NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9372 8.3393 109.7357 44.9381 0.0000 177.4982 3 K 3.8365 8.9579 121.5053 55.4290 33.1846 170.6247 4 V 4.4365 8.7029 121.8378 61.3727 35.3759 174.9012 5 Y 5.0676 8.7870 124.1512 56.1311 40.9805 174.6991 6 K 4.5018 8.1459 122.5783 54.5032 35.2578 174.7285 7 K 5.0478 8.5032 125.3402 54.7884 34.1288 175.9425 8 V 4.5194 8.6590 117.5643 59.4951 35.3320 174.3980 9 E 4.9797 8.7491 124.5183 55.0208 30.4922 174.8988 10 L 4.8828 8.9988 127.3113 52.8360 45.7023 175.9204 11 V 4.7372 8.3110 120.3854 61.2810 33.6462 174.9520 12 G 4.2412 8.9023 116.2272 45.3572 0.0000 172.1670 13 T 5.8099 8.0421 111.8628 59.0283 72.1907 172.9217 14 S 4.6747 8.2743 114.8760 57.9045 65.3943 175.3107 15 E 4.6062 8.9597 123.5010 57.2028 30.0530 177.8933 16 E 4.1987 8.5254 118.9224 57.2451 30.0979 176.4762 17 G 3.3598 7.1308 104.1573 44.3990 0.0000 173.2758 18 L 3.7528 7.3685 118.0918 57.8376 41.5535 179.1963 19 E 3.9025 8.0896 117.7671 59.6284 29.4340 179.3223 20 A 3.9429 7.9205 119.7515 54.8322 18.4672 179.4671 21 A 3.9171 7.6830 119.2605 55.3575 18.5169 179.8302 22 I 3.5133 7.6807 118.3084 64.7189 37.1920 178.7099 23 Q 3.8916 8.1955 118.6070 58.7543 28.5891 178.7717 24 A 3.9406 8.0331 121.6465 54.9823 18.3871 179.5227 25 A 3.8813 7.7275 118.7345 55.3914 18.4554 179.9455 26 L 3.8216 7.9044 117.2664 57.7326 41.4173 179.5338 27 A 3.9304 8.2347 120.2535 55.1887 18.4483 179.3854 28 R 3.9299 7.9337 116.6445 59.1178 30.1479 178.3329 29 A 3.9115 8.0583 121.0617 55.2275 18.2360 179.5592 30 R 3.9963 7.8126 111.6436 58.0963 29.7206 178.4959 31 K 4.1560 7.6609 119.4598 58.7369 32.1415 177.4648 32 T 4.5411 7.6538 105.1748 60.2803 70.3043 173.4724 33 L 4.4848 7.7616 122.1375 52.7788 43.7825 175.8786 34 R 4.4831 7.9799 120.8019 55.7881 32.7925 175.0796 35 H 4.1938 8.5536 114.6277 56.8270 25.7367 175.1665 36 L 4.6164 8.1961 119.0822 55.6391 42.0548 175.8222 37 D 5.1868 9.3389 123.1878 55.2325 42.7812 176.4158 38 W 5.5929 7.8276 113.3355 55.0415 32.1293 172.9414 39 F 5.3529 8.5097 113.9566 55.2736 40.8037 173.6223 40 E 4.7803 9.2741 119.3882 54.5964 33.1005 175.1329 41 V 4.3195 8.5826 124.0302 62.7436 31.9030 175.1407 42 K 4.5102 9.4415 127.5891 57.8267 33.6408 176.6959 43 E 4.8670 8.0029 117.0406 54.5945 34.4000 174.4330 44 I 5.0958 8.4357 121.7718 59.8046 40.1111 174.6781 45 A 4.7137 8.9858 128.1592 51.3690 23.2543 174.0215 46 G 4.1901 8.1640 103.7271 46.6258 0.0000 172.9973 47 T 4.7380 7.9188 109.8749 60.1175 71.5600 173.6731 48 I 4.7465 8.2330 122.6232 59.7893 39.5119 175.8017 49 G 4.1932 8.9604 115.4591 44.6739 0.0000 173.2719 50 E 3.9128 8.9873 117.9023 58.7639 29.7487 177.4441 51 A 4.5976 7.9023 119.2630 51.8443 20.4846 176.2247 52 G 4.0101 7.3792 104.8220 44.3562 0.0000 176.7449 53 V 3.7465 8.2571 125.1972 63.0726 31.7912 175.0618 54 K 4.1902 8.9110 129.0305 58.4488 33.7348 176.0803 55 E 4.6766 7.5053 121.2200 54.7475 33.1563 173.7200 56 Y 4.5851 9.2563 125.7301 57.8357 39.7450 174.6431 57 Q 5.0355 9.4880 122.4035 54.2024 32.5605 174.4458 58 V 4.7346 8.9373 125.2568 60.9842 34.2081 174.5186 59 V 4.6000 8.6059 129.5466 62.1535 32.5410 174.7485 60 L 5.3664 9.1817 128.1101 54.0394 44.3660 175.1025 61 E 4.9149 9.0962 120.7091 55.3951 31.4085 175.1667 62 V 4.4812 8.9168 125.3846 61.0171 33.9073 174.3912 63 G 3.2779 8.2259 115.7505 44.0394 0.0000 172.2567 64 F 5.6572 8.3159 117.6426 55.0299 41.9874 173.3762 65 R 4.1776 8.8882 121.5949 56.0395 30.5411 175.9498 66 L 4.4021 8.3640 127.4271 54.3427 42.2842 177.1749 67 E 4.2212 8.8302 122.8652 56.0195 30.3800 175.9882 68 E 4.3768 8.3708 120.6231 55.5930 30.6551 177.0105 69 T 4.0970 8.4234 112.3356 61.9897 69.0149 174.3038 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 G 8.34 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 3 K 8.96 3.84 0.00 1.59 1.66 0.00 1.65 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.51 7.81 4 V 8.70 4.44 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 1.09 0.00 0.00 0.95 0.00 0.00 5 Y 8.79 5.07 0.00 3.04 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 6 K 8.15 4.50 0.00 1.51 0.74 0.00 1.57 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.17 1.27 7.81 7 K 8.50 5.05 0.00 1.65 1.66 0.00 2.02 0.00 0.00 1.80 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.14 1.42 7.81 8 V 8.66 4.52 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 0.87 0.00 0.00 1.04 0.00 0.00 9 E 8.75 4.98 0.00 1.98 1.87 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 2.22 2.34 0.00 10 L 9.00 4.88 0.00 1.55 1.49 0.87 0.42 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 11 V 8.31 4.74 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 0.85 0.00 0.00 0.94 0.00 0.00 12 G 8.90 4.