NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3106 8.2644 123.5865 52.2841 19.2785 175.2593 3 R 4.2526 7.7778 121.3906 54.5671 31.8602 176.0045 4 K 4.0293 9.0677 125.5199 59.5391 33.2838 178.8232 5 A 3.9716 8.0859 119.8456 54.6197 18.2308 177.7898 6 L 4.7081 7.3901 113.3926 54.8496 42.3355 177.9177 7 I 4.3771 7.7733 120.7047 60.1706 36.1842 175.9798 8 E 4.7189 7.4128 118.8518 55.3274 29.8023 177.6556 9 K 3.7993 7.7794 120.6868 59.6056 33.0523 177.1704 10 A 4.2821 7.7777 119.8259 51.9786 18.1611 177.1328 11 K 4.1534 7.4424 119.8563 56.8346 31.2539 177.3092 12 R 3.9748 8.2318 125.9126 58.8056 30.1978 176.9034 13 T 4.5517 7.5836 106.4792 59.1120 70.5366 172.1178 14 P 4.2841 0.0000 0.0000 63.3409 31.4943 173.8484 15 K 3.8063 6.8702 122.6736 53.9387 29.8751 173.8779 16 F 4.7684 7.7663 115.1922 56.8146 40.0691 177.4530 17 K 4.2679 7.2910 123.1894 58.2427 34.6127 175.7003 18 V 3.8222 7.6353 113.4786 62.1642 32.0201 176.9966 19 R 4.4581 8.1144 118.8716 56.0097 30.6423 175.7803 20 A 4.3631 7.5383 119.7289 52.5253 19.2216 176.4008 21 Y 4.9453 7.7081 118.5195 55.1225 41.2216 174.7155 22 T 4.3362 8.5345 115.4590 61.1346 68.3421 174.1440 23 R 4.8464 8.1960 127.1040 53.9055 33.2312 175.2098 24 C 4.3823 8.2948 122.0130 59.5989 31.1833 173.7441 25 V 3.5474 8.1169 128.0913 65.8992 31.4124 177.7912 26 R 4.0031 7.8965 122.4659 58.8372 30.5660 179.1283 27 C 4.3608 8.2488 112.4708 57.4713 40.8340 173.4663 28 G 3.8230 7.5292 107.8285 46.5504 0.0000 171.9681 29 R 4.5618 7.4609 118.3722 54.7161 33.1459 174.5608 30 A 4.4353 8.5762 117.1161 53.6379 20.8777 176.6418 31 R 4.5184 7.7592 113.9554 56.0183 31.6587 177.2299 32 S 3.9788 8.7539 114.8089 59.1861 60.5123 171.2179 33 V 4.2655 7.3248 114.6649 61.2710 31.5456 176.1275 34 Y 4.4382 8.8097 123.1719 58.1328 38.5360 176.3600 35 R 4.5711 8.4337 117.7640 56.5606 32.3546 177.5200 36 F 4.1605 8.4475 119.2471 59.8366 39.6687 175.7513 37 F 4.6300 8.4202 117.2187 56.7465 40.8537 176.5874 38 G 4.1469 8.6975 107.4473 45.1769 0.0000 172.0533 39 L 5.0346 7.8308 119.3001 51.8326 44.5578 176.1001 40 C 4.5103 9.0341 120.3937 57.5813 31.3770 174.8192 41 R 3.7516 8.7600 119.3340 60.0968 28.7008 178.4935 42 I 3.7330 7.7625 113.2316 63.4141 38.0088 178.3664 43 C 3.9552 8.1267 118.5898 59.6861 39.9098 175.5345 44 L 3.6162 8.2579 120.5792 58.6176 41.7681 178.7125 45 R 3.8439 8.0076 117.4218 59.2733 28.7027 178.4290 46 E 3.9782 8.5677 118.8483 59.4998 29.4725 178.7361 47 L 3.8793 7.6679 115.4849 55.1326 41.7204 178.5408 48 A 3.9613 7.8765 122.1006 55.1250 19.0382 179.2225 49 H 4.3765 7.8552 114.2282 58.6421 28.6540 177.8751 50 K 4.3231 7.5168 117.8124 56.7639 31.7419 177.4369 51 G 4.0247 7.8741 105.3681 47.4673 0.0000 174.3918 52 Q 4.5884 7.9173 112.9203 55.3169 30.7546 177.2204 53 L 4.6869 7.4551 118.6348 51.1081 41.6664 173.7450 54 P 4.1940 0.0000 0.0000 63.6705 32.2386 178.3858 55 G 4.0603 8.8289 107.4248 46.2332 0.0000 174.4234 56 V 3.8562 7.6339 120.1311 62.8268 32.6705 175.1684 57 R 4.5906 8.2591 128.4306 55.4182 31.0755 174.7325 58 K 4.4593 8.5686 115.6440 54.2899 35.1692 175.9896 59 A 4.4867 8.8245 127.1305 51.0983 19.2916 176.3126 60 S 5.3323 8.6399 121.6052 58.2671 64.3020 177.4079 61 W 4.5740 7.8117 121.4387 56.9818 27.3083 174.0657 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 A 8.26 4.31 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.78 4.25 0.00 1.95 1.82 0.00 3.19 0.00 0.00 3.35 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 4 K 9.07 4.03 0.00 1.87 1.84 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.44 7.81 5 A 8.09 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 6 L 7.39 4.71 0.00 1.95 1.80 1.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.77 4.38 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.84 0.90 0.00 0.00 8 E 7.41 4.72 0.00 1.98 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 2.06 2.16 0.00 9 K 7.78 3.80 0.00 1.59 1.74 0.00 1.67 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.36 1.44 7.81 10 A 7.78 4.28 1.24 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 11 K 7.44 4.15 0.00 1.77 1.72 0.00 1.82 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.59 1.37 7.81 12 R 8.23 3.97 0.00 1.81 1.97 0.00 3.18 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 13 T 7.58 4.55 4.18 0.00 0.00 0.00 0.00 0.00 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 14 P 0.00 4.28 0.00 2.23 