NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 3.9382 8.1976 109.7323 44.9298 0.0000 175.0339 5 K 3.5780 8.7804 124.9403 57.4809 33.2244 172.1720 6 V 4.1841 8.0772 119.6896 60.6492 33.6434 176.7183 7 K 4.3528 8.2223 126.6107 55.0266 34.8060 177.5477 8 A 3.7612 8.2184 122.9108 55.1424 18.2034 180.3797 9 G 3.3642 7.6592 103.6741 47.9626 0.0000 175.4064 10 E 4.0089 8.0246 121.3323 58.7729 29.4024 178.7114 11 L 4.0931 7.2911 118.6828 57.3409 41.8440 178.9634 12 W 4.5895 7.9754 117.7415 59.0727 29.0610 177.8685 13 N 4.5475 7.9576 117.0503 55.5704 38.7563 175.7079 14 K 4.2143 7.0322 118.6156 55.9861 32.9735 177.4017 15 S 4.5197 8.5110 116.6417 57.6448 65.2764 175.3794 16 K 3.9780 8.5299 121.4343 59.7110 31.7286 179.2192 17 D 4.3893 8.0455 118.7334 56.1805 39.4746 177.9490 18 D 4.4947 7.8216 120.1741 56.4490 40.9555 178.7557 19 L 4.0165 7.9665 119.9853 58.0718 41.5760 179.5042 20 T 3.9280 7.6513 115.6792 66.5073 68.2455 176.7450 21 K 3.9447 8.0896 121.6535 59.4621 32.2213 178.7471 22 Q 3.9764 8.4050 120.3272 58.7392 28.8963 177.7410 23 L 3.9111 8.3132 121.7769 58.1755 42.1677 178.8761 24 A 4.0392 8.3471 120.7248 54.6011 18.2079 179.3196 25 E 3.8980 7.8245 118.5205 59.4345 29.7263 178.8299 26 L 4.1532 8.0146 119.0825 57.5017 41.6671 179.1891 27 K 3.8467 8.1852 119.6813 60.0567 32.0653 178.8239 28 T 3.8906 7.6411 115.8288 66.6765 68.3463 176.4061 29 E 3.9419 8.1978 120.4529 59.2276 29.4668 179.0217 30 L 3.9982 8.2634 120.6873 58.3064 42.3329 179.1290 31 G 3.7014 8.5896 105.8375 48.0929 0.0000 175.1973 32 Q 4.0922 8.1236 120.5346 58.4056 29.1119 177.7640 33 L 4.1598 7.6323 119.7950 57.7457 42.0352 179.2018 34 R 4.1047 8.2430 118.0676 57.1728 30.2567 178.7761 35 I 4.0312 8.5710 120.5520 61.3822 36.2215 179.4941 36 Q 3.9774 8.4522 129.5212 60.9929 29.0008 178.0343 37 K 3.8295 7.7822 117.7919 59.2532 32.1185 178.3057 38 V 3.8070 7.5173 116.1867 63.7328 31.8783 175.3994 39 A 4.2553 7.4205 121.2099 51.2557 20.6232 176.5370 40 S 3.3275 7.3811 114.8569 57.8627 64.3739 172.1942 41 S 4.9917 8.1177 119.2022 56.3816 63.5940 174.7690 42 G 3.8255 8.9524 115.6061 48.2509 0.0000 172.4144 43 S 4.7646 6.9760 116.2773 57.5067 63.1043 175.3260 44 K 4.6005 8.4439 113.4348 58.9067 32.4426 179.7381 45 L 3.5830 7.4121 120.2361 56.9570 42.0607 177.9290 46 N 4.3604 8.2445 116.6685 56.2272 38.6506 176.4017 47 R 4.0632 8.3637 120.1652 58.7926 30.0590 178.2800 48 I 3.6410 7.6648 118.8442 64.4230 36.8479 177.8052 49 H 4.6717 7.7844 115.8563 58.5047 28.7752 177.1540 50 D 4.3425 7.8215 120.0623 57.2861 41.0976 178.2240 51 I 3.7860 8.5313 120.9137 64.4259 37.0371 178.6717 52 R 3.9376 7.5495 119.2703 59.1617 29.8760 179.2816 53 K 3.9785 7.8413 118.3929 59.4609 32.0775 179.3591 54 S 4.1163 8.5844 115.8071 62.0247 62.8047 177.0741 55 I 3.7479 7.7656 121.7707 64.1684 36.6894 178.4339 56 A 3.9977 7.9395 121.7354 55.1151 18.1493 179.8216 57 R 3.8625 8.1777 116.7442 59.4067 30.1300 179.3024 58 V 3.6183 7.7824 117.8696 66.1632 31.6560 177.8268 59 L 4.0147 7.9750 119.8908 58.3422 41.8865 179.0663 60 T 3.9044 8.1752 116.0903 66.6066 68.3725 176.8440 61 V 3.7563 8.2553 120.4657 66.1870 31.5586 177.9141 62 I 3.8732 8.1960 120.0090 64.5663 37.0522 177.9619 63 N 4.2789 8.0965 117.1647 56.5383 38.6270 176.9158 64 A 4.0409 7.7226 120.9995 55.2013 18.5913 179.5352 65 K 3.9253 8.0920 115.8982 57.6648 32.1287 177.9321 66 Q 4.0067 6.8294 117.6412 55.9677 28.7315 172.8996 67 R 4.2307 7.8635 122.0435 56.1526 32.1424 174.5747 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 4 G 8.20 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 5 K 8.78 3.58 0.00 1.94 1.97 0.00 1.51 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.48 7.81 6 V 8.08 4.18 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 0.90 0.00 0.00 0.92 0.00 0.00 7 K 8.22 4.35 0.00 1.72 1.58 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.19 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.56 1.38 7.81 8 A 8.22 3.76 0.78 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 9 G 7.66 3.36 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 0.00 10 E 8.02 4.01 0.00 1.97 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 0.00 2.37 2.33 0.00 11 L 7.29 4.09 0.00 1.71 1.79 0.89 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 12 W 7.98 4.59 0.00 3.43 3.13 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 13 N 7.96 4.55 0.00 2.89 3.02 0.00 0.00 7.21 6.78 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 14 K 7.03 4.21 0.00 1.90 1.76 0.00 1.78 0.00 0.00 1.90 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.71 1.54 7.81 15 S 8.51 4.52 0.00 4.11 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 16 K 8.53 3.98 0.00 1.87 1.91 0.00 1.55 0.00 0.00 1.86 