NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9355 8.3549 109.7366 45.1108 0.0000 173.6552 3 K 3.8928 8.5770 122.7462 55.6139 32.8706 170.7929 4 V 4.5055 8.5959 121.2953 61.4437 35.6153 173.6318 5 Y 5.0330 8.8516 123.9885 56.0964 41.1538 174.6587 6 K 4.5395 8.3901 121.9017 54.4384 35.8309 174.8135 7 K 4.9044 8.4766 124.1401 54.6822 34.7859 175.8150 8 V 4.5320 8.8232 118.2255 59.5202 34.9483 174.2585 9 E 5.0512 8.7206 124.5772 54.8049 30.8413 174.8694 10 L 4.9301 9.0090 126.3736 52.8391 46.3624 175.8594 11 V 4.7335 8.2830 119.6207 61.3087 33.6640 175.0001 12 G 4.2046 8.8581 116.2663 45.5490 0.0000 171.8899 13 T 5.7890 8.0659 111.0937 59.0493 72.3013 172.9120 14 S 4.6869 8.3299 114.8295 57.8621 65.4206 175.0067 15 E 4.5325 9.0992 124.3537 57.4519 30.0258 177.0700 16 E 4.3968 8.2456 118.0611 56.9578 30.9699 175.9003 17 G 3.4189 7.1881 105.6136 43.9495 0.0000 173.8682 18 L 3.7559 7.3550 118.3452 57.8288 41.4470 179.5876 19 E 3.8947 8.0393 117.7409 59.4068 29.4031 179.1442 20 A 3.9232 7.9048 120.0004 55.0554 18.5436 179.4028 21 A 3.9222 7.8422 118.8757 55.2229 18.4722 179.9501 22 I 3.4659 7.7248 118.2574 64.6700 37.1091 178.6586 23 Q 3.8905 8.2686 118.9224 58.8145 28.4586 178.8829 24 A 3.9088 8.1301 121.5833 55.0801 18.4002 179.5637 25 A 3.8829 7.8187 119.0661 55.3322 18.4638 179.9189 26 L 3.8483 7.9364 117.2811 57.7402 41.3950 179.6363 27 A 3.9622 7.9984 120.3692 55.0554 18.7248 179.3824 28 R 3.9198 8.0412 117.1564 59.2967 30.0502 178.5122 29 A 3.8919 8.1035 120.8172 55.1761 18.1714 179.5875 30 R 3.7613 7.7091 115.7078 59.0538 30.1166 178.5377 31 K 4.1315 7.6616 117.7271 58.7407 32.0726 177.6163 32 T 4.4931 7.6676 105.4427 60.5591 70.4831 173.5662 33 L 4.4241 7.7659 121.9340 52.8778 43.5828 175.8155 34 R 4.5204 7.8280 119.5448 55.4593 33.2997 174.8498 35 H 4.2012 8.4950 113.1173 56.8911 26.0820 175.3394 36 L 4.5742 8.1356 118.7155 55.3357 42.2527 176.2787 37 D 5.2077 9.2681 123.0954 55.3322 43.4586 176.0546 38 W 5.4522 7.7790 113.2036 55.3267 31.8816 173.1794 39 F 5.3275 8.2299 113.9550 55.3874 41.0281 173.7496 40 E 4.7443 9.3217 118.8902 54.6803 33.3879 175.0016 41 V 4.2599 8.7555 125.1347 62.9679 31.7205 175.4496 42 K 4.4975 9.2830 127.6902 58.1070 33.5816 176.8216 43 E 4.8400 7.8836 116.8002 55.0339 34.3362 174.4435 44 I 5.0553 8.3373 122.8838 59.8462 40.3396 174.8485 45 R 4.5581 8.7390 123.6493 56.9294 33.0116 173.5547 46 G 4.2268 8.0035 105.5713 47.1143 0.0000 172.3379 47 T 4.7645 7.9667 109.9238 60.0320 71.6545 173.6173 48 I 4.8513 8.2206 122.6601 59.8982 40.1201 175.5397 49 G 4.1004 9.1828 114.3677 44.2665 0.0000 172.5432 50 E 3.9394 8.9135 115.8167 58.6714 29.6559 177.2333 51 A 4.5911 8.0196 121.1384 51.7705 20.8239 176.9464 52 G 3.9082 8.1080 113.1124 46.0075 0.0000 177.8061 53 V 3.7735 8.5595 120.0080 62.6891 32.1783 173.9049 54 K 4.3211 8.7441 129.0389 57.8731 33.1265 176.1877 55 E 4.8333 7.8260 118.4805 54.7275 33.8113 174.0412 56 Y 4.6910 9.3829 122.3305 57.2152 40.1064 174.6876 57 Q 4.9053 9.4937 122.2908 54.2941 32.5420 174.4781 58 V 4.6312 8.7791 125.5854 61.0726 33.8433 174.5619 59 V 4.7054 8.8322 129.8362 62.0312 32.6914 174.7884 60 L 5.2913 9.1822 127.4926 54.3557 44.6466 174.6344 61 E 5.0275 9.3050 119.8728 54.8235 31.9672 175.1599 62 V 4.4818 9.0602 124.5700 61.0329 34.0859 174.2660 63 G 2.9733 8.1170 116.0569 44.0487 0.0000 172.3539 64 F 5.6343 8.3326 118.4116 54.9944 41.9261 173.5734 65 R 4.1496 8.8931 121.6324 56.1113 30.5096 175.9978 66 L 4.5639 8.3196 126.4391 54.1767 42.7997 176.5444 67 E 4.4344 8.7345 121.4133 55.4089 30.9770 176.4662 68 E 4.2634 8.4963 117.9427 56.5237 29.7852 175.8446 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 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 K 8.58 3.89 0.00 1.81 1.40 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.46 7.81 4 V 8.60 4.51 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 1.09 0.00 0.00 0.91 0.00 0.00 5 Y 8.85 5.03 0.00 3.04 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 6 K 8.39 4.54 0.00 1.43 0.74 0.00 1.56 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.14 1.26 7.81 7 K 8.48 4.90 0.00 1.62 1.79 0.00 2.11 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.09 1.43 7.81 8 V 8.82 4.53 2.14 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 0.94 0.00 0.00 1.11 0.00 0.00 9 E 8.72 5.05 0.00 2.13 1.86 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 2.22 2.47 0.00 10 L 9.01 4.93 0.00 1.55 1.47 0.87 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.28 4.73 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 0.85 0.00 0.00 0.94 0.00 0.00 12 G 8.86 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 0.00 0.00 0.00 0.00 13 T 8.07 5.79 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 1.22 0.00 