 32 I 3.7368 7.6839 117.6640 63.5132 37.2299 177.2694 33 A 4.2192 7.7054 120.5419 50.9758 19.2584 176.5640 34 H 4.0251 8.6923 114.0594 57.6566 26.4446 175.9559 35 N 4.2473 8.5994 113.6656 53.9732 38.0884 175.4295 36 N 4.3790 7.6766 116.5001 53.4936 38.9609 174.6590 37 I 3.6791 8.2177 128.8655 63.9446 38.1001 177.1956 38 E 3.9287 8.2156 118.9272 59.6042 29.5198 178.8535 39 M 3.9865 8.2494 117.7255 58.7130 32.4101 177.8874 40 A 3.9329 8.3160 121.2863 55.2710 18.3855 179.7352 41 K 3.8391 8.2942 117.0161 59.6446 31.9732 179.2814 42 N 4.3318 7.9249 116.8813 56.2850 38.3380 177.3893 43 I 3.7594 7.6050 120.7216 64.4033 37.2821 178.1579 44 L 3.7106 7.6690 119.5596 58.0475 41.3165 179.8884 45 R 4.1755 8.1538 119.5181 58.2854 29.6748 177.7936 46 E 4.3331 7.7978 116.9963 57.7571 30.4306 177.5392 47 F 4.2612 8.4484 116.7866 59.6276 39.8165 177.3548 48 S 4.3485 8.2387 110.8440 59.6166 62.6166 173.9427 49 G 4.1537 7.8859 107.9542 42.8239 0.0000 172.0030 50 P 4.3915 0.0000 0.0000 62.7000 30.0809 175.9503 51 S 4.4357 8.2950 121.5462 58.3697 62.5577 173.5289 52 S 4.3977 7.8419 114.1480 57.7497 66.5452 175.9294 53 G 4.0069 8.8790 109.6957 46.3707 0.0000 173.4638 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 8.35 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.63 3.69 0.00 4.02 3.86 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 0.00 0.00 0.00 3 S 8.60 4.29 0.00 3.98 4.01 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.06 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 0.00 0.00 0.00 5 S 8.94 4.38 0.00 3.88 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 6 S 8.18 4.72 0.00 3.92 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 7 G 8.00 5.07 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 0.00 0.00 0.00 8 Q 7.48 4.61 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.78 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 9 L 8.26 4.65 0.00 1.73 1.68 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.38 4.20 0.00 3.88 3.96 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 11 S 8.06 4.15 0.00 4.06 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 12 E 8.28 4.07 0.00 2.18 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 0.00 2.34 2.50 0.00 13 I 7.77 3.80 2.13 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.16 1.14 0.00 0.00 14 E 8.03 4.06 0.00 2.15 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 2.54 2.50 0.00 15 R 7.54 3.98 0.00 1.95 2.03 0.00 3.34 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 16 L 8.06 4.37 0.00 2.00 1.98 0.96 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 17 M 7.97 4.58 0.00 2.13 2.29 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.53 0.00 18 S 7.66 4.11 0.00 3.86 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.58 4.02 0.00 1.70 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.36 0.00 0.00 0.00 0.00 0.00 2.64 2.68 0.00 20 G 7.37 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 21 Y 7.26 4.32 0.00 3.08 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 22 S 8.59 4.42 0.00 3.96 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 23 Y 8.74 4.24 0.00 3.10 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 24 Q 8.13 3.78 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.69 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 25 D 8.04 4.30 0.00 2.86 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 26 I 7.99 3.60 1.99 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.82 0.91 0.00 0.00 27 Q 7.80 3.79 0.00 1.88 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.73 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 28 K 8.17 3.79 0.00 1.83 1.79 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.56 7.81 29 A 8.11 3.86 1.25 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 0.00 0.00 0.00 30 L 7.75 3.84 0.00 1.82 1.69 0.93 0.87 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 31 V 7.98 3.54 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.93 0.00 0.00 32 I 7.68 3.74 1.75 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.67 0.80 0.00 0.00 33 A 7.71 4.22 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 34 H 8.69 4.03 0.00 3.29 3.32 0.00 5.78 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 N 8.60 4.25 0.00 2.86 2.98 0.00 0.00 6.77 8.79 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 36 N 7.68 4.38 0.00 2.81 2.80 0.00 0.00 6.70 7.75 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 37 I 8.22 3.68 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 1.65 1.32 0.91 0.00 0.00 38 E 8.22 3.93 0.00 2.19 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 0.00 2.40 2.37 0.00 39 M 8.25 3.99 0.00 2.17 2.03 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 2.57 2.50 0.00 40 A 8.32 3.93 1.37 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 0.00 0.00 41 K 8.29 3.84 0.00 2.03 1.87 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.58 7.81 42 N 7.92 4.33 0.00 2.87 2.88 0.00 0.00 7.04 7.18 0.00 0.00 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 I 7.61 3.76 1.82 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 1.45 0.89 0.64 0.00 0.00 44 L 7.67 3.71 0.00 1.27 0.13 0.55 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.15 4.18 0.00 1.99 2.21 0.00 3.18 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 46 E 7.80 4.33 0.00 2.18 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 2.38 2.52 0.00 47 F 8.45 4.26 0.00 3.07 3.12 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 0.00 48 S 8.24 4.35 0.00 3.88 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 0.00 49 G 7.89 4.15 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 0.00 0.00 0.00 50 P 0.00 4.39 0.00 2.19 2.13 0.00 3.81 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 2.00 1.95 0.00 51 S 8.29 4.44 0.00 3.88 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 52 S 7.84 4.40 0.00 3.83 3.73 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 53 G 8.88 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00