NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 L 4.2898 8.1693 120.6284 54.7991 43.1919 176.2328 6 S 4.5840 8.0203 116.0766 56.3364 65.9699 173.6293 7 Q 3.9501 8.7683 121.9308 59.5267 28.8587 180.9077 8 L 4.0697 7.8219 120.3030 58.1488 42.3275 178.7175 9 Q 4.0843 8.4364 118.1652 58.9341 28.4575 179.0609 10 T 3.9052 8.2203 117.5023 66.4587 68.5258 176.4715 11 E 3.9584 7.7614 119.1988 59.6285 29.5703 179.4469 12 L 4.0337 7.9158 118.7569 57.6702 41.4148 179.5453 13 L 3.8854 7.5974 118.5915 58.3724 42.3308 178.1270 14 A 3.9903 8.7056 120.7171 55.6275 17.8366 179.1909 15 A 3.8996 8.7543 118.3677 55.2850 18.2643 179.6691 16 L 3.9409 7.6434 117.9070 57.8168 42.2830 179.0033 17 L 4.3983 7.9769 120.6794 56.9196 41.7505 178.9175 18 E 3.9738 8.2458 116.2187 58.8198 29.5429 177.9791 19 S 4.3462 7.6411 111.8234 58.3539 63.4343 174.0662 20 G 3.5972 8.5658 108.1572 46.6498 0.0000 174.8485 21 L 4.5825 7.4651 119.8369 51.9083 44.5460 175.3122 22 S 4.3285 8.5056 122.2228 58.1924 64.7131 174.8742 23 K 3.8569 8.8177 124.3030 60.3169 31.7922 178.6188 24 E 4.0448 8.2904 117.8019 59.4552 29.5003 178.8562 25 A 4.2233 8.0269 120.5131 54.9981 18.3421 179.5778 26 L 3.8747 7.7715 119.0325 58.4853 42.1311 179.0155 27 I 3.6741 8.2212 119.1805 64.3239 37.0329 178.0099 28 Q 4.0381 8.3783 119.8750 59.2684 29.0742 177.7733 29 A 4.0982 7.7271 120.6218 55.0152 18.4424 177.5671 30 L 4.2127 7.9750 122.6779 55.5182 42.3538 176.3627 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 5 L 8.17 4.29 0.00 1.65 1.67 0.92 0.55 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 6 S 8.02 4.58 0.00 4.03 4.02 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 7 Q 8.77 3.95 0.00 2.08 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.97 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 8 L 7.82 4.07 0.00 1.75 1.65 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 8.44 4.08 0.00 2.32 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.60 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 10 T 8.22 3.91 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 1.21 0.00 0.00 11 E 7.76 3.96 0.00 2.22 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 2.54 2.51 0.00 12 L 7.92 4.03 0.00 1.84 1.72 0.92 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.60 3.89 0.00 1.71 1.85 0.92 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.71 3.99 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.75 3.90 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.64 3.94 0.00 1.99 1.90 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.98 4.40 0.00 1.88 1.68 0.92 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.25 3.97 0.00 1.95 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 0.00 2.32 2.51 0.00 19 S 7.64 4.35 0.00 3.99 4.07 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 20 G 8.57 3.60 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 0.00 0.00 0.00 21 L 7.47 4.58 0.00 1.67 1.64 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.51 4.33 0.00 4.08 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 23 K 8.82 3.86 0.00 1.82 1.93 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.56 7.81 24 E 8.29 4.04 0.00 1.97 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 2.40 2.33 0.00 25 A 8.03 4.22 1.36 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 0.00 0.00 26 L 7.77 3.87 0.00 1.94 1.82 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 27 I 8.22 3.67 1.87 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 1.41 0.94 0.91 0.00 0.00 28 Q 8.38 4.04 0.00 2.05 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 29 A 7.73 4.10 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.98 4.21 0.00 1.73 1.78 0.92 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00