NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5600 8.2233 120.1898 54.4371 43.4744 176.5211 2 Q 4.3223 7.8512 117.5818 54.3818 27.7834 172.8446 3 E 4.5941 7.5933 111.5810 55.8336 31.3777 176.1684 4 S 4.3093 7.1999 111.1393 58.8698 63.5887 172.6982 5 C 4.7858 8.7846 119.1088 55.8103 42.3077 171.5417 6 K 4.5415 8.5257 119.6784 55.8633 32.2569 176.9007 7 G 3.9892 9.2914 112.8513 46.1331 0.0000 174.1575 8 R 5.3554 7.5283 115.5963 56.1437 29.6853 177.2867 9 C 5.5192 7.9703 112.3024 56.3700 45.2380 173.5860 10 T 4.4326 7.9879 114.8482 64.4674 70.7994 175.2726 11 E 3.9749 8.0444 118.9042 57.9687 30.0351 175.6111 12 G 4.3055 8.1117 103.5594 42.7861 0.0000 172.7265 13 F 3.8753 8.7235 122.1713 57.8914 38.9819 174.5604 14 N 4.5046 8.1687 127.8120 53.0120 37.5163 175.0702 15 V 3.8881 8.2793 124.0283 63.6156 32.2582 175.4129 16 D 4.9769 7.3794 117.9016 54.5953 41.2306 174.3134 17 K 4.7212 7.3627 116.1524 54.2709 36.2782 177.1831 18 K 4.1702 8.4506 118.3604 58.8566 32.3523 178.1715 19 C 5.0304 7.6888 117.5751 54.9728 46.8587 173.0229 20 Q 4.5410 8.4946 122.2497 54.5786 32.2023 174.7680 21 C 4.8356 8.0483 116.9690 55.7799 39.7374 172.8839 22 D 4.9628 8.2571 122.1735 53.0559 43.9265 175.1575 23 E 4.2478 8.8628 117.6689 58.9722 29.8858 177.4872 24 L 4.5024 8.0822 118.4612 54.9406 41.8806 177.6768 25 C 4.6624 8.3141 122.6193 59.7363 43.5969 176.0926 26 S 4.0496 8.0249 112.8830 60.9882 63.2632 174.8789 27 Y 4.0836 8.0086 121.4905 60.6437 38.5558 176.1683 28 Y 3.9130 7.7610 114.7372 57.7885 38.8083 175.2592 29 Q 3.6416 7.8396 117.8267 56.7225 26.5475 176.0518 30 S 4.7548 7.7803 111.8324 57.0837 64.8855 172.4902 31 C 5.7743 7.7798 115.6501 52.0859 39.2274 175.7089 32 C 4.6775 8.3522 118.9044 56.7604 40.7481 174.9591 33 T 3.8217 8.3784 117.5174 66.4537 68.2796 175.3568 34 D 4.8053 8.0238 119.8038 53.5897 39.9913 177.5954 35 Y 4.1594 8.0836 123.0726 61.6555 38.7205 178.0919 36 T 3.5772 7.9208 109.9393 64.2655 68.7733 176.3682 37 A 3.9274 7.7508 122.5977 55.1944 18.4094 178.9643 38 E 4.0532 8.4897 117.1213 59.1917 29.4820 178.6243 39 C 4.0740 8.0441 117.7421 59.1404 42.5830 173.1704 40 K 3.6501 7.0900 120.7729 56.4395 28.5094 174.3975 41 P 4.1687 0.0000 0.0000 63.1385 32.5106 176.6840 42 Q 3.3822 7.1654 118.7929 56.8226 25.4289 174.3319 43 V 3.8974 7.3829 117.3869 61.6476 29.7761 175.5227 44 T 3.7610 7.5199 120.1225 66.3023 68.9306 175.1092 45 R 4.0128 7.8578 126.6723 56.8101 31.5515 178.0136 46 G 3.7708 8.5189 107.7290 46.0555 0.0000 172.9925 47 D 4.3002 8.4032 121.7902 54.0303 41.5640 174.6089 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 1 D 8.22 4.56 0.00 2.77 2.72 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 2 Q 7.85 4.32 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.14 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 3 E 7.59 4.59 0.00 2.01 1.97 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 2.33 2.18 0.00 4 S 7.20 4.31 0.00 4.07 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 C 8.78 4.79 0.00 3.34 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 6 K 8.53 4.54 0.00 1.66 1.49 0.00 1.67 0.00 0.00 1.43 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.41 7.81 7 G 9.29 3.99 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 0.00 0.00 0.00 8 R 7.53 5.36 0.00 1.88 1.99 0.00 2.50 0.00 0.00 3.72 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 9 C 7.97 5.52 0.00 2.97 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 10 T 7.99 4.43 4.25 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 1.22 0.00 0.00 11 E 8.04 3.97 0.00 2.12 2.21 0.00 0.00 0.00 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 2.25 0.00 12 G 8.11 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 0.00 0.00 0.00 0.00 13 F 8.72 3.88 0.00 3.34 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 14 N 8.17 4.50 0.00 2.64 2.54 0.00 0.00 6.80 7.69 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 15 V 8.28 3.89 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 0.31 0.00 0.00 1.08 0.00 0.00 16 D 7.38 4.98 0.00 2.55 2.55 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 0.00 0.00 0.00 0.00 17 K 7.36 4.72 0.00 1.50 1.76 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.45 7.81 18 K 8.45 4.17 0.00 1.70 1.85 0.00 1.60 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.46 7.81 19 C 7.69 5.03 0.00 2.89 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 20 Q 8.49 4.54 0.00 0.96 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.85 0.00 0.00 0.00 0.00 0.00 2.21 2.18 0.00 21 C 8.05 4.84 0.00 3.02 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.26 4.96 0.00 2.89 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 23 E 8.86 4.25 0.00 2.19 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 0.00 2.37 2.39 0.00 24 L 8.08 4.50 0.00 1.97 1.70 0.94 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 25 C 8.31 4.66 0.00 2.64 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 26 S 8.02 4.05 0.00 4.06 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 27 Y 8.01 4.08 0.00 2.70 2.90 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 0.00 0.00 0.00 28 Y 7.76 3.91 0.00 2.86 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 29 Q 7.84 3.64 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.09 0.00 0.00 0.00 0.00 0.00 2.36 2.25 0.00 30 S 7.78 4.75 0.00 4.07 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 31 C 7.78 5.77 0.00 2.77 2.47 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 32 C 8.35 4.68 0.00 3.18 3.09 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 0.00 0.00 0.00 33 T 8.38 3.82 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 1.24 0.00 0.00 34 D 8.02 4.81 0.00 2.91 2.88 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 0.00 0.00 0.00 0.00 35 Y 8.08 4.16 0.00 3.06 3.14 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 36 T 7.92 3.58 4.19 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 1.19 0.00 0.00 37 A 7.75 3.93 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 38 E 8.49 4.05 0.00 2.13 2.13 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 2.32 2.74 0.00 39 C 8.04 4.07 0.00 2.83 2.67 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 0.00 0.00 0.00 40 K 7.09 3.65 0.00 2.07 1.75 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.30 1.43 7.81 41 P 0.00 4.17 0.00 2.23 2.19 0.00 3.68 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.80 0.00 42 Q 7.17 3.38 0.00 2.32 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.32 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 43 V 7.38 3.90 2.10 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 0.85 0.00 0.00 0.98 0.00 0.00 44 T 7.52 3.76 4.25 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 1.21 0.00 0.00 45 R 7.86 4.01 0.00 1.78 1.95 0.00 3.31 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 46 G 8.52 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.40 4.30 0.00 2.57 2.47 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