NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.2806 8.1744 117.3732 62.9651 69.9298 172.7906 4 Q 4.0664 8.3505 124.2632 55.6070 29.7878 174.1921 5 L 4.3560 9.0023 125.6204 54.0874 43.9783 177.1241 6 M 4.1844 8.1340 121.7092 58.3078 32.0984 178.7024 7 G 3.8741 8.0678 106.5514 47.3236 0.0000 175.2836 8 E 4.0594 8.1345 120.2419 59.3366 29.4971 179.6075 9 R 4.0099 7.7885 117.6695 58.9438 30.1219 179.0884 10 I 3.7436 7.8291 119.9045 64.3398 37.0937 178.4062 11 R 4.2017 8.3582 120.5852 58.9552 30.0167 178.2628 12 A 4.0031 8.1648 120.6289 55.3164 18.1284 179.6175 13 R 3.9059 7.8618 116.1795 59.4114 30.3069 178.4705 14 R 4.0617 8.2421 118.6485 59.4071 30.1901 178.5180 15 K 3.9342 8.3534 118.6034 59.4217 31.7907 179.1149 16 K 3.9490 7.8062 118.8291 59.4740 32.2770 178.3406 17 L 4.1369 7.6593 116.5386 54.3889 42.9905 176.7187 18 K 3.8674 7.7157 118.0721 57.0868 29.6907 174.5061 19 I 4.6918 7.0418 110.0349 57.9570 41.3934 176.5168 20 R 4.2626 8.2472 118.9423 55.8119 31.6627 177.6564 21 Q 3.9558 8.5166 117.8171 59.0967 28.6965 178.9130 22 A 3.9784 7.9823 121.0767 55.0528 18.5460 179.4278 23 A 3.9545 7.7829 118.9182 55.1215 18.5571 179.4730 24 L 4.0463 8.0598 119.1497 58.1266 42.1403 179.2725 25 G 3.7033 8.3935 107.5334 47.1155 0.0000 175.4679 26 K 3.9420 7.8736 120.9436 59.5297 32.2649 178.4980 27 M 4.2109 7.6967 117.6965 58.2646 31.9443 178.4227 28 V 3.9904 7.9089 117.4558 63.5417 31.8814 176.6683 29 G 4.0555 9.3530 106.5914 45.5449 0.0000 172.8999 30 V 4.5134 7.5052 111.5413 58.1373 35.8623 175.1223 31 S 4.5044 8.0971 115.9862 57.8911 65.1367 174.8036 32 N 4.2240 8.4564 120.1216 55.9766 36.9266 177.4276 33 V 3.4576 7.6490 119.9641 65.6768 31.6145 177.6149 34 A 4.0293 7.5379 121.7363 54.4674 18.0183 179.6470 35 I 3.0549 6.8805 118.2850 64.3546 37.2254 178.5204 36 S 4.0277 7.9209 113.8834 61.5289 62.0399 176.3279 37 Q 4.0045 8.1089 121.0406 58.7003 28.4959 178.7173 38 W 4.7359 7.9549 121.4158 59.4846 28.5884 178.5127 39 E 4.3172 8.6823 118.7535 58.9959 28.6649 178.5677 40 R 4.4380 7.7591 115.1516 55.3220 30.3703 176.5869 41 S 3.8922 7.7854 113.4550 59.5426 60.9156 172.8248 42 E 4.1107 8.5165 124.3556 59.0369 29.3670 176.1596 43 T 4.7261 7.5838 106.8586 60.6905 71.7727 171.6689 44 E 4.6021 8.3184 120.2196 53.3294 32.7242 174.5673 45 P 3.8747 0.0000 0.0000 62.2779 31.9441 176.8333 46 N 4.7470 8.3923 118.6449 51.9613 40.2520 175.9318 47 G 3.5701 8.4770 105.8829 48.2842 0.0000 175.2508 48 E 3.9684 8.1196 122.0180 58.8654 29.6586 178.5213 49 N 4.4495 8.9527 117.0201 56.0187 38.5089 177.2250 50 L 3.6626 8.1707 122.3155 57.9574 42.2479 179.0650 51 L 3.9249 7.7734 118.2725 57.8157 41.5979 179.4007 52 A 4.0485 8.1018 120.7045 54.8969 18.1953 179.5039 53 L 4.0078 8.2894 119.6029 58.3099 42.1333 179.2833 54 S 4.1459 8.2959 114.4711 61.4207 62.7976 176.7618 55 K 3.9377 8.0707 121.5779 59.2176 31.6483 179.1878 56 A 4.0772 7.9606 119.6862 54.7253 18.3710 178.6913 57 L 4.3365 8.0029 114.5515 53.7614 42.5746 176.4741 58 Q 3.5193 8.0768 117.2542 56.4970 26.4997 172.0553 59 C 4.6905 8.2056 111.0924 56.1139 33.2721 173.7916 60 S 4.6561 8.3180 114.0594 57.0234 65.3102 173.2034 61 P 4.2492 0.0000 0.0000 65.7916 31.0237 178.7326 62 D 4.3302 8.0912 117.4190 57.4474 40.7344 178.0282 63 Y 4.0586 8.1243 119.9453 60.6299 38.4448 178.0947 64 L 3.6526 7.6617 119.8926 57.6639 41.5193 179.5658 65 L 3.9705 7.8841 117.6894 57.1760 41.7569 178.3291 66 K 4.4463 7.9062 114.0009 54.7195 35.0205 178.5353 67 G 3.6503 7.7316 107.0484 46.5608 0.0000 173.5594 68 D 4.6024 8.7151 123.3543 54.3579 41.4383 175.6247 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 3 T 8.17 4.28 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 1.20 0.00 0.00 4 Q 8.35 4.07 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.99 0.00 0.00 0.00 0.00 0.00 2.30 2.60 0.00 5 L 9.00 4.36 0.00 1.74 1.55 0.92 0.55 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 6 M 8.13 4.18 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.40 0.00 7 G 8.07 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.13 4.06 0.00 2.25 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 0.00 2.34 2.35 0.00 9 R 7.79 4.01 0.00 1.84 1.78 0.00 2.21 0.00 0.00 3.01 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 10 I 7.83 3.74 2.13 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.89 1.07 0.00 0.00 11 R 8.36 4.20 0.00 1.93 1.95 0.00 3.17 0.00 0.00 3.28 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.53 0.00 12 A 8.16 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 R 7.86 3.91 0.00 2.19 2.15 0.00 3.36 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 14 R 8.24 4.06 0.00 2.05 2.10 0.00 3.17 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 15 K 8.35 3.93 0.00 1.95 1.87 0.00 1.75 