NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.1014 8.3549 109.7625 45.0411 0.0000 173.6432 2 E 4.9180 7.7322 120.4834 53.3289 32.8892 173.3199 3 W 5.7501 8.6339 121.0902 55.4880 34.0550 173.7033 4 E 4.8175 9.1486 118.4821 55.6694 33.0522 174.0839 5 I 5.4323 8.6631 121.7895 59.3067 38.2520 175.2608 6 I 4.5165 8.2173 120.6942 58.7443 39.8432 175.2344 7 D 4.5500 8.6858 122.4376 54.8882 41.7851 175.7860 8 I 4.3675 8.1261 122.4769 61.3317 37.6359 175.5396 9 G 4.1870 7.6503 110.4732 43.4813 0.0000 172.6350 10 P 4.1843 0.0000 0.0000 65.9220 31.0273 178.2346 11 F 4.2661 8.3346 118.0195 60.7010 39.2521 176.5920 12 T 3.7793 8.8996 116.0350 65.2659 68.6731 176.0097 13 Q 4.4912 7.6076 118.2618 56.7862 29.0247 177.3696 14 N 4.2705 7.6873 118.0903 55.8036 39.0553 177.1143 15 L 3.9322 7.2269 120.1100 57.2716 41.6825 179.8199 16 G 3.6423 7.4154 104.5199 47.4658 0.0000 175.9133 17 K 3.0996 7.1241 122.2089 58.5278 32.0937 178.6579 18 F 3.9859 8.4108 121.1480 61.8110 39.2332 176.1683 19 A 3.7045 8.0157 118.9283 55.6802 17.7792 179.2852 20 V 3.5176 7.7821 115.8655 66.3077 31.9225 178.1945 21 D 4.4437 7.9196 118.1147 57.5322 40.4515 178.7495 22 E 3.8674 7.7695 117.6687 58.3743 29.6816 177.9055 23 E 4.3838 7.6396 117.5882 56.5226 29.7171 176.8369 24 N 4.5309 7.6652 115.0766 55.6667 38.9616 176.2414 25 K 4.2201 7.8973 118.9732 57.1294 33.0501 176.3900 26 I 4.1803 7.4922 117.2331 60.6561 40.4463 175.6160 27 G 4.2060 8.0669 109.1824 46.2420 0.0000 175.5726 28 Q 3.8434 7.6505 119.9499 57.8277 28.9752 177.5009 29 Y 4.5504 7.5234 115.1584 57.2699 39.5265 176.5943 30 G 4.0569 8.3929 108.1783 45.7468 0.0000 176.1480 31 R 4.7612 8.2231 117.7811 54.1381 30.1149 174.9709 32 L 4.4863 8.3836 121.9340 53.7851 43.0490 176.6196 33 T 4.6796 7.9719 110.2894 59.3658 71.1794 173.7478 34 F 4.2052 8.8481 126.7487 58.6212 39.6632 173.6452 35 N 4.3578 7.1842 125.5293 52.2130 39.6230 175.7234 36 K 3.8649 5.7654 114.9067 56.9010 34.6353 173.5133 37 V 4.3542 8.8273 118.9485 60.9686 33.4104 174.7140 38 I 4.4211 8.0418 119.0564 59.3436 39.9759 174.0237 39 R 4.6427 8.1251 118.9799 53.6842 32.6361 173.7769 40 P 4.6386 0.0000 0.0000 62.3374 32.8434 174.7204 41 C 4.6887 8.4203 120.3237 58.5756 33.2510 172.1927 42 M 5.4412 8.6703 124.2312 53.5923 35.6263 175.0166 43 K 4.5175 9.2740 121.5551 54.9979 35.7213 174.7265 44 K 4.2252 8.5577 128.7652 55.2126 33.5956 175.3642 45 T 4.3010 8.1259 123.5780 61.8864 70.3665 173.7972 46 I 4.5630 7.9291 127.1603 60.1000 39.1728 174.7084 47 Y 4.7786 7.8134 119.3268 56.8372 41.8074 174.4523 48 E 4.6749 8.2020 117.7574 55.8740 31.3214 175.1451 49 N 4.5013 8.5489 127.5868 53.9901 39.9089 174.4512 50 E 4.2844 7.8538 121.5948 56.3192 29.8821 175.8848 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 G 8.35 4.10 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 0.00 0.00 0.00 2 E 7.73 4.92 0.00 1.92 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 2.42 2.73 0.00 3 W 8.63 5.75 0.00 3.08 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 4 E 9.15 4.82 0.00 2.07 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 0.00 2.24 2.32 0.00 5 I 8.66 5.43 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.46 1.00 0.00 0.00 6 I 8.22 4.52 1.95 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.70 0.99 0.00 0.00 7 D 8.69 4.55 0.00 2.69 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.13 4.37 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.01 0.94 0.00 0.00 9 G 7.65 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 0.00 0.00 0.00 0.00 10 P 0.00 4.18 0.00 2.23 2.18 0.00 3.65 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 11 F 8.33 4.27 0.00 3.12 3.02 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 