NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 S 4.4806 8.3344 116.8051 58.2874 64.8432 173.0202 8 D 4.8414 7.9450 120.4497 51.6890 42.9963 173.9802 9 F 5.5206 8.7858 117.6204 55.3299 42.0395 173.4942 10 V 4.6603 9.4004 112.7621 59.6196 35.4306 174.8163 11 V 4.7838 8.7327 124.3557 61.4436 33.5665 174.4352 12 I 4.9814 9.0517 128.9724 59.4224 40.3649 174.1923 13 K 5.0509 9.2824 129.1388 54.4411 34.5811 174.7910 14 A 4.6137 8.7916 129.9556 51.9056 19.2316 177.5974 15 L 4.6262 9.3118 122.6954 55.0709 43.0298 175.7707 16 E 4.8099 7.7650 116.2261 54.4752 33.7240 174.4887 17 D 4.6839 8.7131 119.2383 55.1151 41.4901 176.1102 18 G 3.8372 8.3836 107.3832 46.7350 0.0000 174.3710 19 V 3.9626 7.8486 119.4528 62.3518 33.2182 174.1726 20 N 5.1326 9.3684 126.2264 51.9284 41.3482 173.3135 21 V 4.5889 8.6831 127.7404 61.6344 33.1893 174.1888 22 I 4.5913 8.9879 130.5798 59.6492 39.1597 175.2131 23 G 4.3841 9.5939 116.1382 45.0692 0.0000 172.4348 24 L 5.1550 8.9893 124.5476 53.3912 44.6045 177.4047 25 T 4.4551 8.3655 116.2644 61.7686 69.1467 174.2996 26 R 3.9819 7.8390 123.2458 57.4274 30.0266 177.9090 27 G 3.6179 8.1148 106.4716 48.5378 0.0000 174.1794 28 A 4.3190 7.7891 120.9952 52.9568 19.4247 176.7534 29 D 4.3693 7.1880 112.3627 52.8156 42.1346 175.7774 30 T 4.3080 8.5580 112.2104 61.1913 69.1395 173.7733 31 R 4.1305 7.8001 128.3798 55.6454 32.5334 174.7615 32 F 4.6689 7.1748 116.9873 56.8473 35.2996 174.0681 33 H 4.2165 8.3881 126.7436 59.8674 30.2901 174.8104 34 H 4.7607 8.3141 121.6703 54.7493 32.3438 171.7635 35 S 5.0184 8.6120 120.6095 57.2153 64.4817 173.3242 36 E 4.4422 8.5287 128.5033 55.4849 32.3969 174.9393 37 K 4.7777 8.6570 131.0392 54.9859 33.0526 172.8167 38 L 4.9763 9.1832 123.3379 52.6346 45.3993 175.4671 39 D 5.1588 10.0452 123.6545 51.8573 43.8773 175.8028 40 K 4.0963 8.1151 121.5487 58.0542 32.1923 176.9987 41 G 4.0081 9.3515 115.8424 45.0472 0.0000 173.2130 42 E 4.3091 8.3466 120.0350 56.1576 30.9390 175.9337 43 V 4.9496 8.2678 121.6275 61.0258 34.4895 174.2028 44 L 4.7030 9.0967 129.8000 53.3157 44.8102 174.9941 45 I 4.8709 8.4873 126.7455 59.8787 38.3891 174.3273 46 A 4.6686 9.0497 130.3124 50.1324 20.9840 175.2768 47 Q 5.0723 8.4926 123.3134 54.2759 31.6127 174.8224 48 F 4.5013 8.7789 124.1209 57.5055 39.6656 175.8864 49 T 4.5755 8.4605 114.5974 59.7664 71.1453 174.3485 50 E 4.1478 8.7760 118.6704 59.8509 29.7730 177.8245 51 H 4.0275 8.5199 116.6234 57.8816 28.8536 174.3008 52 T 4.8688 7.5616 115.5406 61.7843 68.9742 173.9894 53 S 4.5145 8.8762 122.3702 60.5171 63.8693 174.5771 54 A 5.1460 8.0646 120.6181 49.6844 22.9316 174.7113 55 I 4.9622 8.5070 119.2997 59.4496 40.5107 174.7956 56 K 4.5904 9.2846 128.9687 54.5858 34.6165 174.8977 57 V 4.8242 8.4213 126.4865 61.3381 33.6703 174.5414 58 R 4.5042 9.4195 128.0215 54.8516 32.2115 175.5376 59 G 4.1586 8.7112 109.0087 42.8148 0.0000 172.0368 60 K 4.7397 9.0812 121.5734 55.8981 32.8095 175.5238 61 A 5.1577 8.9837 128.6082 50.6800 23.5817 173.5775 62 Y 4.9894 9.1774 121.3903 56.0578 40.9055 174.5633 63 I 4.9792 8.6795 127.4542 59.5123 40.7582 174.3601 64 Q 4.9705 9.1314 126.0756 54.2687 31.5130 174.8794 65 T 4.8835 8.4431 112.7354 59.2854 72.4159 174.6932 66 R 3.6464 8.5686 121.3699 59.4096 29.8417 176.3979 67 H 4.7098 7.6320 112.6717 55.4463 29.1204 174.0657 68 G 3.7192 8.0055 106.9464 44.2542 0.0000 173.3392 69 V 4.5862 7.7404 111.1360 60.4681 33.7450 175.5229 70 I 4.4074 8.1419 120.7322 60.1191 41.8653 172.5141 71 E 5.2265 8.7735 128.1760 54.3874 31.9580 174.9297 72 S 4.6324 9.3504 124.7422 57.7549 65.1194 174.1099 73 E 5.1797 8.5833 122.0053 54.6159 29.2145 173.6359 74 G 3.8257 8.2978 112.6010 46.2004 0.0000 171.2795 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 7 S 8.33 4.48 0.00 3.92 4.03 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 8 D 7.94 4.84 0.00 2.81 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 F 8.79 5.52 0.00 3.14 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 V 9.40 4.66 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 0.72 0.00 0.00 0.87 0.00 0.00 11 V 8.73 4.78 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 1.05 0.00 0.00 1.17 0.00 0.00 12 I 9.05 4.98 1.88 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 1.11 0.61 0.93 0.00 0.00 13 K 9.28 5.05 0.00 1.88 1.81 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.40 7.81 14 A 8.79 4.61 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.31 4.63 0.00 1.58 1.73 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.77 4.81 0.00 1.98 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 2.26 2.33 0.00 17 D 8.71 4.68 0.00 2.69 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 18 G 8.38 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 19 V 7.85 3.96 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.05 0.00 0.00 20 N 9.37 5.13 0.00 2.81 2.65 0.00 0.00 6.61 7.64 0.00 0.00 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 V 8.68 4.59 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 0.88 0.00 0.00 0.92 0.00 0.00 22 I 8.99 4.59 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.50 1.01 0.00 0.00 23 G 9.59 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.99 5.15 0.00 1.85 1.58 1.