NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 5.1693 0.0000 0.0000 62.7704 33.5916 175.1339 3 R 4.4611 8.4612 125.1808 53.7904 30.7472 172.3684 4 L 5.0641 8.5811 126.7834 53.0796 44.5609 175.1177 5 K 5.0689 8.6993 125.2775 55.7121 36.3709 174.6667 6 V 5.3942 8.4698 112.3270 61.4181 36.8686 173.1372 7 K 5.0224 8.2513 120.7837 54.8172 35.8955 174.8004 8 L 4.3112 8.5913 128.5272 55.2393 41.8683 177.0388 9 V 4.2206 8.5031 129.6172 61.2680 33.9574 177.3012 10 K 4.5355 8.5176 126.4064 56.7173 34.7351 176.9664 11 S 4.6410 8.4759 121.2743 57.4474 64.7039 174.7676 12 P 4.2106 0.0000 0.0000 66.2986 30.7967 181.9883 13 I 2.5048 6.8190 115.3642 59.5924 41.0149 174.4457 14 G 3.7544 6.4784 112.1539 44.7278 0.0000 171.0229 15 Y 4.5904 8.0488 116.2845 55.3061 39.6379 171.2334 16 P 4.1779 0.0000 0.0000 63.0464 30.9015 175.2590 17 K 3.4264 8.6076 121.6651 59.7529 32.7859 178.1355 18 D 4.4042 7.8746 117.8020 56.3847 40.1834 179.1904 19 Q 3.8420 8.1284 121.1151 58.7087 29.0808 177.7329 20 K 3.3983 8.1885 119.7165 59.5138 31.9369 178.8142 21 A 3.8973 7.9196 119.9955 55.1007 18.3479 178.9633 22 A 3.9529 8.1247 120.3814 55.2171 18.3267 179.2819 23 L 3.8456 8.1654 117.1482 57.8035 41.6689 179.5639 24 K 4.1699 8.7643 119.2012 59.7714 31.9567 178.2237 25 A 3.9717 8.1529 120.0076 54.5872 18.2371 178.9358 26 L 3.9964 8.3072 119.3967 55.7213 42.3245 177.0918 27 G 3.9789 9.7483 107.4976 42.5601 0.0000 175.1617 28 L 4.6143 9.0380 119.3510 52.9566 42.9219 174.4587 29 R 4.9509 9.3067 122.9679 56.1826 27.3761 175.9872 30 R 3.6877 8.1548 117.9206 55.5497 31.3588 176.2256 31 L 3.9613 8.7139 125.0621 57.4791 42.2902 176.5659 32 Q 4.4674 7.8144 117.8278 54.6098 29.0273 174.8993 33 Q 4.5378 8.1741 120.5860 55.1098 31.8100 172.8101 34 E 4.8783 8.8869 125.6717 55.0148 30.9733 175.2298 35 R 4.7654 9.1116 122.9398 54.4046 33.1130 174.5403 36 V 4.5528 8.4291 114.3900 59.6154 33.9866 174.6199 37 L 4.7487 8.6224 128.5904 52.7816 44.3424 175.0869 38 E 4.3671 8.8116 125.4132 55.1798 30.1364 176.9642 39 D 4.6380 8.3692 130.3965 54.2834 39.7204 177.2067 40 T 4.0548 7.7263 116.2289 63.0252 69.7117 174.6235 41 P 4.2410 0.0000 0.0000 65.9491 31.2927 177.6893 42 A 4.1904 8.2432 120.6561 53.1938 18.2326 179.0935 43 I 3.6030 7.6391 115.5512 64.6958 37.6001 177.9368 44 R 4.0106 8.6888 119.0078 58.7864 29.7519 179.4857 45 G 4.4909 8.6418 105.4714 47.7215 0.0000 174.8346 46 N 4.2394 8.2324 120.2366 56.5119 38.9299 177.0401 47 V 3.6899 7.9263 119.6127 65.8334 31.5557 177.8421 48 E 3.9420 8.6276 118.0509 59.4185 29.2522 178.3495 49 K 3.7347 8.1289 119.6019 59.4924 32.1755 178.2269 50 V 3.4406 7.8917 117.9674 63.5529 31.8757 179.1810 51 A 3.6984 9.2000 121.6256 53.2188 17.6938 179.1188 52 H 4.3357 9.9310 109.1832 56.4890 28.8062 176.2029 53 L 4.9084 9.2171 119.6612 54.8001 43.8884 176.1063 54 V 4.9963 7.6368 116.8405 60.3009 35.1781 173.9258 55 R 4.6155 8.8173 121.9109 54.6837 31.7426 175.0035 56 V 4.6217 8.4464 126.2448 60.1044 33.2264 174.8703 57 E 4.5995 9.1005 125.2386 54.1031 33.4068 176.3386 58 V 4.2500 8.5791 124.3585 63.3776 29.6228 174.2073 59 V 4.1029 8.7282 124.8976 60.5853 31.9093 175.1786 60 E 4.2443 8.2813 126.7244 55.8035 29.7858 175.5692 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 2 P 0.00 5.17 0.00 2.09 2.20 0.00 3.81 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 2.01 1.96 0.00 3 R 8.46 4.46 0.00 1.77 1.94 0.00 3.26 0.00 0.00 3.13 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.78 0.00 4 L 8.58 5.06 0.00 1.77 1.52 1.00 0.28 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 5 K 8.70 5.07 0.00 2.13 1.90 0.00 1.27 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.42 7.81 6 V 8.47 5.39 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 0.75 0.00 0.00 0.93 0.00 0.00 7 K 8.25 5.02 0.00 1.82 1.58 0.00 2.02 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.50 7.81 8 L 8.59 4.31 0.00 1.70 1.79 1.04 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.50 4.