NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.3125 8.3645 123.5824 50.5436 21.0920 177.8731 1 N 4.8151 7.6400 113.6944 50.8152 38.9478 175.8139 2 Q 4.3335 8.4987 121.8840 56.3804 30.4448 175.7862 3 A 4.7898 8.6251 126.4376 50.8348 21.2352 176.0186 4 S 5.1945 8.9572 117.6746 56.3843 66.9147 173.5026 5 V 4.2979 8.2183 121.9190 62.8068 32.3271 174.9842 6 V 4.8264 8.5816 127.4480 60.6005 35.0099 174.3436 7 A 4.4535 8.7306 129.1841 52.3171 18.5543 177.6131 8 N 4.6548 9.2650 122.3139 55.7823 39.6667 174.1361 9 Q 4.5983 7.5435 114.3236 55.1958 31.9884 173.4684 10 L 4.3313 8.4284 121.7216 55.1736 43.0256 175.8997 11 I 4.3763 8.7379 127.7524 59.0271 38.5762 173.7812 12 P 4.6696 0.0000 0.0000 62.0687 32.0086 176.4326 13 I 3.7022 8.3882 121.8475 61.7511 39.3929 175.5407 14 S 4.0442 8.0625 120.6392 60.0051 60.9592 172.3223 15 T 4.7378 7.2003 114.9697 61.4593 71.3802 173.7885 16 A 4.5426 8.5798 128.0031 51.4868 19.4395 177.2277 17 L 4.2328 8.7711 123.6662 55.1094 42.9135 176.5673 18 T 4.9034 8.3323 112.5318 59.4796 71.6467 174.9435 19 L 4.0331 8.6215 122.1073 58.0759 41.8308 180.0496 20 V 3.7920 7.6728 110.1482 63.7281 31.8613 176.9929 21 M 4.2967 8.1743 119.5296 56.9025 32.1514 175.5762 22 M 5.3332 7.6729 115.7517 53.5076 34.3544 175.2074 23 R 4.6003 8.9369 119.5623 54.7170 33.0077 174.3279 24 S 5.1866 8.2527 113.1584 56.7426 64.6760 172.5403 25 E 4.6757 8.7669 125.3538 55.1576 33.6034 174.3031 26 V 4.5432 8.3938 125.7979 62.2239 31.6956 175.3215 27 V 4.5850 8.2844 120.2153 59.6546 35.0964 175.3937 28 T 4.6236 8.0583 116.9165 60.9090 71.6449 172.7670 29 P 4.4311 0.0000 0.0000 62.3535 32.1010 176.2262 30 V 3.8555 8.1624 119.3879 62.8869 32.6031 176.0114 31 G 4.4326 8.4617 114.1545 44.9364 0.0000 172.1174 32 I 3.8854 8.1038 122.3983 61.1393 38.2415 174.2169 33 P 4.7234 0.0000 0.0000 62.9992 31.6779 177.4004 34 A 3.9787 9.1544 126.3817 54.9534 18.5673 179.4493 35 E 4.0019 8.2851 113.0315 59.5084 29.6577 178.0561 36 D 4.7834 8.4651 118.3808 54.3629 40.7467 178.1304 37 I 3.7233 7.7669 123.5991 63.9351 36.8994 176.1815 38 P 4.2391 0.0000 0.0000 66.3102 30.7735 177.9700 39 R 4.0706 7.8556 116.8101 59.0683 30.3899 178.0123 40 L 4.3209 8.0756 118.6797 55.8854 41.3734 176.9007 41 V 3.8063 6.8267 118.5516 65.2341 31.3685 176.1347 42 S 4.3766 9.0534 123.7006 58.4158 61.7671 169.3752 43 M 4.5172 8.2754 121.0587 55.4241 33.2388 175.5118 44 T 5.2261 8.6350 110.7998 59.4058 71.9681 173.7243 45 V 4.6518 8.2000 122.3567 60.9362 33.6150 175.7724 46 N 5.0940 9.0719 119.5551 52.8255 38.4538 174.0194 47 R 4.7210 7.5918 114.3074 54.6103 32.8582 174.4793 48 A 4.2760 8.5836 122.1315 52.0841 19.4703 177.2094 49 V 4.3164 8.7840 122.9695 60.1693 33.5971 173.5248 50 P 4.7123 0.0000 0.0000 62.0777 32.8746 175.5786 51 L 4.0655 8.3112 122.7658 56.8186 42.1836 177.3754 52 G 3.9818 8.8680 114.8176 45.2695 0.0000 173.5071 53 T 4.1501 7.6702 117.5490 63.6033 69.6763 174.0764 54 T 4.4905 8.3615 122.6241 63.2522 69.7173 174.2580 55 L 4.2001 8.8610 127.1056 54.7207 42.7721 176.4240 56 M 4.6292 8.4682 123.6089 53.0454 34.2891 175.1934 57 P 3.8903 0.0000 0.0000 65.9048 31.4652 178.2565 58 D 4.5998 8.0863 113.9102 55.2393 39.3425 176.5094 59 M 4.5063 8.0459 119.1151 54.9865 32.9575 175.5535 60 V 4.6018 7.4456 119.4601 60.4738 33.0152 174.9529 61 K 4.1121 8.9724 128.2586 57.6914 32.3264 177.7153 62 G 3.8998 8.9403 111.9596 45.3294 0.0000 172.6527 63 Y 3.9751 7.5253 120.9429 57.3444 38.5256 175.0935 64 A 4.2408 7.9437 130.0336 50.5727 21.3454 175.3092 65 A 4.0840 8.0758 124.5056 52.6196 19.2842 175.6723 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 0 A 8.36 4.31 1.27 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 0.00 0.00 1 N 7.64 4.82 0.00 2.81 2.67 0.00 0.00 6.68 6.57 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 2 Q 8.50 4.33 0.00 1.93 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 3 A 8.63 4.79 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.96 5.19 0.00 3.71 3.73 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 5 V 8.22 4.30 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 1.01 0.00 0.00 0.92 0.00 0.00 6 V 8.58 4.83 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 1.08 0.00 0.00 0.97 0.00 0.00 7 A 8.73 4.45 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.27 4.65 0.00 2.72 3.05 0.00 0.00 7.05 6.70 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 9 Q 7.54 4.60 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.70 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 10 L 8.43 4.33 0.00 1.66 1.61 0.92 0.96 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 11 I 8.74 4.38 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.69 0.90 0.00 0.00 12 P 0.00 4.67 0.00 1.93 1.98 0.00 3.68 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 2.08 0.00 13 I 8.39 3.70 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.35 0.91 0.00 0.00 14 S 8.06 4.04 0.00 4.