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.69 7.81 17 D 8.05 4.39 0.00 2.95 2.93 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 0.00 0.00 0.00 18 D 7.82 4.49 0.00 2.93 2.76 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 0.00 0.00 0.00 0.00 19 L 7.97 4.02 0.00 1.89 1.74 0.98 0.76 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 20 T 7.65 3.93 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 1.22 0.00 0.00 21 K 8.09 3.94 0.00 1.97 1.93 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.59 7.81 22 Q 8.40 3.98 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 23 L 8.31 3.91 0.00 1.91 1.82 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.35 4.04 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 E 7.82 3.90 0.00 2.19 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 0.00 2.30 2.49 0.00 26 L 8.01 4.15 0.00 1.88 1.70 0.92 1.00 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 27 K 8.19 3.85 0.00 1.79 1.82 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.65 7.81 28 T 7.64 3.89 4.40 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 29 E 8.20 3.94 0.00 2.16 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 2.33 2.70 0.00 30 L 8.26 4.00 0.00 1.84 1.86 0.93 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 31 G 8.59 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 32 Q 8.12 4.09 0.00 2.04 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 33 L 7.63 4.16 0.00 1.85 1.70 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 34 R 8.24 4.10 0.00 1.98 1.98 0.00 3.29 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.81 0.00 35 I 8.57 4.03 2.01 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 1.76 0.98 0.91 0.00 0.00 36 Q 8.45 3.98 0.00 2.17 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 37 K 7.78 3.83 0.00 2.79 1.75 0.00 1.66 0.00 0.00 1.52 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.55 1.29 7.81 38 V 7.52 3.81 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 0.75 0.00 0.00 0.98 0.00 0.00 39 A 7.42 4.26 1.15 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 40 S 7.38 3.33 0.00 4.08 4.30 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 41 S 8.12 4.99 0.00 3.98 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 42 G 8.95 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 43 S 6.98 4.76 0.00 3.95 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 44 K 8.44 4.60 0.00 1.78 1.68 0.00 1.62 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.50 7.81 45 L 7.41 3.58 0.00 1.70 1.54 0.91 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 46 N 8.24 4.36 0.00 2.77 2.81 0.00 0.00 6.79 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 47 R 8.36 4.06 0.00 1.89 1.86 0.00 3.20 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 48 I 7.66 3.64 1.79 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.54 0.92 0.00 0.00 49 H 7.78 4.67 0.00 3.38 3.30 0.00 5.64 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 D 7.82 4.34 0.00 2.84 2.79 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 0.00 0.00 0.00 51 I 8.53 3.79 1.88 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 1.71 1.08 0.93 0.00 0.00 52 R 7.55 3.94 0.00 2.22 1.98 0.00 3.13 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.89 0.00 53 K 7.84 3.98 0.00 1.85 1.85 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.64 7.81 54 S 8.58 4.12 0.00 3.94 3.93 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 0.00 0.00 0.00 55 I 7.77 3.75 2.04 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.77 0.92 0.00 0.00 56 A 7.94 4.00 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 57 R 8.18 3.86 0.00 2.08 1.99 0.00 3.17 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 58 V 7.78 3.62 2.23 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 1.13 0.00 0.00 1.02 0.00 0.00 59 L 7.97 4.01 0.00 1.84 1.80 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 60 T 8.18 3.90 4.47 0.00 0.00 0.00 0.00 0.00 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 61 V 8.26 3.76 2.39 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 1.38 0.00 0.00 1.44 0.00 0.00 62 I 8.20 3.87 2.03 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 1.43 0.82 0.95 0.00 0.00 63 N 8.10 4.28 0.00 3.00 2.98 0.00 0.00 7.07 7.50 0.00 0.00 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 A 7.72 4.04 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 65 K 8.09 3.93 0.00 1.72 1.81 0.00 1.57 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.24 1.31 7.81 66 Q 6.83 4.01 0.00 2.11 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.35 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 67 R 7.86 4.23 0.00 1.84 2.10 0.00 3.40 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.44 0.00