NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9741 8.3549 109.7379 44.1095 0.0000 173.6487 3 K 4.4871 7.8533 118.8535 52.7431 36.8160 170.4670 4 V 4.5572 8.6579 120.6972 61.5083 35.5081 173.5730 5 Y 4.9749 8.9244 124.2291 56.0780 41.0303 174.6865 6 K 4.5236 8.1718 122.2924 54.5053 35.3697 174.7479 7 K 5.0914 8.5359 124.7851 54.7492 34.4170 175.8883 8 V 4.5628 8.7242 117.1391 59.4962 35.5096 174.2197 9 E 4.9530 8.7992 124.6845 54.8864 30.6501 174.8755 10 L 4.9135 9.0683 127.0333 52.8242 45.9135 175.8374 11 V 4.7385 8.3327 120.3469 61.2789 33.6032 174.9440 12 G 4.6598 9.0409 116.0488 44.6716 0.0000 172.1625 13 T 5.3471 8.1941 112.2644 60.0517 72.1121 172.9973 14 S 4.6977 8.6791 116.1417 57.6116 65.8569 175.2717 15 E 4.3485 9.0453 124.9489 58.5115 29.9232 178.1485 16 E 4.1843 8.5594 118.7294 57.2356 30.2138 176.5683 17 G 3.3506 7.1877 105.0002 44.2439 0.0000 173.4911 18 L 3.7731 7.3075 118.1827 57.7427 41.5521 179.4121 19 E 3.8877 8.0400 117.7757 59.5264 29.4244 179.2094 20 A 4.0667 7.9187 119.8715 55.0041 18.4818 179.4209 21 A 3.9298 7.8713 118.9611 55.2690 18.4512 179.9862 22 I 3.4931 7.7488 118.3008 64.6353 37.1011 178.6938 23 Q 3.9170 8.4858 119.0253 58.8454 28.5560 178.8227 24 A 3.9377 8.2027 121.6930 54.8720 18.3424 179.5714 25 A 3.8709 7.7918 118.7540 55.4765 18.6342 179.8169 26 L 3.8740 7.8512 117.2636 57.6391 41.3804 179.6218 27 A 3.9654 8.0748 120.6462 55.0870 18.7132 179.3722 28 R 3.9191 7.9074 116.5949 59.3019 30.0613 178.4670 29 A 3.8909 8.0893 120.7659 55.2722 18.1801 179.6372 30 R 3.7665 7.8467 115.5754 59.1305 30.1295 178.5601 31 K 4.1545 7.6953 117.6032 58.6978 32.0597 177.6500 32 T 4.5258 7.6650 105.3307 60.3460 70.3808 173.5481 33 L 4.4805 7.8848 122.0784 52.7434 43.7421 175.8637 34 R 4.5042 7.9108 120.3119 55.6908 33.0968 174.8322 35 H 4.1683 8.4541 113.6927 57.0057 25.7930 175.0912 36 L 4.5858 8.1364 119.2063 55.1839 42.1991 175.8438 37 D 5.1735 9.2076 122.9109 55.4615 43.1847 176.2953 38 F 5.2373 7.6605 111.2594 55.5408 41.6404 172.7475 39 F 5.5448 8.3097 113.2482 55.6540 41.4905 173.6777 40 E 4.7254 9.3322 118.5944 54.7511 33.5832 175.0188 41 V 4.1920 8.8021 125.3886 63.1741 31.7205 175.3781 42 K 4.5169 9.3754 127.4810 57.9331 33.6622 176.6836 43 E 4.8375 7.9390 116.7988 54.8637 34.4505 174.4451 44 I 5.0334 8.3766 122.5557 59.7876 40.1240 174.8768 45 R 4.6234 8.9857 123.5470 55.8086 33.5051 173.3841 46 G 4.1535 7.7730 104.9934 46.8937 0.0000 172.2156 47 T 4.8417 8.0508 109.5293 59.7994 72.0611 173.2732 48 I 4.8182 8.2691 122.4012 59.8089 40.2349 175.4424 49 G 4.2744 8.6252 115.2665 44.1684 0.0000 172.6711 50 E 4.0586 8.8822 117.2403 58.1597 29.6145 177.3902 51 A 4.6084 8.0230 120.3512 51.6882 20.5080 176.4828 52 G 3.9808 7.7561 103.4714 44.1998 0.0000 175.7243 53 V 3.6656 8.1906 124.6682 63.3488 31.7450 175.1631 54 K 4.1992 8.8806 129.5669 58.2963 32.9114 176.3861 55 E 4.7350 7.6755 119.6179 54.6314 33.1196 173.6657 56 Y 4.6014 8.9315 125.0817 57.9678 39.7439 174.7591 57 Q 4.8829 9.4998 121.8365 54.3514 32.9692 174.1551 58 V 4.7081 8.8280 125.0936 61.0405 34.1288 174.3977 59 V 4.6098 8.7696 128.9982 61.8728 33.0594 174.3953 60 L 5.2225 9.0964 129.6478 53.4683 45.7404 174.6648 61 E 5.0160 9.4287 126.0616 55.2851 31.7651 175.2411 62 V 4.6985 8.9403 123.9377 61.0602 34.5973 174.1493 63 G 3.8935 8.5684 116.0621 44.1664 0.0000 172.2525 64 F 5.6305 8.7685 119.3798 54.8610 41.6954 173.8975 65 R 3.8531 8.7571 122.4146 55.8275 30.5647 175.8855 66 L 4.3273 8.2555 127.4584 54.2504 42.2527 177.1194 67 E 4.0863 8.8588 123.5212 56.5966 30.0950 176.8786 68 E 4.3119 8.6205 121.4905 57.6368 30.4606 176.6307 69 T 4.2048 7.6201 112.8609 61.6952 69.0221 173.4954 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 G 8.35 3.97 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 0.00 0.00 0.00 3 K 7.85 4.49 0.00 1.84 1.47 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.51 7.81 4 V 8.66 4.56 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 1.08 0.00 0.00 0.92 0.00 0.00 5 Y 8.92 4.97 0.00 2.83 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 6 K 8.17 4.52 0.00 1.39 0.74 0.00 1.57 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.22 1.28 7.81 7 K 8.54 5.09 0.00 1.67 1.70 0.00 1.90 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.27 1.45 7.81 8 V 8.72 4.56 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 0.92 0.00 0.00 1.09 0.00 0.00 9 E 8.80 4.95 0.00 1.99 1.87 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 2.22 2.34 0.00 10 L 9.07 4.91 0.00 1.55 1.49 0.89 0.44 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 11 V 8.33 4.74 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 0.86 0.00 0.00 0.94 0.00 0.00 12 G 9.04 4.66 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 13 T 8.19 5.35 4.37 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 1.25 0.00 0.00 14 S 8.68 4.70 0.00 3.92 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 