NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 L 4.3634 8.1693 120.6646 55.0580 43.2249 175.3520 6 T 4.4819 7.8870 109.1388 59.9681 70.3767 172.4593 7 E 4.2416 9.5174 122.7299 58.4232 30.7346 177.7763 8 T 4.9521 7.5638 115.3052 62.0185 72.2046 173.0656 9 M 4.8811 9.2275 126.8758 53.0463 35.2460 172.9506 10 P 5.1624 0.0000 0.0000 62.4053 33.2197 175.0758 11 F 5.2586 8.6482 115.5463 55.4000 41.6507 173.4068 12 R 5.2170 8.7288 115.4992 54.8258 32.7007 174.0159 13 M 5.1017 9.2776 120.1408 54.1021 36.1131 173.9322 14 T 5.2540 8.5550 113.7583 60.1951 72.1693 172.7253 15 M 4.9994 9.2925 123.9424 53.8827 35.8601 173.5022 16 E 4.8584 8.5697 122.7223 54.8774 33.1689 174.4858 17 G 3.7719 7.5505 107.3118 46.2110 0.0000 172.1862 18 T 5.1514 8.3058 115.6751 61.5699 71.9751 173.9970 19 V 4.1767 8.7523 125.5798 61.9518 33.6132 175.1002 20 N 4.2451 9.9590 125.5773 54.3006 36.0315 175.4552 21 G 3.8437 8.4452 106.1369 45.5344 0.0000 173.7354 22 H 4.6832 8.0611 118.1182 55.1752 28.7960 174.1172 23 H 5.2789 8.7521 122.4603 55.5251 30.3978 174.4500 24 F 5.2272 8.7635 116.0039 56.0382 41.8721 173.0706 25 K 5.2232 9.4544 118.2462 55.1625 36.5079 175.4064 26 C 5.5748 9.7671 121.0863 58.2614 32.6196 173.1316 27 T 5.1803 8.9588 111.4229 60.2612 72.0488 172.9530 28 G 4.6184 8.8554 108.0918 45.1252 0.0000 172.0363 29 K 4.9730 9.0432 121.0421 54.7598 36.8749 175.9532 30 G 3.7849 8.1693 110.7263 45.6799 0.0000 171.1448 31 E 5.0874 8.5751 116.3426 55.5329 33.4741 174.3366 32 G 4.4983 9.0038 106.9272 46.0183 0.0000 171.7607 33 N 5.4484 8.8273 117.6687 50.3991 38.7193 174.9419 34 P 4.0938 0.0000 0.0000 65.1989 31.6225 178.2773 35 F 4.5712 7.7823 115.1140 59.2434 39.2779 176.2199 36 E 4.2972 8.3396 117.9520 55.8786 29.8701 176.1393 37 G 3.9272 8.0338 107.1307 46.9017 0.0000 173.5286 38 T 4.9306 7.5923 108.1060 59.7566 72.2376 172.5348 39 Q 5.1625 8.3622 119.1691 55.6408 31.6093 173.0671 40 D 5.1648 9.2627 120.0731 53.1085 45.2955 174.4432 41 M 5.1965 8.6249 117.7621 54.0977 34.7843 173.7884 42 K 4.6812 9.2037 119.4550 54.8170 34.9691 175.4513 43 I 5.0679 8.2296 123.8696 59.4362 40.3434 174.3442 44 E 4.5763 9.1314 127.5558 54.1627 32.6302 174.8643 45 V 4.4228 8.4998 127.3223 62.8002 31.3405 175.2568 46 I 4.3649 8.7666 122.4017 61.6542 38.9411 175.8607 47 E 4.5626 8.0107 122.0454 55.7570 33.8977 176.0911 48 G 4.1995 8.6677 110.7313 46.7724 0.0000 173.5132 49 G 3.9811 7.6787 107.7454 42.9743 0.0000 172.3561 50 P 4.2966 0.0000 0.0000 61.8251 31.9680 176.4605 51 L 3.6403 8.2464 121.5463 54.8889 41.7208 174.9813 52 P 4.6758 0.0000 0.0000 62.2210 31.5528 175.1650 53 F 4.8482 6.8299 111.5653 55.4728 40.7189 173.5785 54 A 4.0819 8.7127 124.5632 52.2589 18.7050 178.6833 55 F 4.1204 8.9597 125.1161 61.1673 39.3230 176.6346 56 D 4.5430 8.4489 118.6603 57.5394 40.3496 178.5246 57 I 3.8379 7.4599 111.7863 62.7547 37.7936 177.1189 58 L 4.3310 7.8227 120.3577 55.0274 42.0713 178.3085 59 S 4.0042 7.3558 115.9951 61.9194 62.8566 176.2413 60 T 4.2644 7.7776 106.1743 62.5918 68.7168 174.7659 61 S 4.6167 7.9393 117.5192 58.7894 64.3069 173.9469 62 C 4.3696 7.8014 123.0408 59.9431 27.9229 173.3117 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 L 8.17 4.36 0.00 1.44 1.64 0.72 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 6 T 7.89 4.48 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 1.26 0.00 0.00 7 E 9.52 4.24 0.00 2.18 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 0.00 2.49 2.64 0.00 8 T 7.56 4.95 4.26 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 1.22 0.00 0.00 9 M 9.23 4.88 0.00 2.09 1.85 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 10 P 0.00 5.16 0.00 2.06 1.97 0.00 3.80 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 11 F 8.65 5.26 0.00 3.07 3.12 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 0.00 0.00 0.00 0.00 12 R 8.73 5.22 0.00 1.81 1.90 0.00 2.99 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 13 M 9.28 5.10 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.67 0.00 14 T 8.56 5.25 4.27 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 1.24 0.00 0.00 15 M 9.29 5.00 0.00 2.18 1.98 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.74 