NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 P 4.2512 0.0000 0.0000 61.7271 32.5178 176.1735 6 E 3.9009 8.7536 123.5251 55.7143 29.9737 171.6061 7 V 4.0184 8.1684 123.4746 61.8204 33.3475 173.5432 8 P 5.2046 0.0000 0.0000 62.2967 33.0082 174.1002 9 F 4.9693 7.5378 113.6526 56.1195 41.5041 172.5811 10 K 5.1008 8.8172 117.5183 55.0000 34.1121 176.5436 11 V 4.8504 8.5714 115.7851 59.7241 36.8010 174.3998 12 V 4.6275 8.2583 121.7071 60.6081 34.6108 174.3699 13 A 4.1330 8.3216 129.8572 52.5631 18.5042 178.0889 14 Q 3.6536 8.9444 123.1687 58.8433 29.1824 177.0292 15 F 5.1588 7.7797 114.6497 54.7598 43.5891 172.8950 16 P 4.6894 0.0000 0.0000 63.2752 31.9625 174.8276 17 Y 4.8972 8.0356 125.6299 56.0046 40.2603 174.1749 18 K 4.7603 8.0810 127.2546 54.8210 35.3265 175.0851 19 S 4.5007 8.0717 119.3209 57.3614 66.1171 173.4607 20 D 4.4971 8.1985 118.4423 54.5080 40.7804 176.1746 21 Y 4.7141 7.1539 117.0045 56.3397 39.6911 176.5272 22 E 4.0455 8.9724 124.5943 59.5936 30.3116 177.8368 23 D 4.6531 8.2058 118.0624 57.2375 42.0116 176.7071 24 D 5.2326 7.7020 118.6619 54.3722 41.5941 176.0343 25 L 4.5736 9.0458 125.8537 54.3322 42.6876 175.4690 26 N 4.9395 8.8277 124.0971 52.1144 40.5673 174.1423 27 F 5.0934 7.7593 115.5805 56.2870 41.7506 173.1609 28 E 4.5704 8.7001 119.0726 54.6502 31.6616 175.7114 29 K 3.9534 8.5551 121.8618 58.3323 32.4917 176.9344 30 D 4.4798 8.8635 123.2106 54.4611 39.9753 174.1690 31 Q 3.8736 7.3684 121.3304 55.7832 29.9804 174.4342 32 E 4.5655 8.5539 128.2823 55.8062 30.4214 175.4379 33 I 4.7419 8.5836 127.3681 59.4893 41.4285 174.7265 34 I 4.5251 8.3463 124.7887 59.5009 39.6808 175.4639 35 V 4.0373 8.3008 129.5096 62.7260 31.5788 176.2047 36 T 4.4227 8.3623 118.3649 61.6266 69.6674 174.6551 37 S 4.5194 7.4904 114.3290 57.9727 65.8756 174.6694 38 V 4.6491 8.5203 126.2654 61.3891 31.4624 175.4730 39 E 4.1399 8.6089 127.9329 58.6641 29.5978 177.4288 40 D 4.7073 7.5756 115.3304 52.0575 42.3342 175.2566 41 A 4.0334 8.7404 120.5145 54.8503 18.5813 178.2644 42 E 4.3738 8.2970 114.2309 56.0695 31.1062 175.5197 43 W 4.9858 7.9037 118.4212 54.9434 33.2713 174.5232 44 Y 5.3945 8.3791 120.9593 56.3718 41.2218 174.2410 45 F 5.0321 9.1770 121.8846 57.1597 42.7739 173.6595 46 G 4.5283 8.5210 113.2389 46.2901 0.0000 170.5275 47 E 5.5675 8.8269 116.5318 56.7409 33.1373 173.5015 48 Y 4.9941 7.8047 116.3147 56.2081 41.3850 173.7171 49 Q 4.3962 8.7612 122.3526 54.8673 28.9449 175.3504 50 D 4.7557 8.2541 126.8568 52.7391 40.6559 176.8524 51 S 4.0590 8.8193 112.8575 62.0231 62.1214 174.9872 52 N 4.5925 8.1799 113.5344 53.4603 38.1545 176.0847 53 G 3.9925 8.1488 108.0050 45.3007 0.0000 174.0774 54 D 4.5003 7.8228 120.2190 53.6600 41.5439 175.8529 55 V 4.2482 8.1875 123.8826 62.9074 32.4222 175.1124 56 I 4.7200 8.1597 120.1052 59.0547 40.7692 174.0540 57 E 5.4632 9.1128 121.9792 53.3060 33.5541 174.4449 58 G 4.2168 6.8737 105.7094 43.8265 0.0000 171.5858 59 I 5.4771 8.3185 113.7853 59.3342 39.9560 174.9802 60 F 5.1265 8.2016 116.4058 55.1804 40.5900 171.6389 61 P 3.8359 0.0000 0.0000 62.2098 32.0453 177.8338 62 K 3.9071 8.4253 122.7620 59.3128 32.0989 179.6528 63 S 4.3775 7.9311 111.9461 60.3640 63.2918 174.8853 64 F 4.6777 8.4116 119.2538 58.7786 39.2107 175.1725 65 V 5.1942 7.8803 111.9941 59.3916 35.8866 174.7083 66 A 4.7930 8.4832 123.1850 49.7828 21.9809 176.6577 67 V 3.9874 8.5048 120.8037 63.2400 31.2685 175.7952 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 5 P 0.00 4.25 0.00 0.84 1.59 0.00 3.45 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.85 0.00 6 E 8.75 3.90 0.00 2.08 1.95 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 2.33 2.32 0.00 7 V 8.17 4.02 2.16 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 0.86 0.00 0.00 0.94 0.00 0.00 8 P 0.00 5.20 0.00 2.04 1.99 0.00 3.44 0.00 0.00 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.79 0.00 9 F 7.54 4.97 0.00 3.07 3.27 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.82 5.10 0.00 1.69 1.76 0.00 1.71 0.00 0.00 1.78 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.46 7.81 11 V 8.57 4.85 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 0.93 0.00 0.00 1.00 0.00 0.00 12 V 8.26 4.63 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 0.90 0.00 0.00 0.89 0.00 0.00 13 A 8.32 4.13 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 14 Q 8.94 3.65 0.00 1.44 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.64 0.00 0.00 0.00 0.00 0.00 2.20 2.35 0.00 15 F 7.78 5.16 0.00 2.77 2.83 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 0.00 0.00 0.00 16 P 0.00 4.69 0.00 2.14 2.17 0.00 3.98 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 