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 T 8.04 5.81 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 1.22 0.00 0.00 14 S 8.27 4.67 0.00 3.90 3.77 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 15 E 8.96 4.61 0.00 2.03 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 2.48 2.30 0.00 16 E 8.53 4.20 0.00 1.96 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 2.33 2.27 0.00 17 G 7.13 3.36 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 0.00 18 L 7.37 3.75 0.00 1.55 1.64 0.87 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.09 3.90 0.00 1.99 1.97 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 2.39 2.44 0.00 20 A 7.92 3.94 1.29 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 0.00 0.00 0.00 21 A 7.68 3.92 1.44 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 0.00 0.00 22 I 7.68 3.51 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.88 0.36 0.00 0.00 23 Q 8.20 3.89 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 24 A 8.03 3.94 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 25 A 7.73 3.88 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.90 3.82 0.00 1.71 1.62 0.52 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.23 3.93 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 28 R 7.93 3.93 0.00 1.94 2.02 0.00 3.12 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 29 A 8.06 3.91 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 30 R 7.81 4.00 0.00 1.93 2.18 0.00 3.05 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 31 K 7.66 4.16 0.00 1.86 1.87 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.40 7.81 32 T 7.65 4.54 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 33 L 7.76 4.48 0.00 1.42 0.89 0.43 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 34 R 7.98 4.48 0.00 1.63 1.44 0.00 3.24 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.51 0.00 35 H 8.55 4.19 0.00 3.66 3.53 0.00 5.62 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.20 4.62 0.00 1.67 1.66 0.87 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 37 D 9.34 5.19 0.00 2.97 3.09 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 0.00 0.00 0.00 0.00 38 W 7.83 5.59 0.00 3.28 3.22 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 39 F 8.51 5.35 0.00 3.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 9.27 4.78 0.00 1.99 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 2.34 2.52 0.00 41 V 8.58 4.32 2.17 0.00 0.00 0.00 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 1.12 0.00 0.00 42 K 9.44 4.51 0.00 1.76 1.86 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.58 7.81 43 E 8.00 4.87 0.00 1.88 1.79 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 2.31 2.34 0.00 44 I 8.44 5.10 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.66 1.00 0.00 0.00 45 A 8.99 4.71 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 47 T 7.92 4.74 4.20 0.00 0.00 0.00 0.00 0.00 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 48 I 8.23 4.75 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.62 0.92 0.00 0.00 49 G 8.96 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.99 3.91 0.00 1.96 2.02 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 2.30 2.24 0.00 51 A 7.90 4.60 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.38 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 0.00 0.00 0.00 53 V 8.26 3.75 1.81 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 -0.24 0.00 0.00 0.69 0.00 0.00 54 K 8.91 4.19 0.00 1.82 1.70 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.75 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.35 7.81 55 E 7.51 4.68 0.00 1.99 1.67 0.00 0.00 0.00 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 2.28 0.00 56 Y 9.26 4.59 0.00 2.99 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 9.49 5.04 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.74 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 58 V 8.94 4.73 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 0.97 0.00 0.00 0.97 0.00 0.00 59 V 8.61 4.60 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 0.92 0.00 0.00 0.95 0.00 0.00 60 L 9.18 5.37 0.00 1.96 1.78 0.89 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 61 E 9.10 4.91 0.00 1.93 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 62 V 8.92 4.48 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 0.91 0.00 0.00 0.89 0.00 0.00 63 G 8.23 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.32 5.66 0.00 3.39 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 65 R 8.89 4.18 0.00 2.01 1.96 0.00 3.14 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.17 0.00 66 L 8.36 4.40 0.00 1.59 1.55 0.85 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.83 4.22 0.00 2.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 68 E 8.37 4.38 0.00 1.95 1.87 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 2.26 2.21 0.00 69 T 8.42 4.10 4.24 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 0.00 0.00 0.00 1.22 0.00 0.00