0.00 16 E 8.57 4.86 0.00 1.82 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 2.08 2.16 0.00 17 G 7.55 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 0.00 0.00 0.00 18 T 8.31 5.15 4.21 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 1.06 0.00 0.00 19 V 8.75 4.18 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.75 0.00 0.00 20 N 9.96 4.25 0.00 2.87 2.88 0.00 0.00 7.32 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 21 G 8.45 3.84 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 0.00 0.00 0.00 22 H 8.06 4.68 0.00 3.57 3.46 0.00 5.61 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.75 5.28 0.00 3.15 3.21 0.00 5.63 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 8.76 5.23 0.00 3.32 3.24 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 25 K 9.45 5.22 0.00 1.71 1.71 0.00 1.90 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.38 7.81 26 C 9.77 5.57 0.00 2.98 2.93 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 0.00 0.00 0.00 27 T 8.96 5.18 4.27 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 1.24 0.00 0.00 28 G 8.86 4.62 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 0.00 29 K 9.04 4.97 0.00 1.62 1.55 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.26 1.35 7.81 30 G 8.17 3.78 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 0.00 0.00 0.00 31 E 8.58 5.09 0.00 2.07 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 2.11 2.24 0.00 32 G 9.00 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.83 5.45 0.00 2.76 2.84 0.00 0.00 6.95 8.19 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 34 P 0.00 4.09 0.00 1.17 1.77 0.00 3.61 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.98 0.00 35 F 7.78 4.57 0.00 3.07 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 36 E 8.34 4.30 0.00 2.00 2.03 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 2.33 2.39 0.00 37 G 8.03 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.59 4.93 4.27 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 1.29 0.00 0.00 39 Q 8.36 5.16 0.00 2.32 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.47 0.00 40 D 9.26 5.16 0.00 2.65 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.62 5.20 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.73 0.00 42 K 9.20 4.68 0.00 1.62 1.69 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.35 7.81 43 I 8.23 5.07 1.73 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.60 1.15 0.00 0.00 44 E 9.13 4.58 0.00 1.96 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.18 0.00 45 V 8.50 4.42 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 0.95 0.00 0.00 0.89 0.00 0.00 46 I 8.77 4.36 1.90 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 1.37 0.82 0.98 0.00 0.00 47 E 8.01 4.56 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 2.32 2.35 0.00 48 G 8.67 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 0.00 0.00 0.00 0.00 49 G 7.68 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.30 0.00 2.12 2.01 0.00 3.76 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 51 L 8.25 3.64 0.00 1.28 0.94 0.58 0.41 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 52 P 0.00 4.68 0.00 2.04 2.02 0.00 3.33 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 1.76 1.77 0.00 53 F 6.83 4.85 0.00 3.03 2.98 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 0.00 0.00 0.00 54 A 8.71 4.08 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 55 F 8.96 4.12 0.00 3.05 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 56 D 8.45 4.54 0.00 2.75 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 57 I 7.46 3.84 1.79 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.47 0.89 0.00 0.00 58 L 7.82 4.33 0.00 0.78 1.47 0.80 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 59 S 7.36 4.00 0.00 3.89 3.93 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 0.00 0.00 0.00 60 T 7.78 4.26 4.21 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 1.19 0.00 0.00 61 S 7.94 4.62 0.00 3.98 3.93 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 0.00 0.00 0.00 62 C 7.80 4.37 0.00 3.17 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