0.00 14 S 8.33 4.69 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 15 E 9.10 4.53 0.00 2.03 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 2.53 2.35 0.00 16 E 8.25 4.40 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 2.27 0.00 17 G 7.19 3.42 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 0.00 18 L 7.36 3.76 0.00 1.55 1.63 0.86 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 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 7.90 3.92 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 21 A 7.84 3.92 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.72 3.47 1.85 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 1.37 0.94 0.29 0.00 0.00 23 Q 8.27 3.89 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 24 A 8.13 3.91 1.36 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 25 A 7.82 3.88 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 26 L 7.94 3.85 0.00 1.74 1.66 0.69 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.00 3.96 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 28 R 8.04 3.92 0.00 1.92 2.03 0.00 3.12 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 29 A 8.10 3.89 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 30 R 7.71 3.76 0.00 1.80 2.09 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 1.60 1.63 0.00 31 K 7.66 4.13 0.00 1.90 1.82 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.64 1.55 7.81 32 T 7.67 4.49 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 7.77 4.42 0.00 1.34 0.76 0.44 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 34 R 7.83 4.52 0.00 1.65 1.47 0.00 3.31 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.51 0.00 35 H 8.49 4.20 0.00 3.66 3.48 0.00 5.62 0.00 0.00 0.00 0.00 6.96 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 4.57 0.00 1.68 1.67 0.87 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 37 D 9.27 5.21 0.00 3.00 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 38 W 7.78 5.45 0.00 3.23 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 39 F 8.23 5.33 0.00 3.03 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 40 E 9.32 4.74 0.00 1.99 1.93 0.00 0.00 0.00 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 2.55 0.00 41 V 8.76 4.26 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 0.83 0.00 0.00 1.11 0.00 0.00 42 K 9.28 4.50 0.00 1.65 1.87 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.58 7.81 43 E 7.88 4.84 0.00 1.90 1.80 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 2.32 2.37 0.00 44 I 8.34 5.06 1.91 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 8.74 4.56 0.00 1.83 2.04 0.00 2.87 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 46 G 8.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.97 4.76 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 8.22 4.85 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 0.62 0.92 0.00 0.00 49 G 9.18 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.91 3.94 0.00 2.06 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 0.00 2.27 2.36 0.00 51 A 8.02 4.59 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.11 3.91 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 0.00 0.00 0.00 53 V 8.56 3.77 1.76 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 -0.30 0.00 0.00 0.65 0.00 0.00 54 K 8.74 4.32 0.00 1.78 1.82 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.34 1.36 7.81 55 E 7.83 4.83 0.00 1.78 1.75 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 0.00 2.18 2.39 0.00 56 Y 9.38 4.69 0.00 3.07 2.83 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 57 Q 9.49 4.91 0.00 1.93 1.99 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 2.27 2.28 0.00 58 V 8.78 4.63 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 0.94 0.00 0.00 0.94 0.00 0.00 59 V 8.83 4.71 2.19 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 0.83 0.00 0.00 0.99 0.00 0.00 60 L 9.18 5.29 0.00 1.94 1.75 0.90 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 61 E 9.30 5.03 0.00 1.90 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 2.28 2.42 0.00 62 V 9.06 4.48 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 1.02 0.00 0.00 0.91 0.00 0.00 63 G 8.12 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 0.00 0.00 0.00 64 F 8.33 5.63 0.00 3.38 3.05 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 0.00 0.00 0.00 65 R 8.89 4.15 0.00 1.88 1.88 0.00 3.06 0.00 0.00 3.08 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.98 0.00 66 L 8.32 4.56 0.00 1.58 1.56 0.86 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.73 4.43 0.00 1.99 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 2.34 2.41 0.00 68 E 8.50 4.26 0.00 2.02 1.85 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 2.14 2.24 0.00