NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8775 8.3549 109.7372 45.4597 0.0000 173.0990 2 S 4.1615 7.8800 114.8674 58.2165 63.9938 173.4588 3 S 3.4417 9.8194 121.9196 59.3865 61.5266 171.0881 4 G 3.8111 8.0217 110.0544 45.8766 0.0000 173.5385 5 S 4.6233 8.1923 120.8269 56.8717 64.4568 174.5673 6 S 4.5873 8.2879 117.3814 57.0914 64.2715 174.0281 7 G 4.2185 7.8439 112.2568 44.6550 0.0000 171.2377 8 P 4.4951 0.0000 0.0000 62.4965 32.0587 175.7717 9 K 4.4359 8.3448 117.5710 57.5882 32.5459 177.3077 10 Q 4.5423 7.9235 114.3652 55.8351 29.4583 175.7350 11 R 4.5648 7.2972 115.8708 54.0275 33.4222 173.6562 12 C 3.6357 8.5548 122.5038 59.3760 32.2893 174.0043 13 R 4.2581 8.0433 123.8621 56.7993 28.9412 176.2556 14 A 4.9728 7.7134 119.5849 49.5445 21.9551 176.3362 15 P 4.3404 0.0000 0.0000 64.6738 32.1404 176.3614 16 A 4.7080 7.1172 121.4802 50.4620 18.9101 177.1203 17 C 4.4670 7.8502 121.4945 59.4410 33.3678 173.2737 18 D 5.0053 8.6673 130.6917 53.6956 39.9133 175.9023 19 H 4.9608 7.8919 115.3436 54.6130 31.7555 173.8530 20 F 4.4875 8.8580 124.4754 58.3098 39.9015 175.3327 21 G 4.3689 7.5616 119.4721 45.3985 0.0000 171.5445 22 N 4.2997 7.9017 114.4857 52.5035 42.7264 175.9013 23 A 3.8917 8.6903 129.0898 55.4962 18.6508 179.3782 24 K 3.7646 8.1840 114.7951 59.9878 32.3432 177.5319 25 C 3.7509 7.7492 115.2456 60.8301 28.3780 173.1178 26 N 4.5332 9.2046 112.7361 54.3391 36.9633 175.1634 27 G 4.0830 8.3575 109.3526 45.8965 0.0000 174.4800 28 Y 4.4628 7.2578 116.5930 57.7191 38.8319 174.7096 29 C 4.6635 8.4887 115.6655 57.0755 32.8162 174.0926 30 N 4.1880 8.5517 121.1231 57.3929 38.7525 176.2026 31 E 3.9606 8.4904 119.0519 60.1722 29.5318 179.0613 32 C 4.1239 8.0859 115.3365 62.9395 28.1842 175.5861 33 F 4.0909 8.5411 121.0588 61.7666 39.1866 176.6297 34 Q 3.9196 8.8438 119.0109 59.0240 28.6570 177.6086 35 F 4.0093 8.2498 120.9490 61.8358 39.4750 177.0713 36 K 3.9713 8.3252 117.8494 58.7756 32.4979 176.3791 37 Q 3.6536 7.0114 115.9700 55.8391 29.2750 177.2193 38 M 3.8614 8.2902 120.9256 55.2340 31.9412 175.5755 39 Y 3.6404 8.3592 125.9164 61.3679 38.9071 176.4233 40 G 4.3026 8.5316 120.4956 46.4427 0.0000 172.7546 41 S 4.6623 7.5694 107.7635 57.2892 63.9388 174.5410 42 G 3.8477 7.8719 109.1869 45.8665 0.0000 172.3983 43 P 4.3328 0.0000 0.0000 64.4945 31.6178 176.8457 44 S 4.7946 7.3364 111.7087 56.6242 65.2625 173.0627 45 S 4.5359 7.8579 112.2376 57.8520 64.7921 175.9763 46 G 3.7324 8.5872 114.4155 45.8433 0.0000 172.2498 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 3.88 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 0.00 0.00 0.00 0.00 2 S 7.88 4.16 0.00 3.95 3.82 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.82 3.44 0.00 3.90 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 4 G 8.02 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.19 4.62 0.00 3.87 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.29 4.59 0.00 3.97 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 7 G 7.84 4.22 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 0.00 0.00 0.00 8 P 0.00 4.50 0.00 2.24 2.10 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 9 K 8.34 4.44 0.00 1.74 1.83 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.44 7.81 10 Q 7.92 4.54 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 11 R 7.30 4.56 0.00 1.71 1.74 0.00 3.50 0.00 0.00 3.30 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.77 0.00 12 C 8.55 3.64 0.00 3.16 3.05 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 0.00 0.00 0.00 0.00 13 R 8.04 4.26 0.00 0.67 1.57 0.00 2.70 0.00 0.00 2.98 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.18 0.00 14 A 7.71 4.97 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.34 0.00 2.21 2.22 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 16 A 7.12 4.71 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.85 4.47 0.00 2.93 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 18 D 8.67 5.01 0.00 2.83 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 19 H 7.89 4.96 0.00 3.24 3.30 0.00 5.64 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.86 4.49 0.00 2.94 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 21 G 7.56 4.37 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 0.00 22 N 7.90 4.30 0.00 2.68 2.53 0.00 0.00 7.51 7.62 0.00 0.00 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 A 8.69 3.89 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.18 3.76 0.00 1.64 1.74 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.29 1.44 7.81 25 C 7.75 3.75 0.00 3.22 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 0.00 26 N 9.20 4.53 0.00 3.19 3.07 0.00 0.00 7.19 8.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 8.36 4.08 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 0.00 0.00 0.00 28 Y 7.26 4.46 0.00 3.29 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 29 C 8.49 4.66 0.00 3.21 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.55 4.19 0.00 2.83 2.94 0.00 0.00 7.03 7.71 0.00 0.00 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 E 8.49 3.96 0.00 2.10 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 2.52 0.00 32 C 8.09 4.12 0.00 3.23 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 33 F 8.54 4.09 0.00 2.99 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 8.84 3.92 0.00 2.35 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.46 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 35 F 8.25 4.01 0.00 3.06 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 8.33 3.97 0.00 1.71 1.83 0.00 1.79 0.00 0.00 1.52 0.00 0.00 2.97 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.28 1.40 7.81 37 Q 7.01 3.65 0.00 1.98 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.60 0.00 0.00 0.00 0.00 0.00 2.15 2.10 0.00 38 M 8.29 3.86 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.38 0.00 39 Y 8.36 3.64 0.00 2.81 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.53 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.57 4.66 0.00 3.92 4.01 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 42 G 7.87 3.85 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 0.00 0.00 0.00 43 P 0.00 4.33 0.00 2.18 2.18 0.00 3.72 0.00 0.00 3.68 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 44 S 7.34 4.79 0.00 3.97 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 45 S 7.86 4.54 0.00 3.78 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.59 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00