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 T 7.20 4.74 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 16 A 8.58 4.54 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.77 4.23 0.00 1.81 1.61 0.97 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.33 4.90 4.24 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 1.23 0.00 0.00 19 L 8.62 4.03 0.00 1.73 1.77 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.67 3.79 2.08 0.00 0.00 0.00 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 0.93 0.00 0.00 21 M 8.17 4.30 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.47 0.00 22 M 7.67 5.33 0.00 1.96 1.96 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 2.48 2.46 0.00 23 R 8.94 4.60 0.00 1.88 2.10 0.00 2.71 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.54 0.00 24 S 8.25 5.19 0.00 3.87 3.75 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 0.00 0.00 0.00 25 E 8.77 4.68 0.00 2.06 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 2.21 2.24 0.00 26 V 8.39 4.54 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.93 0.00 0.00 27 V 8.28 4.59 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 0.80 0.00 0.00 0.92 0.00 0.00 28 T 8.06 4.62 4.24 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 1.21 0.00 0.00 29 P 0.00 4.43 0.00 2.17 2.05 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 30 V 8.16 3.86 2.08 0.00 0.00 0.00 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 0.93 0.00 0.00 31 G 8.46 4.43 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 0.00 0.00 0.00 32 I 8.10 3.89 1.77 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.53 0.77 0.00 0.00 33 P 0.00 4.72 0.00 2.14 2.22 0.00 3.79 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.05 0.00 34 A 9.15 3.98 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 35 E 8.29 4.00 0.00 2.10 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 0.00 2.31 2.38 0.00 36 D 8.47 4.78 0.00 2.91 2.87 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 37 I 7.77 3.72 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.14 0.92 0.00 0.00 38 P 0.00 4.24 0.00 2.23 2.22 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.06 0.00 39 R 7.86 4.07 0.00 1.86 2.31 0.00 3.25 0.00 0.00 3.42 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 40 L 8.08 4.32 0.00 1.89 1.72 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 41 V 6.83 3.81 2.24 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 0.76 0.00 0.00 0.99 0.00 0.00 42 S 9.05 4.38 0.00 4.02 4.19 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 0.00 0.00 0.00 0.00 43 M 8.28 4.52 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.52 0.00 44 T 8.64 5.23 4.25 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 1.22 0.00 0.00 45 V 8.20 4.65 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 0.90 0.00 0.00 0.96 0.00 0.00 46 N 9.07 5.09 0.00 2.84 3.07 0.00 0.00 6.54 8.44 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 47 R 7.59 4.72 0.00 1.77 1.88 0.00 3.02 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.62 0.00 48 A 8.58 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 49 V 8.78 4.32 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 0.98 0.00 0.00 0.91 0.00 0.00 50 P 0.00 4.71 0.00 2.14 2.16 0.00 3.78 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 2.06 1.96 0.00 51 L 8.31 4.07 0.00 1.60 1.63 1.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.87 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 53 T 7.67 4.15 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 1.19 0.00 0.00 54 T 8.36 4.49 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 1.24 0.00 0.00 55 L 8.86 4.20 0.00 1.55 1.48 0.89 0.99 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 56 M 8.47 4.63 0.00 2.12 1.92 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.61 0.00 57 P 0.00 3.89 0.00 2.21 2.33 0.00 3.56 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.06 0.00 58 D 8.09 4.60 0.00 2.79 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 59 M 8.05 4.51 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.39 0.00 60 V 7.45 4.60 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.83 0.00 0.00 61 K 8.97 4.11 0.00 1.75 1.75 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.49 7.81 62 G 8.94 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.53 3.98 0.00 2.87 3.01 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 A 7.94 4.24 1.11 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 0.00 0.00 65 A 8.08 4.08 0.96 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 0.00 0.00