NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8482 8.3501 109.7348 45.3046 0.0000 173.9009 3 A 4.2276 7.7120 119.7955 50.5877 20.2698 176.5200 4 Q 4.3760 9.3002 123.8135 54.4972 31.3784 172.6786 5 V 4.6563 8.2566 126.4335 61.3386 33.4412 174.6454 6 S 4.8256 8.4262 122.9882 56.7116 67.5863 172.9679 7 S 5.3192 8.4508 115.2275 56.7585 64.6380 173.6944 8 Q 4.4343 9.1057 121.1325 54.8596 30.1575 176.1979 9 K 4.1208 8.4577 124.0721 55.0092 31.4254 176.1772 10 V 3.7076 8.1153 126.9665 62.1416 31.9435 174.7428 11 G 3.4741 8.4401 118.5459 47.3560 0.0000 173.4184 12 A 4.2285 8.3810 121.0772 51.6613 19.9319 177.2105 13 H 5.1297 8.6759 120.0253 53.7762 30.8376 174.6208 14 E 4.1845 9.2026 124.3755 55.7727 30.7147 175.8846 15 N 4.6621 8.4106 121.2686 52.8117 37.7050 174.9295 16 S 4.6887 7.5476 112.4770 57.4426 66.1757 173.9426 17 N 5.1862 8.4529 126.9050 52.1093 38.7556 175.0024 18 R 4.5082 7.4052 112.2484 55.4911 30.6209 174.8554 19 A 4.6182 7.3179 127.6382 52.0695 22.4821 178.3722 20 Y 4.4395 8.5975 113.7107 57.6537 37.4828 179.2687 21 G 3.7841 6.7583 103.3412 47.8801 0.0000 174.6328 22 G 3.7807 7.3105 108.5217 46.1745 0.0000 173.3262 23 S 3.9671 7.9437 120.5053 59.6139 61.8723 173.9393 24 T 3.2206 7.1049 115.0745 61.8578 65.8616 171.4693 25 I 4.2915 7.8936 133.3713 60.2813 38.4410 175.3523 26 N 5.5091 8.7184 124.4356 52.2215 41.4290 173.1522 27 Y 4.9570 9.0541 117.6113 55.9325 42.1402 174.0095 28 T 4.9720 8.6255 115.9270 62.0876 71.6815 173.7674 29 T 4.6948 8.9929 121.9731 61.7559 72.3943 172.9661 30 I 4.7110 8.0389 125.5868 59.3723 40.3015 174.9197 31 N 4.2269 8.6522 124.8575 53.1639 39.0942 174.7200 32 Y 4.5764 8.0639 119.2646 58.2256 38.9064 175.0494 33 Y 4.8994 7.5241 116.7208 55.7311 41.2459 175.7440 34 R 4.0521 8.7715 122.8689 59.2048 30.7989 176.8682 35 D 4.6536 8.1006 118.8927 53.4920 41.6466 177.4389 36 S 4.1927 8.7538 118.6975 60.7373 63.4513 176.1854 37 A 4.0500 7.9941 123.2600 55.0273 18.1996 178.6891 38 S 4.1383 7.8512 111.1283 60.8140 63.1043 174.8725 39 N 4.4213 7.7795 117.5044 52.7825 38.7139 174.6654 40 A 4.1937 8.3011 123.9179 51.7527 19.2929 176.9491 41 A 4.3221 8.2077 122.8127 51.8382 19.1816 178.4079 42 S 4.2330 8.6642 116.8411 58.9945 63.6678 175.3961 43 K 4.2405 7.9658 116.5607 56.5169 29.7024 176.5676 44 Q 4.1918 7.6843 119.8705 54.5700 27.0574 174.7834 45 D 4.6864 7.5624 120.9852 52.2578 43.8696 175.7522 46 F 4.9215 8.2013 119.0762 56.3941 40.7723 175.6929 47 S 4.8925 8.5589 118.8532 57.1626 65.1621 173.0817 48 Q 4.6160 8.0330 118.0994 54.3509 31.3663 174.0157 49 D 4.4520 8.4706 118.6711 53.8455 41.8091 174.8732 50 P 4.6608 0.0000 0.0000 63.7668 31.7176 178.0764 51 S 4.2465 8.6034 117.9936 61.0197 62.5022 176.4359 52 K 3.8448 7.7475 119.5570 58.7502 32.3484 177.9790 53 F 4.8527 7.8771 118.5402 59.1173 40.1779 177.3815 54 T 4.3169 7.8842 108.3905 63.0718 70.2368 174.4081 55 E 4.8878 8.2823 120.9379 54.5821 30.1372 173.5909 56 P 4.8078 0.0000 0.0000 63.0337 32.4207 176.8972 57 I 4.2405 7.4427 112.0581 60.5338 39.0546 175.7660 58 K 3.9694 8.6912 123.7656 59.3136 32.2718 176.8035 59 D 4.6864 7.9636 118.6788 53.2231 41.4587 175.9807 60 V 3.2294 7.8414 122.7313 61.7962 32.3508 174.7017 61 L 4.2064 8.4391 129.4856 54.1770 42.5768 175.7496 62 I 4.2994 8.1064 127.8264 59.2068 37.3020 176.3813 63 K 3.9290 8.6491 126.3936 59.8383 32.4286 178.4747 64 T 3.9667 7.8751 107.6720 62.9944 69.1716 174.2651 65 A 4.5161 7.7736 125.6600 49.6705 20.2613 175.0520 66 P 4.3227 0.0000 0.0000 63.0114 31.6811 176.5414 67 M 4.0693 8.8146 122.2218 57.5073 32.4498 175.8644 68 L 4.6695 7.6985 118.3487 52.8792 43.3899 175.6994 69 N 4.4738 8.5065 121.3721 53.9538 38.9068 173.7304 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 3.85 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 0.00 0.00 0.00 3 A 7.71 4.23 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.30 4.38 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.72 0.00 0.00 0.00 0.00 0.00 2.17 2.14 0.00 5 V 8.26 4.66 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 0.79 0.00 0.00 0.87 0.00 0.00 6 S 8.43 4.83 0.00 3.23 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.45 5.32 0.00 3.89 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 8 Q 9.11 4.43 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.03 0.00 0.00 0.00 0.00 0.00 2.26 2.56 0.00 9 K 8.46 4.12 0.00 1.70 1.73 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.41 7.81 10 V 8.12 3.71 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 0.51 0.00 0.00 0.73 0.00 0.00 11 G 8.44 3.47 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 0.00 0.00 0.00 0.00 12 A 8.38 4.23 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 13 H 8.68 5.13 0.00 3.18 3.35 0.00 5.71 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 9.20 4.18 0.00 1.68 1.83 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 2.36 2.31 0.00 15 N 8.41 