NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9363 8.3544 109.7369 45.5464 0.0000 173.6549 2 S 4.0311 8.6277 116.0709 58.9248 62.9292 172.6774 3 A 4.4829 7.8699 121.8647 50.8062 21.4797 175.6324 4 D 4.7687 7.4733 119.3419 53.2413 41.8367 177.0380 5 Y 4.1663 8.1248 117.9139 60.5877 38.1951 179.0090 6 S 4.2069 8.3420 113.4681 60.7882 62.8596 175.0811 7 S 4.4936 8.0060 114.2104 59.0842 63.1493 174.5513 8 L 4.2971 7.5637 118.8199 54.9474 41.7938 176.3343 9 T 4.7361 8.1680 111.6434 60.9210 71.1575 176.0667 10 V 4.2944 8.3996 118.4439 64.7138 31.6087 179.4130 11 V 3.6921 7.9887 112.3793 64.5414 31.3563 178.6598 12 Q 4.0463 8.0513 117.3385 58.6411 28.6919 178.3775 13 L 4.0103 8.5780 120.6702 57.8390 41.8168 179.8331 14 K 2.9613 7.5935 118.5064 59.1991 32.3505 178.7543 15 D 4.1527 7.8905 119.5959 57.1672 41.2710 178.2686 16 L 3.9982 8.1143 120.6034 58.5264 40.1366 178.9768 17 L 3.7323 7.3564 119.2184 58.1231 41.9091 179.1992 18 T 3.8469 7.8149 112.6467 64.8549 66.9753 175.9626 19 K 3.8927 7.6050 121.0656 59.3243 32.2613 178.3244 20 R 4.0839 7.6992 116.2517 56.7939 30.3593 177.1780 21 N 4.6197 7.9942 115.3271 52.7345 36.7374 175.2138 22 L 3.8304 7.0172 117.5736 54.3026 42.0843 179.3657 23 S 5.3259 6.5962 116.1876 57.8835 64.9521 175.9495 24 V 4.0570 7.6100 111.6911 60.9155 33.8023 177.1817 25 G 4.1164 8.1059 110.3092 44.5259 0.0000 172.4235 26 G 4.7293 7.3446 105.9881 44.1796 0.0000 172.0156 27 L 3.4268 7.2382 120.5490 52.5484 45.3731 174.0483 28 K 4.0681 6.9325 122.4621 59.6802 31.8262 178.0929 29 N 4.2806 7.9399 116.5844 56.2529 37.0492 176.6972 30 E 4.0465 7.9068 119.3774 58.3939 29.7836 179.0628 31 W 4.3522 8.9696 121.4869 59.7795 29.1953 178.8111 32 V 3.7226 8.5262 119.4635 64.8195 30.7442 178.4845 33 Q 3.9880 8.1165 118.8960 58.8096 28.5727 178.8507 34 R 3.9644 8.5423 117.5037 59.1669 29.4376 178.8546 35 L 3.7707 8.3658 119.9314 57.6663 41.5913 179.3896 36 I 3.9404 8.2239 120.0860 64.5536 37.0418 178.4237 37 K 4.0444 8.1947 120.3296 59.1137 31.7507 178.5782 38 D 4.2829 8.0163 118.1307 57.5673 41.0544 177.7782 39 D 4.5366 8.6562 119.6591 57.1280 40.8028 178.4352 40 E 4.1648 8.4133 118.9040 58.6770 29.2794 178.6049 41 E 4.1597 7.7371 117.6578 58.7507 29.8924 178.3200 42 S 5.0636 7.8151 113.9312 56.3150 63.6831 174.3446 43 K 3.7376 9.0974 121.7035 56.9910 30.9522 174.5957 44 G 3.9494 8.3951 101.1457 46.1976 0.0000 174.5089 45 E 4.4812 8.1810 118.9326 55.3246 32.0563 175.2301 46 S 4.5349 7.3372 109.3375 57.1685 65.1857 175.1622 47 E 4.8702 8.6925 122.1130 56.2683 29.8401 175.5644 48 V 4.5883 7.8994 112.2840 59.9064 35.4364 175.0388 49 S 4.8216 8.2117 115.6502 56.2727 66.0088 173.6145 50 P 4.6389 0.0000 0.0000 62.3738 29.5957 176.1885 51 Q 4.0484 7.4560 122.9284 56.9650 29.3178 174.1197 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 3.94 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 0.00 0.00 0.00 2 S 8.63 4.03 0.00 3.93 3.89 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 3 A 7.87 4.48 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.47 4.77 0.00 2.61 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.12 4.17 0.00 3.19 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 6 S 8.34 4.21 0.00 4.01 4.10 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.01 4.49 0.00 3.84 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.56 4.30 0.00 1.89 1.80 0.85 0.87 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 9 T 8.17 4.74 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 10 V 8.40 4.29 2.46 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 0.95 0.00 0.00 1.04 0.00 0.00 11 V 7.99 3.69 2.11 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 0.90 0.00 0.00 0.97 0.00 0.00 12 Q 8.05 4.05 