NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9268 8.1976 109.7326 45.2143 0.0000 174.1815 2 I 3.3828 7.6813 111.9917 62.7554 37.0977 172.7119 3 V 3.5183 7.8817 119.0114 64.9568 31.9676 177.9354 4 E 4.2470 7.8757 118.3423 58.6746 29.9447 177.5742 5 Q 3.9857 8.0102 118.2104 59.1845 29.1519 176.4398 6 C 4.4276 8.3935 116.8538 58.7327 40.7921 174.0504 7 C 4.3595 7.8395 118.1959 61.6742 32.0693 174.7672 8 T 4.0127 8.0295 115.5172 65.9503 68.4648 174.4984 9 S 4.8462 7.6280 114.7236 56.7943 64.6941 172.2456 10 I 4.5527 8.1262 119.1812 59.8925 39.0703 173.5809 11 C 5.2648 8.3871 117.0829 53.1268 45.2157 173.7665 12 S 4.8774 8.8299 115.5699 56.8633 66.0005 175.2638 13 L 4.0652 8.3531 122.2599 58.1504 41.1399 179.1587 14 Y 4.1487 8.0691 118.3504 60.6796 38.9918 177.6617 15 Q 4.1080 8.2607 119.2656 58.8009 28.8846 178.3766 16 L 4.1982 8.1277 120.0814 57.8210 41.5273 179.1369 17 E 3.9483 8.2465 119.1524 58.9910 29.2256 178.3308 18 N 4.1893 7.6951 116.0063 55.8106 38.9589 174.7715 19 Y 4.4105 7.4706 115.5024 57.6867 38.5339 175.6591 20 C 4.3561 7.3972 116.8140 59.3172 28.8813 173.3073 21 N 4.4741 8.5613 118.8778 54.0676 38.5312 174.7694 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 8.20 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 7.68 3.38 1.62 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.00 0.25 0.00 0.00 3 V 7.88 3.52 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 0.82 0.00 0.00 0.87 0.00 0.00 4 E 7.88 4.25 0.00 2.04 2.01 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 2.30 2.33 0.00 5 Q 8.01 3.99 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 6 C 8.39 4.43 0.00 3.08 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 7 C 7.84 4.36 0.00 2.90 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 8 T 8.03 4.01 4.35 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 1.21 0.00 0.00 9 S 7.63 4.85 0.00 3.81 3.94 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.13 4.55 1.88 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 1.47 0.76 0.92 0.00 0.00 11 C 8.39 5.26 0.00 3.18 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 S 8.83 4.88 0.00 4.14 4.09 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 13 L 8.35 4.07 0.00 1.78 1.81 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.07 4.15 0.00 2.94 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 8.26 4.11 0.00 2.42 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.62 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 16 L 8.13 4.20 0.00 1.93 1.77 0.94 0.58 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 17 E 8.25 3.95 0.00 2.15 1.90 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 2.23 2.29 0.00 18 N 7.70 4.19 0.00 2.39 2.50 0.00 0.00 5.30 8.17 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 19 Y 7.47 4.41 0.00 3.18 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 20 C 7.40 4.36 0.00 2.98 2.86 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 N 8.56 4.47 0.00 2.68 2.70 0.00 0.00 6.87 7.56 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