4.66 0.00 2.77 2.83 0.00 0.00 6.67 7.57 0.00 0.00 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 S 7.55 4.69 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 17 N 8.45 5.19 0.00 2.66 2.71 0.00 0.00 6.82 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 18 R 7.41 4.51 0.00 1.77 1.83 0.00 3.57 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 19 A 7.32 4.62 1.31 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 0.00 0.00 0.00 20 Y 8.60 4.44 0.00 3.02 2.22 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.76 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 0.00 0.00 0.00 22 G 7.31 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 0.00 0.00 0.00 23 S 7.94 3.97 0.00 3.94 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 24 T 7.10 3.22 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 1.20 0.00 0.00 25 I 7.89 4.29 1.86 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.33 0.85 0.00 0.00 26 N 8.72 5.51 0.00 2.64 2.77 0.00 0.00 6.60 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 9.05 4.96 0.00 2.91 2.94 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 28 T 8.63 4.97 4.26 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 1.18 0.00 0.00 29 T 8.99 4.69 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 1.16 0.00 0.00 30 I 8.04 4.71 1.79 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.57 0.88 0.00 0.00 31 N 8.65 4.23 0.00 2.64 2.71 0.00 0.00 7.08 7.46 0.00 0.00 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 Y 8.06 4.58 0.00 2.47 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.52 4.90 0.00 2.94 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 34 R 8.77 4.05 0.00 1.82 2.03 0.00 3.26 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 35 D 8.10 4.65 0.00 2.75 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 36 S 8.75 4.19 0.00 4.01 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 37 A 7.99 4.05 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 38 S 7.85 4.14 0.00 4.01 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 39 N 7.78 4.42 0.00 2.80 2.76 0.00 0.00 6.94 6.63 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 40 A 8.30 4.19 1.27 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 41 A 8.21 4.32 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 42 S 8.66 4.23 0.00 4.02 4.02 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 43 K 7.97 4.24 0.00 1.91 1.93 0.00 1.78 0.00 0.00 1.21 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.32 1.31 7.81 44 Q 7.68 4.19 0.00 1.99 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 45 D 7.56 4.69 0.00 2.59 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 8.20 4.92 0.00 3.18 3.01 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 47 S 8.56 4.89 0.00 3.92 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 48 Q 8.03 4.62 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.93 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 49 D 8.47 4.45 0.00 2.64 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 4.66 0.00 2.41 2.39 0.00 3.80 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 51 S 8.60 4.25 0.00 3.85 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 52 K 7.75 3.84 0.00 1.50 1.63 0.00 0.74 0.00 0.00 1.16 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.62 0.21 7.81 53 F 7.88 4.85 0.00 3.04 3.06 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 0.00 0.00 0.00 54 T 7.88 4.32 4.28 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 1.29 0.00 0.00 55 E 8.28 4.89 0.00 1.97 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 2.23 0.00 56 P 0.00 4.81 0.00 2.17 2.24 0.00 3.77 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 57 I 7.44 4.24 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 1.18 0.62 0.91 0.00 0.00 58 K 8.69 3.97 0.00 1.73 1.87 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.45 7.81 59 D 7.96 4.69 0.00 2.70 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 60 V 7.84 3.23 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 0.74 0.00 0.00 0.92 0.00 0.00 61 L 8.44 4.21 0.00 1.62 1.56 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 62 I 8.11 4.30 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 1.47 0.54 0.91 0.00 0.00 63 K 8.65 3.93 0.00 1.86 1.96 0.00 1.57 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.44 7.81 64 T 7.88 3.97 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 1.21 0.00 0.00 65 A 7.77 4.52 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 66 P 0.00 4.32 0.00 2.35 2.08 0.00 3.78 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 67 M 8.81 4.07 0.00 1.98 2.14 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.63 0.00 68 L 7.70 4.67 0.00 1.65 1.57 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 69 N 8.51 4.47 0.00 2.62 2.60 0.00 0.00 7.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00