2.19 0.00 3.73 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 15 K 6.87 3.81 0.00 1.68 1.86 0.00 1.28 0.00 0.00 1.52 0.00 0.00 2.62 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.97 0.21 7.81 16 F 7.77 4.77 0.00 3.21 2.91 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 0.00 0.00 0.00 17 K 7.29 4.27 0.00 1.88 1.68 0.00 1.74 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.55 7.81 18 V 7.64 3.82 2.12 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 0.75 0.00 0.00 0.96 0.00 0.00 19 R 8.11 4.46 0.00 1.92 2.16 0.00 3.40 0.00 0.00 3.35 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 20 A 7.54 4.36 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.71 4.95 0.00 3.07 2.85 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 22 T 8.53 4.34 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 23 R 8.20 4.85 0.00 1.80 1.87 0.00 3.29 0.00 0.00 3.32 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 24 C 8.29 4.38 0.00 2.97 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 25 V 8.12 3.55 2.10 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 0.80 0.00 0.00 0.94 0.00 0.00 26 R 7.90 4.00 0.00 1.80 2.00 0.00 3.40 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 27 C 8.25 4.36 0.00 3.02 3.13 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 0.00 0.00 0.00 0.00 28 G 7.53 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.46 4.56 0.00 1.93 1.89 0.00 3.20 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.79 0.00 30 A 8.58 4.44 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 31 R 7.76 4.52 0.00 1.91 1.86 0.00 3.25 0.00 0.00 3.35 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 32 S 8.75 3.98 0.00 4.13 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 0.00 33 V 7.32 4.27 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 0.77 0.00 0.00 1.13 0.00 0.00 34 Y 8.81 4.44 0.00 3.18 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.43 4.57 0.00 1.80 1.97 0.00 3.21 0.00 0.00 3.14 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 36 F 8.45 4.16 0.00 2.84 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 37 F 8.42 4.63 0.00 3.15 3.07 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 0.00 0.00 0.00 38 G 8.70 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.83 5.03 0.00 1.69 1.60 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 40 C 9.03 4.51 0.00 3.19 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 41 R 8.76 3.75 0.00 2.07 2.36 0.00 2.98 0.00 0.00 3.43 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 42 I 7.76 3.73 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.88 0.91 0.00 0.00 43 C 8.13 3.96 0.00 2.96 3.21 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 44 L 8.26 3.62 0.00 1.64 1.65 0.53 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.01 3.84 0.00 1.84 1.86 0.00 3.27 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.54 0.00 46 E 8.57 3.98 0.00 1.97 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 2.33 2.48 0.00 47 L 7.67 3.88 0.00 1.61 1.63 0.93 0.88 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 48 A 7.88 3.96 1.10 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 0.00 0.00 49 H 7.86 4.38 0.00 3.17 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.52 4.32 0.00 1.83 1.82 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.48 1.53 7.81 51 G 7.87 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 52 Q 7.92 4.59 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 7.05 0.00 0.00 0.00 0.00 0.00 2.27 2.55 0.00 53 L 7.46 4.69 0.00 1.50 1.52 0.42 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.19 0.00 2.24 2.05 0.00 3.81 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 55 G 8.83 4.06 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 0.00 0.00 0.00 56 V 7.63 3.86 2.35 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 0.70 0.00 0.00 0.99 0.00 0.00 57 R 8.26 4.59 0.00 1.77 1.67 0.00 3.25 0.00 0.00 3.25 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 58 K 8.57 4.46 0.00 1.75 1.69 0.00 1.85 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.42 7.81 59 A 8.82 4.49 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 0.00 0.00 0.00 0.00 0.00 60 S 8.64 5.33 0.00 4.05 3.91 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 0.00 0.00 0.00 61 W 7.81 4.57 0.00 3.37 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00