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 1.07 0.00 0.00 10 K 8.52 4.54 0.00 1.69 1.69 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.45 7.81 11 S 8.48 4.64 0.00 3.92 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 12 P 0.00 4.21 0.00 2.12 2.36 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.91 0.00 13 I 6.82 2.50 1.76 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.67 0.78 0.00 0.00 14 G 6.48 3.75 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 0.00 0.00 0.00 15 Y 8.05 4.59 0.00 2.98 3.01 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 P 0.00 4.18 0.00 2.21 2.17 0.00 3.97 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 17 K 8.61 3.43 0.00 1.82 1.73 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.48 7.81 18 D 7.87 4.40 0.00 2.98 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 19 Q 8.13 3.84 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.18 0.00 20 K 8.19 3.40 0.00 1.83 1.82 0.00 2.15 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.65 1.18 7.81 21 A 7.92 3.90 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 22 A 8.12 3.95 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.17 3.85 0.00 1.87 1.60 0.87 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.76 4.17 0.00 1.91 1.89 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.49 7.81 25 A 8.15 3.97 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.31 4.00 0.00 1.71 1.78 0.91 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 27 G 9.75 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 0.00 0.00 0.00 28 L 9.04 4.61 0.00 1.75 1.65 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 29 R 9.31 4.95 0.00 1.91 1.85 0.00 3.42 0.00 0.00 3.25 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.33 0.00 30 R 8.15 3.69 0.00 1.91 1.86 0.00 3.43 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 31 L 8.71 3.96 0.00 1.61 1.71 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 32 Q 7.81 4.47 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.39 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 33 Q 8.17 4.54 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.00 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 34 E 8.89 4.88 0.00 2.00 1.88 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 2.25 2.30 0.00 35 R 9.11 4.77 0.00 1.85 1.96 0.00 2.77 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 36 V 8.43 4.55 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 0.70 0.00 0.00 0.93 0.00 0.00 37 L 8.62 4.75 0.00 1.69 1.67 0.92 0.71 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 38 E 8.81 4.37 0.00 2.01 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 2.27 2.25 0.00 39 D 8.37 4.64 0.00 2.87 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.73 4.05 4.33 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 1.23 0.00 0.00 41 P 0.00 4.24 0.00 2.15 2.10 0.00 3.59 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 42 A 8.24 4.19 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.64 3.60 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.24 0.90 0.00 0.00 44 R 8.69 4.01 0.00 2.05 2.09 0.00 3.16 0.00 0.00 3.54 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 45 G 8.64 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.23 4.24 0.00 2.77 2.88 0.00 0.00 6.93 7.14 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 47 V 7.93 3.69 2.14 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 1.07 0.00 0.00 0.99 0.00 0.00 48 E 8.63 3.94 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.25 0.00 49 K 8.13 3.73 0.00 1.88 2.14 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.45 1.46 7.81 50 V 7.89 3.44 2.13 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 0.84 0.00 0.00 0.95 0.00 0.00 51 A 9.20 3.70 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 52 H 9.93 4.34 0.00 3.30 3.40 0.00 5.47 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 9.22 4.91 0.00 1.39 1.62 0.79 0.32 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 54 V 7.64 5.00 2.07 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 0.70 0.00 0.00 1.03 0.00 0.00 55 R 8.82 4.62 0.00 1.96 1.83 0.00 3.10 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 56 V 8.45 4.62 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 0.80 0.00 0.00 0.93 0.00 0.00 57 E 9.10 4.60 0.00 1.87 1.83 0.00 0.00 0.00 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 2.22 0.00 58 V 8.58 4.25 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 0.73 0.00 0.00 0.93 0.00 0.00 59 V 8.73 4.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.97 0.00 0.00 60 E 8.28 4.24 0.00 2.04 1.72 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 2.25 2.31 0.00