NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 V 4.0508 7.9127 120.3925 62.8535 33.7897 177.1847 4 K 3.7291 8.0907 120.2267 59.2667 31.9910 177.1609 5 Q 3.9853 8.1933 118.0758 58.7734 29.1491 177.7260 6 L 3.9453 7.9131 120.8530 58.4242 42.0918 178.8159 7 E 4.0090 8.5508 118.7796 59.4197 29.3325 179.0589 8 D 4.3317 8.6013 119.2709 57.2966 40.8881 178.6950 9 A 3.9909 8.1778 121.3218 55.1167 18.3014 179.8758 10 V 3.5420 7.9215 116.8087 66.0845 31.7013 177.8030 11 E 3.9259 8.3922 119.1788 59.3652 29.3357 178.7274 12 E 4.0048 8.1288 118.6319 59.4265 29.4627 179.3314 13 L 4.0165 8.0605 119.0235 57.6876 41.6320 179.5482 14 L 4.0147 8.3609 119.5131 57.8367 41.6057 179.7515 15 S 4.1869 8.0468 114.8109 61.3792 62.6938 176.4724 16 A 4.0710 8.3139 123.7398 55.2786 18.0896 179.2000 17 N 4.2484 8.4689 115.7400 56.8246 39.0303 176.3090 18 Y 4.1560 8.1184 120.9288 61.2839 38.9224 178.0414 19 H 3.9506 8.1582 116.7255 58.5457 28.7391 177.5791 20 L 3.9463 8.1945 122.3910 58.3461 41.9780 179.0038 21 E 3.9706 8.4394 118.6441 59.0861 29.3205 178.9062 22 N 4.1606 8.0420 116.5238 56.3602 38.6415 177.2194 23 A 3.9413 7.9164 121.8903 55.1333 18.3836 179.8010 24 V 3.5122 7.9903 116.6478 66.0513 31.6866 178.1323 25 A 3.9599 8.0607 120.5053 55.2283 18.0858 179.7746 26 R 3.8780 8.1132 116.6062 59.4050 30.0359 179.2755 27 L 4.0739 8.0953 118.6492 57.4482 41.5281 179.5006 28 K 3.9597 8.1278 117.9716 59.4225 32.0247 179.2563 29 K 4.1379 7.7896 117.7301 59.1268 32.0175 178.8902 30 L 4.0904 7.4496 120.1689 57.9350 42.0859 177.6500 31 V 3.9505 7.8896 116.1385 61.5687 31.7271 175.8292 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 3 V 7.91 4.05 2.08 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 1.03 0.00 0.00 0.93 0.00 0.00 4 K 8.09 3.73 0.00 1.98 1.79 0.00 1.66 0.00 0.00 1.82 0.00 0.00 3.08 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.65 7.81 5 Q 8.19 3.99 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.65 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 6 L 7.91 3.95 0.00 1.75 1.89 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.55 4.01 0.00 2.17 1.98 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 2.33 2.56 0.00 8 D 8.60 4.33 0.00 2.84 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.18 3.99 1.39 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 0.00 0.00 0.00 10 V 7.92 3.54 2.21 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 1.07 0.00 0.00 0.93 0.00 0.00 11 E 8.39 3.93 0.00 2.11 1.93 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 2.29 2.38 0.00 12 E 8.13 4.00 0.00 2.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.50 0.00 13 L 8.06 4.02 0.00 1.86 1.73 0.93 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.36 4.01 0.00 1.82 1.71 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.05 4.19 0.00 4.14 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 16 A 8.31 4.07 1.35 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 0.00 0.00 0.00 17 N 8.47 4.25 0.00 2.98 3.02 0.00 0.00 6.89 7.93 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 18 Y 8.12 4.16 0.00 3.05 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 19 H 8.16 3.95 0.00 3.39 3.28 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.19 3.95 0.00 1.87 1.87 0.92 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.44 3.97 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 22 N 8.04 4.16 0.00 2.73 2.70 0.00 0.00 6.83 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.92 3.94 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 24 V 7.99 3.51 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.93 0.00 0.00 25 A 8.06 3.96 1.38 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 0.00 0.00 26 R 8.11 3.88 0.00 2.06 1.97 0.00 3.16 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 27 L 8.10 4.07 0.00 1.69 1.69 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.13 3.96 0.00 1.78 1.87 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.56 7.81 29 K 7.79 4.14 0.00 1.80 1.86 0.00 1.49 0.00 0.00 2.14 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.48 7.81 30 L 7.45 4.09 0.00 1.83 1.79 0.91 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 31 V 7.89 3.95 2.08 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 0.78 0.00 0.00 0.99 0.00 0.00