NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.5627 8.1833 122.8224 58.2238 41.0904 176.1664 2 L 4.6290 7.8735 118.5775 54.5315 41.4274 175.3147 3 E 3.9075 8.7464 120.4260 58.9485 30.7723 177.8594 4 K 4.2451 7.6737 116.7672 58.3518 33.0618 179.1603 5 I 3.6456 7.1471 120.0198 63.9521 36.8464 177.8341 6 E 3.8903 7.5480 119.4097 59.1865 28.9505 177.4422 7 P 4.3487 0.0000 0.0000 65.9559 31.2081 178.4388 8 A 2.9027 7.1066 119.3747 54.6034 17.7066 179.6965 9 Q 3.9101 8.2841 117.1422 58.9843 28.4936 178.4777 10 E 3.9965 7.9830 119.1808 58.7856 30.1501 177.9215 11 E 4.2501 7.8582 119.3044 59.5107 29.7711 178.2641 12 H 4.2414 8.1389 118.2420 59.2596 29.7878 176.8674 13 E 4.1774 7.8649 118.1752 57.9994 29.2971 177.9140 14 K 4.1539 7.4947 117.6470 56.7452 33.2894 176.5932 15 Y 4.7338 7.4145 112.8532 57.8549 40.3083 174.1834 16 H 3.5423 8.4869 115.7837 56.2103 27.0609 175.5717 17 S 4.1896 7.8995 113.8072 58.8811 63.4655 175.3198 18 N 4.7560 8.5485 121.8951 52.2550 40.6502 176.5115 19 V 3.5969 8.2998 119.9610 66.5288 31.5020 177.5873 20 K 3.9369 8.1619 118.6067 59.5077 31.9034 178.1546 21 E 3.9304 8.0257 118.9987 59.3000 29.7071 178.6083 22 L 4.2673 8.2167 119.2678 57.9658 41.8310 179.5633 23 S 4.6655 8.7639 114.7834 61.3180 62.1716 175.6314 24 H 4.4196 8.5900 120.1955 58.5403 29.6342 176.9531 25 K 3.9293 8.3719 121.3867 58.9690 32.2172 178.1523 26 F 4.4192 9.1391 116.2544 60.8397 39.6953 175.9245 27 G 3.4869 7.7707 107.5632 44.9856 0.0000 174.2066 28 I 3.7133 7.7911 115.7203 59.9742 38.2336 173.9157 29 P 4.7252 0.0000 0.0000 62.9218 31.7452 176.8394 30 N 4.4357 8.6103 115.1435 55.6911 38.2092 177.5281 31 L 3.9530 7.7721 121.8103 58.1498 42.2842 178.7500 32 V 3.6325 7.8023 115.8989 65.8081 31.6423 177.3767 33 A 4.1455 7.9944 120.7711 54.9428 18.2694 179.7588 34 R 3.9505 7.9665 114.3521 59.5068 29.4586 179.0829 35 Q 3.8078 8.1015 118.8737 58.7702 28.3882 178.8844 36 I 3.6700 7.4054 120.2268 64.3957 37.3667 178.3488 37 V 3.5354 7.6513 118.6469 65.8896 31.2358 177.4028 38 N 4.3274 8.6694 116.6627 56.6929 38.8015 176.7567 39 S 4.3460 7.6855 115.7858 60.0257 63.2051 174.5078 40 C 4.1200 7.3956 123.0626 59.2258 31.9578 173.9562 41 A 3.9568 8.8102 130.4863 55.3897 18.3199 179.0891 42 Q 4.0359 8.1651 115.1179 58.9299 29.2346 176.9296 43 C 4.4505 7.9305 113.7440 61.2904 29.2995 174.8548 44 Q 4.1447 8.2616 118.6668 58.9580 28.3964 177.3970 45 Q 4.1849 7.6685 115.5923 55.5680 29.3996 176.4504 46 K 4.1881 8.5517 120.6640 56.5731 32.3445 176.3165 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 F 8.18 4.56 0.00 3.12 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.87 4.63 0.00 1.88 1.68 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 3 E 8.75 3.91 0.00 1.95 1.98 0.00 0.00 0.00 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 2.34 0.00 4 K 7.67 4.25 0.00 1.67 1.86 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.44 7.81 5 I 7.15 3.65 1.68 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.47 0.70 0.00 0.00 6 E 7.55 3.89 0.00 2.01 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 2.31 2.45 0.00 7 P 0.00 4.35 0.00 2.12 2.25 0.00 3.44 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 2.18 2.20 0.00 8 A 7.11 2.90 0.56 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 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 8.28 3.91 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 10 E 7.98 4.00 0.00 1.96 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 0.00 2.31 2.36 0.00 11 E 7.86 4.25 0.00 2.51 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 2.63 2.59 0.00 12 H 8.14 4.24 0.00 3.30 3.29 0.00 5.84 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 E 7.86 4.18 0.00 2.11 1.95 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 2.34 2.49 0.00 14 K 7.49 4.15 0.00 1.74 1.20 0.00 1.77 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.69 1.19 7.81 15 Y 7.41 4.73 0.00 2.95 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 16 H 8.49 3.54 0.00 3.16 3.27 0.00 5.67 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 7.90 4.19 0.00 3.94 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 18 N 8.55 4.76 0.00 2.77 2.80 0.00 0.00 6.78 7.70 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 19 V 8.30 3.60 2.11 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 1.19 0.00 0.00 0.96 0.00 0.00 20 K 8.16 3.94 0.00 1.92 1.83 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.52 1.61 7.81 21 E 8.03 3.93 0.00 2.15 2.25 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 2.40 2.50 0.00 22 L 8.22 4.27 0.00 1.91 1.77 1.13 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.76 4.67 0.00 3.90 3.98 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.59 4.42 0.00 3.24 3.32 0.00 5.82 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 25 K 8.37 3.93 0.00 1.96 1.79 0.00 1.75 0.00 0.00 1.40 0.00 0.00 3.04 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.92 1.24 7.81 26 F 9.14 4.42 0.00 3.19 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 27 G 7.77 3.49 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 0.00 0.00 0.00 28 I 7.79 3.71 1.81 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.59 0.78 0.00 0.00 29 P 0.00 4.73 0.00 2.25 2.27 0.00 3.66 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 2.08 2.02 0.00 30 N 8.61 4.44 0.00 2.84 2.93 0.00 0.00 6.46 6.74 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 31 L 7.77 3.95 0.00 1.77 1.67 0.94 0.93 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 32 V 7.80 3.63 2.03 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 0.83 0.00 0.00 0.94 0.00 0.00 33 A 7.99 4.15 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 34 R 7.97 3.95 0.00 2.15 2.42 0.00 2.84 0.00 0.00 3.18 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.90 0.00 35 Q 8.10 3.81 0.00 2.37 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.90 0.00 0.00 0.00 0.00 0.00 2.40 2.63 0.00 36 I 7.41 3.67 1.98 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.61 0.86 0.00 0.00 37 V 7.65 3.54 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 1.18 0.00 0.00 1.06 0.00 0.00 38 N 8.67 4.33 0.00 2.87 2.96 0.00 0.00 7.30 6.81 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 39 S 7.69 4.35 0.00 4.07 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 40 C 7.40 4.12 0.00 2.76 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 41 A 8.81 3.96 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 42 Q 8.17 4.04 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.92 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 43 C 7.93 4.45 0.00 3.05 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 44 Q 8.26 4.14 0.00 2.27 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 45 Q 7.67 4.18 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 46 K 8.55 4.19 0.00 1.72 1.71 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.47 7.81