12 T 8.90 3.78 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 1.23 0.00 0.00 13 Q 7.61 4.49 0.00 2.09 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.79 0.00 0.00 0.00 0.00 0.00 2.57 2.61 0.00 14 N 7.69 4.27 0.00 2.66 2.71 0.00 0.00 7.13 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 15 L 7.23 3.93 0.00 1.75 1.57 0.48 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.42 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.12 3.10 0.00 1.13 1.42 0.00 1.42 0.00 0.00 1.47 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.29 1.48 7.81 18 F 8.41 3.99 0.00 2.97 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.02 3.70 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.78 3.52 2.26 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 0.92 0.00 0.00 1.10 0.00 0.00 21 D 7.92 4.44 0.00 2.76 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 22 E 7.77 3.87 0.00 1.71 1.72 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 1.69 1.47 0.00 23 E 7.64 4.38 0.00 2.00 2.12 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 2.27 2.46 0.00 24 N 7.67 4.53 0.00 2.88 2.85 0.00 0.00 6.83 8.83 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 25 K 7.90 4.22 0.00 1.82 1.95 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.45 7.81 26 I 7.49 4.18 1.87 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 1.35 1.32 1.04 0.00 0.00 27 G 8.07 4.21 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 0.00 0.00 0.00 28 Q 7.65 3.84 0.00 1.92 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.94 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 29 Y 7.52 4.55 0.00 2.99 2.98 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 30 G 8.39 4.06 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 0.00 0.00 0.00 31 R 8.22 4.76 0.00 1.78 1.87 0.00 3.21 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 32 L 8.38 4.49 0.00 1.62 1.61 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.97 4.68 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 1.23 0.00 0.00 34 F 8.85 4.21 0.00 2.98 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 35 N 7.18 4.36 0.00 2.49 2.54 0.00 0.00 6.95 7.61 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 36 K 5.77 3.86 0.00 1.75 1.63 0.00 1.47 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.98 1.13 7.81 37 V 8.83 4.35 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 0.88 0.00 0.00 1.16 0.00 0.00 38 I 8.04 4.42 1.86 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 1.40 0.66 0.89 0.00 0.00 39 R 8.13 4.64 0.00 1.81 1.91 0.00 3.21 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 40 P 0.00 4.64 0.00 2.20 2.06 0.00 3.76 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 41 C 8.42 4.69 0.00 3.07 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 42 M 8.67 5.44 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 43 K 9.27 4.52 0.00 1.79 1.63 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.74 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.26 1.36 7.81 44 K 8.56 4.23 0.00 0.83 1.26 0.00 0.61 0.00 0.00 1.18 0.00 0.00 2.63 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.89 0.41 7.81 45 T 8.13 4.30 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 0.42 0.00 0.00 46 I 7.93 4.56 1.76 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.36 0.90 0.00 0.00 47 Y 7.81 4.78 0.00 2.74 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.20 4.67 0.00 1.91 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 2.07 2.15 0.00 49 N 8.55 4.50 0.00 2.71 2.71 0.00 0.00 7.11 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 50 E 7.85 4.28 0.00 2.09 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00