NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9186 8.3549 109.7351 45.4603 0.0000 173.7944 2 S 4.1887 7.6575 113.8882 57.2330 64.1361 173.1492 3 M 4.1256 8.4600 122.6367 56.3593 33.3115 176.2639 4 G 4.1446 8.0261 103.2221 43.8469 0.0000 174.3319 5 V 4.3161 7.5189 117.3997 60.5539 34.8072 171.4837 6 P 4.5781 0.0000 0.0000 62.7556 33.1821 175.0595 7 I 5.2006 7.7254 120.0601 59.2980 40.6527 174.7847 8 C 3.9143 8.8540 128.7707 59.4546 32.0158 174.5733 9 G 2.5642 7.8533 115.1023 46.4475 0.0000 173.8589 10 A 4.6128 7.9060 123.1242 54.4958 19.1179 178.2330 11 C 4.7003 7.9573 105.9263 57.0655 30.4561 173.6098 12 R 3.7758 8.2438 118.2879 57.9323 27.9695 176.0056 13 R 4.7232 7.5080 114.2502 53.3779 33.8520 174.1354 14 P 4.6089 0.0000 0.0000 63.1621 31.6564 176.4771 15 I 4.0970 9.1835 127.2979 60.8853 37.8686 176.9267 16 E 4.8794 7.6077 118.8895 54.0652 31.5350 173.6033 17 G 3.7980 7.8005 117.1890 46.3272 0.0000 173.8214 18 R 4.5885 8.8555 121.7514 54.3749 33.1141 176.3007 19 V 4.4416 8.3954 123.8231 61.4596 34.0401 175.0029 20 V 4.1987 8.1862 123.8677 61.1105 33.9706 174.3421 21 N 5.7612 8.9879 126.0815 51.6972 38.7685 174.4625 22 A 4.5165 8.2665 125.6236 51.4825 22.3878 175.4898 23 M 3.2863 9.1383 116.8748 56.0197 30.2509 177.8068 24 G 4.0284 8.4029 104.3316 46.4399 0.0000 174.1436 25 K 4.7101 8.8112 121.4562 55.0658 36.3268 174.9642 26 Q 4.9877 7.8794 119.1562 55.0475 33.5441 174.4905 27 W 5.3500 9.0482 121.3098 54.9322 34.1045 174.3499 28 H 4.4958 9.1348 120.7183 56.1782 28.6853 176.6924 29 V 3.7128 8.1506 122.3418 65.2157 31.5722 176.2474 30 E 4.3470 8.1452 118.3248 57.7517 30.1306 175.8997 31 H 4.7666 8.3347 113.9994 55.8105 29.7481 174.6939 32 F 4.5848 8.2217 123.2267 57.9277 39.8000 174.3038 33 V 4.5953 7.4669 118.3053 58.9510 35.8442 174.9289 34 C 4.2352 8.0148 121.4957 59.3693 32.5904 173.2383 35 A 4.2081 8.5349 127.0016 51.9980 18.6224 178.4425 36 K 4.5868 7.8441 119.7976 58.1851 35.0337 176.4529 37 C 4.6450 7.6326 109.4850 56.3433 31.3319 172.9214 38 E 3.4834 7.6425 118.1231 57.2398 26.1702 175.1696 39 K 4.1986 7.3926 120.6272 53.6712 32.8632 173.2769 40 P 4.5124 0.0000 0.0000 62.3598 32.5183 177.2288 41 F 4.6687 8.2257 121.7597 56.4620 38.2953 176.6728 42 L 4.1354 7.7273 124.1525 57.7110 41.9308 180.5739 43 G 4.2208 7.4407 104.3281 45.6629 0.0000 171.2409 44 H 5.1187 7.7558 116.5264 53.4701 31.8885 173.3701 45 R 4.2692 8.4888 120.1094 55.5500 30.9543 174.5428 46 H 4.5500 7.2905 118.2901 53.6391 31.4610 172.3810 47 Y 4.4830 8.4937 114.6790 56.1916 41.6302 174.7191 48 E 4.8779 8.3471 122.1609 54.9012 32.3848 175.6652 49 R 4.4676 9.7427 123.1235 56.4713 33.3913 175.0206 50 K 3.9350 10.0092 122.8529 57.2848 29.8522 175.1287 51 G 3.9443 9.1641 103.8675 45.8247 0.0000 173.7693 52 L 4.7785 8.2731 117.7765 52.4541 46.0433 176.1406 53 A 4.5093 8.1135 123.8055 52.4362 20.1187 175.9199 54 Y 4.6768 9.7503 117.0291 56.7656 43.2660 175.1388 55 C 5.1448 9.1724 120.9458 59.7639 28.7157 174.3322 56 E 2.0000 8.5342 119.7141 58.9723 28.6468 178.5756 57 T 3.9462 7.4646 115.0288 66.4005 68.7473 176.7377 58 H 4.3333 7.8677 117.6195 58.9118 28.7696 176.6976 59 Y 4.7105 8.3268 121.4844 61.2036 38.7279 178.2519 60 N 3.8251 7.6510 115.8651 56.2339 38.4485 177.1158 61 Q 3.8866 9.2449 119.6150 59.3039 29.0590 178.2973 62 L 4.0099 8.5679 120.1567 57.8925 41.8101 176.5215 63 F 4.3810 8.9256 118.4219 53.6988 48.1100 173.9646 64 G 3.6002 7.3004 110.9817 46.3942 0.0000 172.7415 65 D 4.4384 8.0233 114.7776 53.9394 38.5166 174.3610 66 V 4.0088 7.4659 121.1171 62.3858 30.7990 173.4664 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 3.92 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 0.00 0.00 0.00 2 S 7.66 4.19 0.00 3.94 3.79 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 3 M 8.46 4.13 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.55 0.00 4 G 8.03 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 0.00 0.00 0.00 0.00 5 V 7.52 4.32 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 0.89 0.00 0.00 0.91 0.00 0.00 6 P 0.00 4.58 0.00 2.05 2.08 0.00 3.82 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 7 I 7.73 5.20 1.74 0.00 0.00 0.80 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 0.59 0.83 0.00 0.00 8 C 8.85 3.91 0.00 2.68 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 9 G 7.85 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.91 4.61 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 C 7.96 4.70 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 3.78 0.00 1.87 1.99 0.00 3.16 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 13 R 7.51 4.72 0.00 1.82 1.85 0.00 3.18 0.00 0.00 3.36 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 14 P 0.00 4.61 0.00 1.92 2.01 0.00 3.68 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 15 I 9.18 4.10 1.78 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.42 