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.37 4.46 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 26 R 7.84 3.98 0.00 2.01 1.90 0.00 3.19 0.00 0.00 3.33 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 27 G 8.11 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.79 4.32 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 29 D 7.19 4.37 0.00 2.74 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.56 4.31 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 1.19 0.00 0.00 31 R 7.80 4.13 0.00 1.64 1.93 0.00 3.02 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.66 0.00 32 F 7.17 4.67 0.00 3.10 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 33 H 8.39 4.22 0.00 3.43 3.65 0.00 5.89 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 8.31 4.76 0.00 3.09 3.18 0.00 5.82 0.00 0.00 0.00 0.00 6.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.61 5.02 0.00 3.96 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.53 4.44 0.00 1.92 1.77 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 2.18 2.27 0.00 37 K 8.66 4.78 0.00 1.58 1.57 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.65 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.36 1.04 7.81 38 L 9.18 4.98 0.00 1.49 1.54 0.93 1.04 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 39 D 10.05 5.16 0.00 2.78 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.12 4.10 0.00 1.74 1.92 0.00 1.63 0.00 0.00 1.56 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.40 7.81 41 G 9.35 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 42 E 8.35 4.31 0.00 2.08 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 2.32 2.25 0.00 43 V 8.27 4.95 2.09 0.00 0.00 0.00 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 0.96 0.00 0.00 44 L 9.10 4.70 0.00 1.74 1.46 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.49 4.87 1.73 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 0.91 0.61 0.00 0.00 46 A 9.05 4.67 1.13 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 0.00 0.00 0.00 47 Q 8.49 5.07 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 48 F 8.78 4.50 0.00 3.07 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 49 T 8.46 4.58 4.31 0.00 0.00 0.00 0.00 0.00 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 50 E 8.78 4.15 0.00 2.11 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 0.00 2.34 2.35 0.00 51 H 8.52 4.03 0.00 3.27 3.42 0.00 5.76 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.56 4.87 4.33 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 1.29 0.00 0.00 53 S 8.88 4.51 0.00 3.91 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 54 A 8.06 5.15 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 55 I 8.51 4.96 1.82 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.60 0.86 0.00 0.00 56 K 9.28 4.59 0.00 1.80 1.67 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.38 7.81 57 V 8.42 4.82 2.09 0.00 0.00 0.00 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 0.93 0.00 0.00 58 R 9.42 4.50 0.00 1.80 1.83 0.00 3.18 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 59 G 8.71 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 9.08 4.74 0.00 1.89 1.73 0.00 1.62 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.42 7.81 61 A 8.98 5.16 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 62 Y 9.18 4.99 0.00 2.99 2.84 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 63 I 8.68 4.98 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.59 0.92 0.00 0.00 64 Q 9.13 4.97 0.00 1.91 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.60 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 65 T 8.44 4.88 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 1.18 0.00 0.00 66 R 8.57 3.65 0.00 1.58 1.78 0.00 3.18 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 67 H 7.63 4.71 0.00 3.20 3.25 0.00 5.68 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.01 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 0.00 0.00 0.00 69 V 7.74 4.59 1.55 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 0.66 0.00 0.00 0.98 0.00 0.00 70 I 8.14 4.41 1.83 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 1.10 1.09 0.86 0.00 0.00 71 E 8.77 5.23 0.00 2.10 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 2.23 2.37 0.00 72 S 9.35 4.63 0.00 3.91 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 73 E 8.58 5.18 0.00 1.74 1.77 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 2.11 1.84 0.00 74 G 8.30 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