NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 E 4.3629 8.4449 116.7540 55.6671 31.4862 174.5845 11 I 4.3411 8.0289 120.6746 57.8479 39.2829 174.5848 12 S 4.4640 8.8035 121.6800 56.8635 65.2261 173.3370 13 A 4.1790 8.1876 123.7316 51.2764 18.6808 175.8431 14 P 4.4934 0.0000 0.0000 62.6878 32.1145 175.5503 15 S 4.6898 7.8369 113.4674 57.0481 66.4244 172.5270 16 N 4.1784 8.8385 114.2791 53.8558 35.7028 175.0996 17 F 4.2128 8.4771 121.0456 59.1661 40.2548 174.3856 18 E 4.1223 7.5918 122.2660 54.0927 33.2530 172.4166 19 H 4.4958 8.3336 125.6359 54.7131 29.4341 175.0636 20 R 4.1700 8.3575 125.8739 57.5513 29.9940 174.9051 21 V 4.3301 7.4850 116.0840 61.0244 34.3048 174.1238 22 H 4.7603 8.5846 125.2611 54.8133 31.1902 172.1033 23 T 4.7743 8.3116 123.4125 62.6448 70.3349 174.7070 24 G 4.3942 9.3333 111.2960 45.0620 0.0000 170.5079 25 F 5.2867 8.7473 120.4241 56.6108 42.8604 173.9912 26 D 4.6304 8.1149 126.1984 52.5692 41.8582 177.0145 27 Q 4.0413 8.7700 126.2531 59.2281 29.2891 177.7958 28 H 4.2192 8.4781 114.2038 58.8902 28.6972 176.2830 29 E 4.1875 8.5812 115.8400 55.9010 30.0277 176.0965 30 Q 3.2941 7.6143 116.8686 56.7698 26.8413 173.5648 31 K 4.5521 6.4327 114.5542 54.2378 36.8390 177.2127 32 F 5.0955 8.8811 122.1073 57.9701 39.9545 174.7242 33 T 4.5577 8.7174 111.4163 60.3180 72.0486 174.0961 34 G 4.0041 8.8616 111.1305 46.7096 0.0000 173.9417 35 L 4.1383 7.9217 118.3401 53.1605 42.7327 175.7040 36 P 3.9818 0.0000 0.0000 63.3784 32.0374 178.2895 37 R 3.9069 8.7115 122.5991 60.0862 29.5368 178.5547 38 Q 4.1932 8.0478 116.4460 57.6796 28.4214 180.3545 39 W 4.6985 8.1422 116.8717 58.3743 29.0262 178.5911 40 Q 4.2202 7.7378 117.7080 59.1588 28.1869 178.5672 41 S 4.3160 8.0895 114.9162 61.1989 63.0305 175.8714 42 L 4.3518 7.1830 121.1103 55.4301 41.9852 176.6129 43 I 4.7317 7.9620 119.2441 59.8478 41.4307 175.1531 44 E 4.4568 8.7644 119.0025 56.1332 30.6324 176.8275 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 10 E 8.44 4.36 0.00 2.01 1.81 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 2.13 1.91 0.00 11 I 8.03 4.34 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 1.18 0.92 0.00 0.00 12 S 8.80 4.46 0.00 3.98 3.88 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 13 A 8.19 4.18 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 14 P 0.00 4.49 0.00 2.24 2.09 0.00 3.72 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 15 S 7.84 4.69 0.00 3.96 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 16 N 8.84 4.18 0.00 2.88 2.92 0.00 0.00 6.79 7.45 0.00 0.00 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 F 8.48 4.21 0.00 2.96 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 18 E 7.59 4.12 0.00 1.96 1.63 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 2.11 1.83 0.00 19 H 8.33 4.50 0.00 3.03 3.19 0.00 5.71 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.36 4.17 0.00 1.87 1.82 0.00 3.26 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.18 0.00 21 V 7.48 4.33 1.99 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 0.79 0.00 0.00 0.76 0.00 0.00 22 H 8.58 4.76 0.00 2.96 3.13 0.00 5.96 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.31 4.77 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 1.43 0.00 0.00 24 G 9.33 4.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 F 8.75 5.29 0.00 2.93 2.87 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 26 D 8.11 4.63 0.00 2.64 2.34 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.77 4.04 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.81 0.00 0.00 0.00 0.00 0.00 2.48 2.38 0.00 28 H 8.48 4.22 0.00 3.20 3.33 0.00 5.88 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.58 4.19 0.00 1.82 1.91 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 2.38 2.32 0.00 30 Q 7.61 3.29 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.63 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 31 K 6.43 4.55 0.00 1.45 1.55 0.00 1.62 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.56 7.81 32 F 8.88 5.10 0.00 3.10 3.10 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 33 T 8.72 4.56 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 1.18 0.00 0.00 34 G 8.86 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 0.00 0.00 0.00 35 L 7.92 4.14 0.00 1.69 1.65 1.09 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 3.98 0.00 0.92 1.35 0.00 2.83 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.41 0.00 37 R 8.71 3.91 0.00 1.73 1.95 0.00 3.26 0.00 0.00 3.37 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.21 0.00 38 Q 8.05 4.19 0.00 1.97 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.87 0.00 0.00 0.00 0.00 0.00 2.37 1.96 0.00 39 W 8.14 4.70 0.00 3.34 3.08 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 0.00 0.00 0.00 40 Q 7.74 4.22 0.00 2.27 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.00 0.00 0.00 0.00 0.00 0.00 2.45 2.58 0.00 41 S 8.09 4.32 0.00 3.89 3.96 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 42 L 7.18 4.35 0.00 1.78 1.68 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 43 I 7.96 4.73 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.92 0.94 0.00 0.00 44 E 8.76 4.46 0.00 1.97 1.63 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 2.11 1.83 0.00