NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.9390 8.2516 118.1441 55.4623 33.0564 173.8502 2 V 4.3394 8.2149 117.8773 60.2464 35.2641 168.6883 3 V 4.7961 9.2593 127.5727 61.0411 34.4824 173.8469 4 L 4.7037 9.1605 128.0589 52.8912 44.0835 175.0874 5 K 4.8767 8.7179 125.6569 54.6415 34.0818 175.1932 6 V 4.3667 8.8638 128.0592 61.6170 33.5597 174.2124 7 T 5.2387 8.5894 125.4393 62.1960 69.7281 174.1292 8 L 4.4019 8.3940 125.3913 54.0534 44.1840 174.8668 9 L 4.0028 7.5962 120.4863 54.6918 42.1444 176.9507 10 E 4.0450 8.4587 121.3164 56.4088 30.2674 176.7459 11 G 4.0239 8.9703 106.9142 45.6192 0.0000 174.8712 12 R 4.0593 7.6458 118.2864 55.2587 31.0115 175.3231 13 P 4.4195 0.0000 0.0000 61.8690 33.2946 176.0103 14 P 4.2512 0.0000 0.0000 65.9528 31.2392 178.7275 15 E 3.9284 8.1051 117.5208 58.7620 29.5045 178.6619 16 K 3.9329 7.9280 119.5511 59.3900 32.3741 178.8430 17 K 3.9679 7.9756 118.6585 59.4199 31.8950 179.5831 18 R 3.9067 8.2826 118.6623 59.1992 30.0203 178.6970 19 E 3.9062 8.3339 119.1341 59.1121 29.5722 178.4474 20 L 3.9113 8.1432 120.6132 58.2593 42.1368 179.1162 21 V 3.5510 7.9087 118.0723 65.9098 31.4677 177.9263 22 R 3.8698 8.1528 118.3946 59.5879 29.9979 178.6927 23 R 3.9540 8.4287 118.1899 59.2662 29.9912 179.0261 24 L 3.9834 8.2439 119.0958 58.1047 41.5206 179.8155 25 T 3.7525 7.9784 118.0227 67.0894 68.3370 177.1578 26 E 4.1318 8.1237 120.1600 61.5045 29.7844 180.6945 27 M 4.2180 8.0665 119.3595 58.3746 32.3142 178.2065 28 A 3.9833 8.3198 121.3541 54.9510 18.5879 179.5309 29 S 4.1671 8.4508 114.4325 62.2618 62.2275 177.3360 30 R 3.9637 8.1207 123.2327 61.4771 29.0110 180.4644 31 L 4.2873 7.9482 120.2379 57.0509 42.1747 178.0120 32 L 4.6099 7.9393 115.8848 53.2111 42.1225 176.4891 33 G 4.0031 7.4761 105.3180 46.4475 0.0000 173.5090 34 E 4.5134 7.7619 118.4286 53.5050 31.0526 174.4478 35 P 4.5166 0.0000 0.0000 62.7647 31.7147 176.3922 36 Y 3.9682 9.1906 125.0407 61.6972 38.6506 178.8865 37 E 4.2326 8.2378 113.3961 57.9803 30.2116 179.0363 38 E 4.3319 8.5393 115.9556 57.2774 29.9819 175.5273 39 V 4.4615 7.1461 119.4555 61.6350 32.6343 175.2847 40 R 4.7382 8.9271 126.7979 54.2882 33.4802 174.8031 41 V 4.9139 8.3644 121.8443 61.1298 34.4786 174.4792 42 I 4.5636 8.7726 127.9131 59.4915 40.3697 174.3485 43 L 4.7967 8.6613 127.0970 53.7107 42.9713 176.0048 44 Y 4.7272 9.0763 127.9198 56.3186 39.0475 173.1344 45 E 4.6213 8.4864 125.0808 55.1535 30.6466 175.8964 46 V 4.0312 8.0555 125.2101 61.2211 33.7472 175.7594 47 R 4.5447 8.5486 125.4156 55.6022 30.8107 178.1464 48 R 3.9257 8.5050 119.6380 59.2013 30.2096 177.3323 49 D 4.9310 7.9308 114.8060 52.6828 39.4395 176.4747 50 Q 4.5627 8.3343 115.1713 55.3092 30.7853 174.6343 51 W 4.7171 8.1547 128.3481 55.3313 33.0157 173.8048 52 A 5.4265 8.3095 126.4910 49.2613 22.1022 174.7395 53 A 4.4326 8.2435 121.9540 51.7827 22.0791 177.0387 54 G 3.8476 9.4712 110.8624 46.6427 0.0000 174.6333 55 G 3.8644 8.5456 105.4493 45.0346 0.0000 173.9869 56 V 4.3791 7.4526 119.5753 60.2964 33.5565 175.0037 57 L 4.6411 8.5029 127.5603 54.8205 42.3310 178.4018 58 F 4.4218 9.6654 122.5046 60.2444 38.8937 177.9173 59 S 4.2695 8.3358 115.1758 60.8829 62.9963 174.6093 60 D 4.5549 8.2813 122.7136 54.4559 40.8640 177.1926 61 K 4.1688 7.8809 126.9347 55.1783 32.2036 178.0323 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 M 8.25 4.94 0.00 2.25 2.35 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.38 0.00 2 V 8.21 4.34 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 0.96 0.00 0.00 0.92 0.00 0.00 3 V 9.26 4.80 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 0.87 0.00 0.00 0.92 0.00 0.00 4 L 9.16 4.70 0.00 1.54 1.54 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.72 4.88 0.00 1.75 1.70 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.76 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.41 1.43 7.81 6 V 8.86 4.37 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 1.03 0.00 0.00 0.95 0.00 0.00 7 T 8.59 5.24 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 8 L 8.39 4.40 0.00 1.57 1.67 0.87 0.47 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 9 L 7.60 4.00 0.00 1.07 1.29 0.61 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.46 4.04 0.00 1.88 1.86 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 2.33 2.18 0.00 11 G 8.97 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 12 R 7.65 4.06 0.00 1.74 1.85 0.00 3.20 0.00 0.00 3.14 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 13 P 0.00 4.42 