NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2587 8.4293 121.4717 55.9747 30.7418 174.4786 2 C 4.6426 8.5951 120.3017 54.8956 40.3746 170.8527 3 L 4.7302 9.4092 120.9810 53.2943 43.6177 178.6222 4 E 4.5847 8.5933 123.9030 55.5414 31.2065 176.3945 5 I 4.0079 8.2931 119.7197 62.5038 38.5154 175.1934 6 F 2.6502 9.0116 121.3174 58.3622 36.9770 175.4475 7 K 4.6584 8.0103 118.6023 54.1168 34.5890 175.6938 8 A 4.7447 9.2362 127.0429 52.2497 18.5857 175.3221 9 C 5.1669 8.8933 116.0526 54.0491 43.6413 173.2985 10 N 5.1043 8.4902 116.6982 50.8332 40.4961 174.6198 11 P 4.5328 0.0000 0.0000 65.5505 31.8345 177.6393 12 S 4.3270 8.0458 112.3820 59.7106 62.7969 173.7079 13 N 4.7538 7.2015 118.1780 51.5666 37.2063 171.9392 14 D 4.6863 8.0698 119.4246 53.7518 41.7284 176.9155 15 Q 4.6078 8.2667 126.1868 55.4368 30.0029 175.8504 16 C 4.8799 8.1268 116.5633 55.8962 42.3809 172.8184 17 C 4.6010 8.6110 123.9941 55.9902 41.9686 174.6690 18 K 3.9586 8.6803 127.2130 59.1222 32.2161 179.3141 19 S 4.1328 8.1105 112.4233 60.9150 62.4466 174.4943 20 S 4.5868 8.0736 114.1458 57.4473 63.2312 173.9690 21 K 3.8848 7.8603 118.8085 58.0447 29.8017 174.6055 22 L 5.3205 7.8555 116.4037 53.1867 44.9694 178.0845 23 V 4.5464 8.6364 114.6754 59.4404 36.3183 173.9516 24 C 4.6681 9.0278 125.2471 57.0202 38.5632 172.3729 25 S 4.7040 8.8331 121.4260 56.3331 63.8175 174.9435 26 R 3.8508 8.7697 127.7321 58.9379 30.4272 177.3869 27 K 3.8902 8.0868 118.5818 59.3687 31.8142 177.3384 28 T 3.4448 7.4189 106.0859 60.7184 69.5644 175.5364 29 R 4.1123 7.7516 120.3450 56.2891 28.3542 175.0280 30 W 5.1292 6.5766 114.7996 55.8281 32.0899 172.5454 31 C 5.0889 9.3094 118.0793 57.3147 41.7634 173.3475 32 K 5.4205 9.4060 125.0024 54.2031 35.5314 174.8666 33 Y 4.7654 8.9545 124.0661 57.4673 38.6315 175.4460 34 Q 4.0938 8.5182 124.0563 55.6407 29.8971 175.6639 35 I 4.1047 8.2399 125.4629 61.3699 38.1271 175.1399 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 E 8.43 4.26 0.00 1.95 1.92 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 2.20 2.31 0.00 2 C 8.60 4.64 0.00 3.19 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 3 L 9.41 4.73 0.00 1.73 1.67 0.96 1.38 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 4 E 8.59 4.58 0.00 1.85 1.92 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 2.31 2.31 0.00 5 I 8.29 4.01 1.86 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.50 0.72 0.00 0.00 6 F 9.01 2.65 0.00 2.77 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 7 K 8.01 4.66 0.00 1.91 1.76 0.00 1.72 0.00 0.00 1.85 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.50 7.81 8 A 9.24 4.74 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.89 5.17 0.00 2.98 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.49 5.10 0.00 2.77 2.75 0.00 0.00 6.62 8.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.53 0.00 2.16 2.16 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 12 S 8.05 4.33 0.00 3.85 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 13 N 7.20 4.75 0.00 2.81 2.75 0.00 0.00 7.08 7.95 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 14 D 8.07 4.69 0.00 2.65 2.63 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 0.00 0.00 0.00 15 Q 8.27 4.61 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 7.04 0.00 0.00 0.00 0.00 0.00 2.35 2.27 0.00 16 C 8.13 4.88 0.00 2.97 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 17 C 8.61 4.60 0.00 3.21 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 18 K 8.68 3.96 0.00 1.87 1.84 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.44 7.81 19 S 8.11 4.13 0.00 3.83 3.90 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 20 S 8.07 4.59 0.00 3.91 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 21 K 7.86 3.88 0.00 1.98 1.90 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.56 7.81 22 L 7.86 5.32 0.00 1.75 1.61 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.64 4.55 2.09 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 0.78 0.00 0.00 0.96 0.00 0.00 24 C 9.03 4.67 0.00 3.02 3.24 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 0.00 25 S 8.83 4.70 0.00 3.88 3.56 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 26 R 8.77 3.85 0.00 1.75 1.87 0.00 3.27 0.00 0.00 3.11 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 27 K 8.09 3.89 0.00 1.65 1.68 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.30 7.81 28 T 7.42 3.44 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 1.09 0.00 0.00 29 R 7.75 4.11 0.00 1.62 1.85 0.00 3.06 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.38 0.00 30 W 6.58 5.13 0.00 3.24 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 9.31 5.09 0.00 3.14 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 32 K 9.41 5.42 0.00 1.92 1.57 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.75 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.88 1.53 7.81 33 Y 8.95 4.77 0.00 3.07 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 34 Q 8.52 4.09 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.05 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 35 I 8.24 4.10 1.88 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.07 0.91 0.00 0.00