0.90 0.00 0.00 16 E 7.61 4.88 0.00 2.03 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 2.37 2.31 0.00 17 G 7.80 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.86 4.59 0.00 1.77 1.85 0.00 3.13 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 19 V 8.40 4.44 2.05 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 0.69 0.00 0.00 0.89 0.00 0.00 20 V 8.19 4.20 2.20 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 -0.06 0.00 0.00 0.91 0.00 0.00 21 N 8.99 5.76 0.00 2.59 2.74 0.00 0.00 6.93 7.30 0.00 0.00 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 8.27 4.52 0.67 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 0.00 0.00 0.00 0.00 0.00 23 M 9.14 3.29 0.00 2.23 2.64 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.66 0.00 24 G 8.40 4.03 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 0.00 0.00 0.00 25 K 8.81 4.71 0.00 1.93 1.25 0.00 1.41 0.00 0.00 1.51 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.66 7.81 26 Q 7.88 4.99 0.00 1.81 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.76 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 27 W 9.05 5.35 0.00 3.15 3.35 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 28 H 9.13 4.50 0.00 3.19 3.18 0.00 5.83 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.15 3.71 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 0.75 0.00 0.00 1.01 0.00 0.00 30 E 8.15 4.35 0.00 1.92 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 2.20 2.37 0.00 31 H 8.33 4.77 0.00 3.42 3.50 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 F 8.22 4.58 0.00 3.28 3.20 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 33 V 7.47 4.60 1.73 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 0.74 0.00 0.00 0.80 0.00 0.00 34 C 8.01 4.24 0.00 3.16 2.73 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 35 A 8.53 4.21 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.84 4.59 0.00 2.06 1.85 0.00 1.64 0.00 0.00 1.91 0.00 0.00 3.15 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.36 7.81 37 C 7.63 4.65 0.00 3.06 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 38 E 7.64 3.48 0.00 2.10 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 0.00 2.15 2.18 0.00 39 K 7.39 4.20 0.00 1.64 1.45 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.28 7.81 40 P 0.00 4.51 0.00 2.16 2.18 0.00 3.28 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.94 0.00 41 F 8.23 4.67 0.00 3.31 3.26 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 42 L 7.73 4.14 0.00 1.54 1.76 1.09 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 43 G 7.44 4.22 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 0.00 0.00 0.00 44 H 7.76 5.12 0.00 3.41 3.39 0.00 5.67 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.49 4.27 0.00 1.67 1.82 0.00 3.02 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 1.02 0.00 46 H 7.29 4.55 0.00 2.21 1.31 0.00 5.52 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 Y 8.49 4.48 0.00 3.31 2.57 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 0.00 0.00 0.00 0.00 48 E 8.35 4.88 0.00 1.72 1.80 0.00 0.00 0.00 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 2.27 0.00 49 R 9.74 4.47 0.00 1.96 1.90 0.00 3.33 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 1.44 1.76 0.00 50 K 10.01 3.94 0.00 1.99 1.88 0.00 1.90 0.00 0.00 1.74 0.00 0.00 2.63 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.25 1.27 7.81 51 G 9.16 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 52 L 8.27 4.78 0.00 1.96 1.31 1.02 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.11 4.51 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.75 4.68 0.00 2.95 3.17 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 55 C 9.17 5.14 0.00 3.01 2.95 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 56 E 8.53 2.00 0.00 1.65 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.94 0.00 57 T 7.46 3.95 4.05 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 1.13 0.00 0.00 58 H 7.87 4.33 0.00 3.43 3.55 0.00 5.66 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.33 4.71 0.00 3.39 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 60 N 7.65 3.83 0.00 2.86 2.68 0.00 0.00 7.04 7.15 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 61 Q 9.24 3.89 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.97 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 62 L 8.57 4.01 0.00 1.48 1.64 0.86 0.04 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 63 F 8.93 4.38 0.00 2.81 2.73 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 64 G 7.30 3.60 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 0.00 0.00 0.00 65 D 8.02 4.44 0.00 2.80 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 66 V 7.47 4.01 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 0.62 0.00 0.00 0.92 0.00 0.00