0.00 2.14 1.95 0.00 3.59 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 14 P 0.00 4.25 0.00 2.15 2.11 0.00 3.58 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 2.11 2.14 0.00 15 E 8.11 3.93 0.00 2.07 1.94 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 2.37 2.42 0.00 16 K 7.93 3.93 0.00 1.95 1.77 0.00 1.66 0.00 0.00 1.81 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.58 7.81 17 K 7.98 3.97 0.00 2.00 1.83 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.46 7.81 18 R 8.28 3.91 0.00 2.00 1.99 0.00 3.14 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 19 E 8.33 3.91 0.00 2.21 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 0.00 2.32 2.33 0.00 20 L 8.14 3.91 0.00 1.90 1.84 0.92 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.91 3.55 2.23 0.00 0.00 0.00 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 0.99 0.00 0.00 22 R 8.15 3.87 0.00 2.07 2.09 0.00 3.20 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 23 R 8.43 3.95 0.00 1.82 1.97 0.00 3.37 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.83 0.00 24 L 8.24 3.98 0.00 1.77 1.69 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 25 T 7.98 3.75 4.11 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 0.47 0.00 0.00 26 E 8.12 4.13 0.00 1.99 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 2.25 2.20 0.00 27 M 8.07 4.22 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.71 0.00 28 A 8.32 3.98 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.45 4.17 0.00 3.88 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 30 R 8.12 3.96 0.00 1.86 1.92 0.00 3.32 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 31 L 7.95 4.29 0.00 1.73 1.80 0.93 0.91 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 32 L 7.94 4.61 0.00 1.74 1.66 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 33 G 7.48 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.76 4.51 0.00 2.02 1.86 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 2.44 2.37 0.00 35 P 0.00 4.52 0.00 2.25 2.21 0.00 3.74 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 2.09 1.97 0.00 36 Y 9.19 3.97 0.00 2.99 3.04 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 0.00 0.00 0.00 37 E 8.24 4.23 0.00 2.03 1.85 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 2.23 1.90 0.00 38 E 8.54 4.33 0.00 2.12 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 2.31 2.39 0.00 39 V 7.15 4.46 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 0.65 0.00 0.00 0.90 0.00 0.00 40 R 8.93 4.74 0.00 1.73 1.74 0.00 3.10 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 41 V 8.36 4.91 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 0.82 0.00 0.00 0.89 0.00 0.00 42 I 8.77 4.56 1.88 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 1.23 0.70 0.93 0.00 0.00 43 L 8.66 4.80 0.00 1.54 1.63 0.92 0.85 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 44 Y 9.08 4.73 0.00 2.95 3.04 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 0.00 0.00 0.00 45 E 8.49 4.62 0.00 1.82 1.76 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 2.20 2.27 0.00 46 V 8.06 4.03 1.94 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 1.17 0.00 0.00 0.50 0.00 0.00 47 R 8.55 4.54 0.00 2.01 1.88 0.00 3.18 0.00 0.00 3.16 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.73 0.00 48 R 8.50 3.93 0.00 1.82 2.16 0.00 3.20 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 49 D 7.93 4.93 0.00 2.81 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.33 4.56 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.65 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 51 W 8.15 4.72 0.00 3.17 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.31 5.43 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.24 4.43 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 54 G 9.47 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 55 G 8.55 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 0.00 0.00 0.00 56 V 7.45 4.38 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 1.05 0.00 0.00 0.96 0.00 0.00 57 L 8.50 4.64 0.00 1.84 1.69 0.97 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 58 F 9.67 4.42 0.00 3.09 3.14 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 0.00 59 S 8.34 4.27 0.00 4.04 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 0.00 60 D 8.28 4.55 0.00 2.90 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 K 7.88 4.17 0.00 1.94 1.63 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.29 1.23 7.81