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.93 0.00 0.00 0.00 0.00 0.00 2.47 2.48 0.00 13 L 8.58 4.01 0.00 2.16 2.00 1.25 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 14 K 7.59 2.96 0.00 1.13 0.74 0.00 1.43 0.00 0.00 1.56 0.00 0.00 2.70 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.19 7.81 15 D 7.89 4.15 0.00 2.91 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 8.11 4.00 0.00 1.91 2.08 1.09 0.75 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 17 L 7.36 3.73 0.00 1.34 1.60 -0.11 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.81 3.85 4.14 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 1.18 0.00 0.00 19 K 7.60 3.89 0.00 1.94 1.86 0.00 1.82 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.46 7.81 20 R 7.70 4.08 0.00 1.78 1.93 0.00 3.12 0.00 0.00 3.41 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.87 0.00 21 N 7.99 4.62 0.00 2.83 3.13 0.00 0.00 7.07 7.24 0.00 0.00 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 L 7.02 3.83 0.00 1.55 1.53 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 23 S 6.60 5.33 0.00 3.95 3.95 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 0.00 0.00 0.00 24 V 7.61 4.06 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.92 0.00 0.00 25 G 8.11 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.34 4.73 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 27 L 7.24 3.43 0.00 1.41 1.30 0.57 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 28 K 6.93 4.07 0.00 1.56 1.65 0.00 1.77 0.00 0.00 1.89 0.00 0.00 3.35 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.60 1.66 7.81 29 N 7.94 4.28 0.00 2.91 3.02 0.00 0.00 5.80 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 E 7.91 4.05 0.00 2.24 2.15 0.00 0.00 0.00 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 2.65 0.00 31 W 8.97 4.35 0.00 3.31 3.06 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 0.00 0.00 0.00 0.00 32 V 8.53 3.72 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.21 0.00 0.00 33 Q 8.12 3.99 0.00 2.32 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.88 0.00 0.00 0.00 0.00 0.00 2.63 2.52 0.00 34 R 8.54 3.96 0.00 1.98 2.39 0.00 2.84 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 1.91 1.65 0.00 35 L 8.37 3.77 0.00 1.05 0.82 -0.27 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 36 I 8.22 3.94 2.14 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.37 0.97 0.00 0.00 37 K 8.19 4.04 0.00 2.03 1.94 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.45 7.81 38 D 8.02 4.28 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 39 D 8.66 4.54 0.00 2.81 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.41 4.16 0.00 2.18 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 2.35 2.55 0.00 41 E 7.74 4.16 0.00 2.16 2.04 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 2.49 2.53 0.00 42 S 7.82 5.06 0.00 3.90 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 43 K 9.10 3.74 0.00 1.80 1.83 0.00 1.93 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.37 7.81 44 G 8.40 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.18 4.48 0.00 1.85 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 46 S 7.34 4.53 0.00 3.98 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 47 E 8.69 4.87 0.00 1.98 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 2.32 2.30 0.00 48 V 7.90 4.59 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 0.84 0.00 0.00 0.97 0.00 0.00 49 S 8.21 4.82 0.00 3.81 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 50 P 0.00 4.64 0.00 2.17 2.10 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 51 Q 7.46 4.05 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.69 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00