NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 F 4.8126 8.3093 119.4032 57.7201 40.3676 173.7674 7 N 4.6648 8.2819 123.1404 51.0882 39.5004 172.5653 8 M 4.0496 8.8773 116.6429 59.2716 32.7516 179.7046 9 Q 3.9802 8.3580 117.5173 59.5532 28.6221 178.1192 10 C 4.0412 8.0686 118.0882 59.4402 41.3114 175.4019 11 Q 4.2553 8.3025 121.1696 59.6160 28.5725 178.8134 12 R 4.0116 8.2109 118.8434 59.3584 30.0354 179.2905 13 R 3.9211 8.2672 118.0050 59.2280 29.9690 179.0339 14 F 4.4547 8.4497 117.7657 60.8864 38.9713 176.8499 15 Y 4.1360 8.4195 119.1250 60.8147 38.3298 177.8344 16 E 3.8203 8.3967 118.4792 59.3437 29.8792 178.1334 17 A 4.1498 8.0100 119.4383 55.1928 18.4930 179.1586 18 L 4.0353 7.9121 116.3837 57.8930 43.0439 179.1122 19 H 4.8556 7.4034 115.6452 54.1263 27.1398 176.9938 20 D 4.7400 7.2129 120.6154 51.0410 41.7466 173.2759 21 P 4.3208 0.0000 0.0000 64.9957 31.9171 177.6899 22 N 4.4206 7.7593 113.8474 55.7630 38.6230 175.5044 23 L 4.5419 7.4781 116.6053 53.7625 43.0187 176.8061 24 N 4.7686 8.7737 119.9196 51.5693 40.4606 175.6069 25 E 3.8929 8.5617 119.4018 59.6842 29.5488 178.4937 26 E 3.9463 8.1819 117.7849 59.5463 29.6022 179.0504 27 Q 3.9822 8.5704 118.1351 59.0405 28.7523 179.0731 28 R 3.8768 8.1135 119.4351 59.7049 30.0964 178.2001 29 N 4.3188 8.4999 116.2666 56.3295 38.4500 177.2396 30 A 3.9910 8.2684 122.2568 54.8704 18.4169 179.6018 31 K 3.8539 8.1975 118.1731 59.7289 32.2848 178.8687 32 I 3.9084 8.0195 120.3306 64.5371 37.0190 178.1791 33 K 3.9823 8.3526 120.3447 59.6996 31.9475 178.9053 34 S 4.1058 8.3261 115.4025 61.6147 62.6982 176.6154 35 I 3.4673 7.7998 122.4205 64.4087 36.6005 178.4581 36 R 4.2982 8.0947 118.0326 59.4902 30.0410 177.6938 37 D 4.4814 8.2092 116.9923 57.3740 41.3588 177.3543 38 D 4.3747 7.8382 116.9407 57.5814 41.3749 175.2886 39 C 4.0341 7.8857 119.9594 56.9453 41.0896 173.4714 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 6 F 8.31 4.81 0.00 3.13 3.14 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 0.00 0.00 0.00 7 N 8.28 4.66 0.00 3.01 2.95 0.00 0.00 6.19 6.73 0.00 0.00 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 M 8.88 4.05 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.63 0.00 9 Q 8.36 3.98 0.00 2.26 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.78 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 10 C 8.07 4.04 0.00 3.24 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 11 Q 8.30 4.26 0.00 2.21 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.51 0.00 0.00 0.00 0.00 0.00 2.45 2.60 0.00 12 R 8.21 4.01 0.00 2.12 2.02 0.00 3.20 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 13 R 8.27 3.92 0.00 1.86 1.84 0.00 3.06 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 14 F 8.45 4.45 0.00 3.32 2.89 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 0.00 0.00 0.00 15 Y 8.42 4.14 0.00 3.15 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.40 3.82 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 17 A 8.01 4.15 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.91 4.04 0.00 1.44 1.60 0.90 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 19 H 7.40 4.86 0.00 2.91 3.09 0.00 5.60 0.00 0.00 0.00 0.00 8.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.21 4.74 0.00 2.80 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.32 0.00 2.07 2.11 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 22 N 7.76 4.42 0.00 2.92 2.89 0.00 0.00 7.37 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 7.48 4.54 0.00 1.78 1.59 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.77 4.77 0.00 2.99 2.98 0.00 0.00 6.81 7.18 0.00 0.00 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 E 8.56 3.89 0.00 2.05 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 0.00 2.38 2.41 0.00 26 E 8.18 3.95 0.00 2.24 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 0.00 2.40 2.47 0.00 27 Q 8.57 3.98 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 28 R 8.11 3.88 0.00 1.92 2.16 0.00 3.16 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 29 N 8.50 4.32 0.00 2.87 2.87 0.00 0.00 7.26 7.57 0.00 0.00 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 A 8.27 3.99 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 31 K 8.20 3.85 0.00 2.00 1.94 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.63 7.81 32 I 8.02 3.91 2.10 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.76 1.07 0.00 0.00 33 K 8.35 3.98 0.00 1.97 2.02 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.54 7.81 34 S 8.33 4.11 0.00 4.04 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 35 I 7.80 3.47 1.67 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 1.18 0.73 -0.18 0.00 0.00 36 R 8.09 4.30 0.00 2.37 2.30 0.00 3.40 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.15 0.00 37 D 8.21 4.48 0.00 2.76 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 38 D 7.84 4.37 0.00 2.65 2.74 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 0.00 0.00 0.00 0.00 39 C 7.89 4.03 0.00 2.22 1.85 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