2.09 2.05 0.00 17 Y 8.04 4.90 0.00 2.81 1.43 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 0.00 18 K 8.08 4.76 0.00 1.62 1.48 0.00 1.60 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.24 1.36 7.81 19 S 8.07 4.50 0.00 4.11 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.20 4.50 0.00 2.11 2.44 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 21 Y 7.15 4.71 0.00 3.31 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 E 8.97 4.05 0.00 1.95 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 0.00 2.33 2.44 0.00 23 D 8.21 4.65 0.00 2.65 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 24 D 7.70 5.23 0.00 2.91 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 25 L 9.05 4.57 0.00 1.93 2.06 1.03 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.83 4.94 0.00 2.61 2.64 0.00 0.00 6.96 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 7.76 5.09 0.00 2.87 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 28 E 8.70 4.57 0.00 1.94 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 2.41 2.28 0.00 29 K 8.56 3.95 0.00 1.82 1.74 0.00 1.89 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.62 7.81 30 D 8.86 4.48 0.00 2.85 2.77 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 31 Q 7.37 3.87 0.00 2.03 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.97 0.00 0.00 0.00 0.00 0.00 1.16 1.45 0.00 32 E 8.55 4.57 0.00 1.94 1.78 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 2.22 2.29 0.00 33 I 8.58 4.74 1.66 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.05 1.00 0.00 0.00 34 I 8.35 4.53 1.87 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 1.10 1.47 0.87 0.00 0.00 35 V 8.30 4.04 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 0.21 0.00 0.00 0.43 0.00 0.00 36 T 8.36 4.42 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 1.25 0.00 0.00 37 S 7.49 4.52 0.00 3.85 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.52 4.65 2.22 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 1.07 0.00 0.00 1.25 0.00 0.00 39 E 8.61 4.14 0.00 2.26 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 2.49 2.44 0.00 40 D 7.58 4.71 0.00 2.88 2.77 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 41 A 8.74 4.03 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 42 E 8.30 4.37 0.00 2.08 1.74 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 2.15 2.24 0.00 43 W 7.90 4.99 0.00 3.25 2.97 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 0.00 0.00 0.00 44 Y 8.38 5.39 0.00 2.08 2.34 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.18 5.03 0.00 3.14 2.81 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 0.00 0.00 0.00 0.00 46 G 8.52 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.83 5.57 0.00 2.04 1.98 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 2.23 2.11 0.00 48 Y 7.80 4.99 0.00 3.06 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 49 Q 8.76 4.40 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.01 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 50 D 8.25 4.76 0.00 2.89 2.62 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 51 S 8.82 4.06 0.00 3.89 3.96 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 0.00 0.00 0.00 52 N 8.18 4.59 0.00 2.75 2.82 0.00 0.00 7.04 7.65 0.00 0.00 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 G 8.15 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 54 D 7.82 4.50 0.00 2.82 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.19 4.25 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 0.76 0.00 0.00 0.91 0.00 0.00 56 I 8.16 4.72 1.74 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.02 0.80 0.00 0.00 57 E 9.11 5.46 0.00 1.61 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 2.16 2.20 0.00 58 G 6.87 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 59 I 8.32 5.48 2.17 0.00 0.00 0.34 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 1.21 1.19 0.00 0.00 60 F 8.20 5.13 0.00 3.09 3.62 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 61 P 0.00 3.84 0.00 1.59 1.12 0.00 2.20 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 62 K 8.43 3.91 0.00 1.56 1.62 0.00 1.45 0.00 0.00 1.25 0.00 0.00 2.49 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.30 0.73 7.81 63 S 7.93 4.38 0.00 4.00 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 64 F 8.41 4.68 0.00 3.46 3.52 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.88 5.19 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 0.65 0.00 0.00 1.38 0.00 0.00 66 A 8.48 4.79 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 67 V 8.50 3.99 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 0.52 0.00 0.00 0.82 0.00 0.00