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.72 1.62 7.81 16 K 7.81 3.95 0.00 2.01 1.91 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.53 7.81 17 L 7.66 4.14 0.00 1.79 1.72 0.98 1.16 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 18 K 7.72 3.87 0.00 1.91 1.83 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.54 7.81 19 I 7.04 4.69 1.88 0.00 0.00 0.88 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 0.67 0.94 0.00 0.00 20 R 8.25 4.26 0.00 2.05 2.11 0.00 2.96 0.00 0.00 3.33 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 21 Q 8.52 3.96 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 22 A 7.98 3.98 1.29 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 0.00 0.00 0.00 23 A 7.78 3.95 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 24 L 8.06 4.05 0.00 1.82 1.84 0.99 1.17 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 25 G 8.39 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 0.00 0.00 0.00 26 K 7.87 3.94 0.00 1.84 2.03 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.53 7.81 27 M 7.70 4.21 0.00 2.10 2.29 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 2.83 2.56 0.00 28 V 7.91 3.99 2.21 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 1.07 0.00 0.00 1.11 0.00 0.00 29 G 9.35 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 30 V 7.51 4.51 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 1.14 0.00 0.00 0.72 0.00 0.00 31 S 8.10 4.50 0.00 3.97 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 32 N 8.46 4.22 0.00 2.87 3.06 0.00 0.00 5.56 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.65 3.46 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 1.05 0.00 0.00 0.87 0.00 0.00 34 A 7.54 4.03 0.79 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 0.00 0.00 35 I 6.88 3.05 1.85 0.00 0.00 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 1.32 0.93 0.90 0.00 0.00 36 S 7.92 4.03 0.00 4.02 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 37 Q 8.11 4.00 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.53 2.47 0.00 38 W 7.95 4.74 0.00 3.54 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 39 E 8.68 4.32 0.00 2.04 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 2.43 2.72 0.00 40 R 7.76 4.44 0.00 1.91 1.97 0.00 3.30 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 41 S 7.79 3.89 0.00 4.08 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 42 E 8.52 4.11 0.00 1.94 2.14 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 2.35 2.26 0.00 43 T 7.58 4.73 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 44 E 8.32 4.60 0.00 1.87 1.70 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 2.13 2.23 0.00 45 P 0.00 3.87 0.00 1.51 0.49 0.00 3.34 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.14 0.00 46 N 8.39 4.75 0.00 3.01 3.05 0.00 0.00 6.02 6.94 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 47 G 8.48 3.57 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 0.00 0.00 0.00 48 E 8.12 3.97 0.00 2.05 1.97 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 2.40 2.42 0.00 49 N 8.95 4.45 0.00 2.81 2.94 0.00 0.00 6.67 6.35 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 50 L 8.17 3.66 0.00 1.54 1.72 0.75 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.77 3.92 0.00 1.83 1.69 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.10 4.05 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.29 4.01 0.00 1.88 1.84 1.16 0.97 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 54 S 8.30 4.15 0.00 4.32 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 0.00 55 K 8.07 3.94 0.00 2.03 1.91 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.60 7.81 56 A 7.96 4.08 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 57 L 8.00 4.34 0.00 1.68 1.77 1.01 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 8.08 3.52 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.63 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 59 C 8.21 4.69 0.00 3.01 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 60 S 8.32 4.66 0.00 4.09 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 0.00 61 P 0.00 4.25 0.00 2.16 2.10 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 62 D 8.09 4.33 0.00 2.72 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 63 Y 8.12 4.06 0.00 3.10 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 64 L 7.66 3.65 0.00 1.75 1.60 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.88 3.97 0.00 1.59 1.66 0.87 0.99 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 66 K 7.91 4.45 0.00 1.65 1.76 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.31 1.29 7.81 67 G 7.73 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.72 4.60 0.00 2.71 2.59 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