15 E 9.05 4.35 0.00 2.03 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 2.49 2.34 0.00 16 E 8.56 4.18 0.00 1.96 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 2.35 2.41 0.00 17 G 7.19 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 0.00 0.00 0.00 18 L 7.31 3.77 0.00 1.55 1.62 0.86 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.04 3.89 0.00 1.99 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 2.42 0.00 20 A 7.92 4.07 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 21 A 7.87 3.93 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.75 3.49 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.56 0.38 0.00 0.00 23 Q 8.49 3.92 0.00 2.11 2.10 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 2.49 2.48 0.00 24 A 8.20 3.94 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 25 A 7.79 3.87 1.28 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 0.00 0.00 0.00 26 L 7.85 3.87 0.00 1.63 1.66 0.66 0.69 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 27 A 8.07 3.97 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 28 R 7.91 3.92 0.00 1.93 2.05 0.00 3.12 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 29 A 8.09 3.89 1.30 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 0.00 0.00 30 R 7.85 3.77 0.00 1.79 2.12 0.00 3.25 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 31 K 7.70 4.15 0.00 1.94 1.82 0.00 1.67 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.60 7.81 32 T 7.67 4.53 4.17 0.00 0.00 0.00 0.00 0.00 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 33 L 7.88 4.48 0.00 1.39 0.92 0.38 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 34 R 7.91 4.50 0.00 1.57 1.41 0.00 3.25 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.50 0.00 35 H 8.45 4.17 0.00 3.63 3.46 0.00 5.62 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.14 4.59 0.00 1.67 1.66 0.86 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 37 D 9.21 5.17 0.00 2.99 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 38 F 7.66 5.24 0.00 2.93 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 39 F 8.31 5.54 0.00 3.09 2.99 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 0.00 0.00 0.00 40 E 9.33 4.73 0.00 1.99 1.90 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 2.42 2.43 0.00 41 V 8.80 4.19 2.17 0.00 0.00 0.00 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 1.12 0.00 0.00 42 K 9.38 4.52 0.00 1.65 1.86 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.60 1.58 7.81 43 E 7.94 4.84 0.00 1.89 1.79 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 2.32 2.36 0.00 44 I 8.38 5.03 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.65 0.99 0.00 0.00 45 R 8.99 4.62 0.00 1.81 2.02 0.00 2.97 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 46 G 7.77 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 47 T 8.05 4.84 4.20 0.00 0.00 0.00 0.00 0.00 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 48 I 8.27 4.82 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.64 0.87 0.00 0.00 49 G 8.63 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.88 4.06 0.00 1.96 2.01 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 2.30 2.24 0.00 51 A 8.02 4.61 1.24 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 0.00 0.00 0.00 52 G 7.76 3.98 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 0.00 0.00 0.00 53 V 8.19 3.67 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 0.69 0.00 0.00 54 K 8.88 4.20 0.00 1.79 1.83 0.00 1.78 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.37 1.34 7.81 55 E 7.68 4.74 0.00 2.03 1.67 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 2.20 2.29 0.00 56 Y 8.93 4.60 0.00 3.12 2.82 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 57 Q 9.50 4.88 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 58 V 8.83 4.71 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 0.99 0.00 0.00 0.94 0.00 0.00 59 V 8.77 4.61 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 0.89 0.00 0.00 1.00 0.00 0.00 60 L 9.10 5.22 0.00 1.70 1.42 0.89 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 61 E 9.43 5.02 0.00 2.00 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 2.31 2.29 0.00 62 V 8.94 4.70 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 0.98 0.00 0.00 0.94 0.00 0.00 63 G 8.57 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 64 F 8.77 5.63 0.00 3.38 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 65 R 8.76 3.85 0.00 1.90 1.80 0.00 3.06 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.67 0.00 66 L 8.26 4.33 0.00 1.54 1.55 0.84 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.86 4.09 0.00 1.99 2.05 0.00 0.00 0.00 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 2.45 0.00 68 E 8.62 4.31 0.00 1.92 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 2.23 2.23 0.00 69 T 7.62 4.20 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 1.20 0.00 0.00