NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3581 8.2649 123.5881 52.0327 19.7611 175.8652 3 R 4.4796 7.3545 121.6144 52.9445 33.0162 176.0276 4 K 3.8560 9.2518 124.8048 59.8320 33.2941 178.0731 5 A 3.9138 8.2393 119.5466 55.5332 18.1066 178.1606 6 L 4.5045 8.3058 112.9205 55.1158 42.0215 177.9296 7 I 4.4659 8.1720 120.3503 60.4563 36.5995 175.7175 8 E 4.4767 7.6346 116.4268 55.8655 30.7371 178.2996 9 K 3.5290 7.8395 121.3172 59.5202 32.3314 177.4809 10 A 4.1116 7.7882 120.1273 53.6734 18.4529 178.5510 11 K 4.1483 7.9307 114.4505 56.4663 32.6302 178.8835 12 R 3.6443 7.1338 118.0408 56.8092 29.8854 179.5556 13 T 3.5966 7.4034 117.5130 64.9916 65.2346 171.3786 14 P 4.3904 0.0000 0.0000 62.6245 32.7004 179.3459 15 K 3.7403 8.7108 122.2400 57.1231 32.5427 175.9283 16 F 4.7920 8.9169 117.4931 56.0023 43.0919 174.9713 17 K 4.2847 8.8843 123.3644 58.3314 32.2472 177.9024 18 V 3.9630 7.6997 112.5286 63.1596 31.9697 176.7800 19 R 4.3833 7.8688 117.2334 56.1527 30.0435 176.3748 20 A 4.3104 7.7961 121.7461 51.9801 19.2635 177.4526 21 Y 4.5563 8.4243 119.6078 57.8288 39.0588 177.3097 22 T 2.9223 7.5687 112.6496 58.2998 72.5124 169.6059 23 R 3.9785 7.9301 128.6217 54.2730 30.4653 175.9402 24 C 4.5474 8.2918 121.3440 59.5008 32.2083 173.7038 25 V 4.0866 8.4820 126.4548 61.4949 31.6459 176.1609 26 R 4.7465 7.7532 120.4342 58.0675 36.3458 174.7088 27 C 4.6913 7.9573 108.8320 56.6031 30.9829 174.8853 28 G 3.9471 7.9869 107.2255 45.1918 0.0000 173.6812 29 R 4.1230 7.7455 121.0984 56.0423 28.3697 176.1157 30 A 4.2752 8.3200 125.0929 54.6069 18.9354 179.2017 31 R 4.0690 7.2544 112.6483 59.7109 30.8739 177.3347 32 S 4.7760 7.6009 112.3795 56.8025 62.4002 175.2185 33 V 4.4897 7.8254 113.1851 62.4178 32.5734 177.4335 34 Y 4.2734 9.6158 124.3186 57.9585 39.2134 177.1670 35 R 3.9160 8.9266 122.2169 59.5123 30.5537 178.8614 36 F 3.9883 8.3332 118.1903 60.3066 39.4293 175.5588 37 F 4.9459 8.3987 116.5061 56.6988 41.3137 176.9777 38 G 4.1559 8.5705 107.7721 45.3088 0.0000 173.0276 39 L 4.8868 7.4985 118.6877 53.1675 43.6446 175.8945 40 C 4.9846 8.2604 115.8321 57.0312 30.7973 174.5341 41 R 3.7960 8.5027 117.7232 60.1920 28.4609 178.7164 42 I 3.7971 7.7070 119.8064 64.1028 37.3451 177.5638 43 C 4.1401 7.9993 116.7273 62.9893 28.0998 175.8010 44 L 3.5834 7.9535 121.8132 58.3163 41.2972 179.2131 45 R 3.7210 7.1676 116.1872 59.1428 30.1526 177.9974 46 E 4.1100 8.4325 118.7990 59.6059 29.5565 179.4341 47 L 3.9505 8.3159 119.0396 57.6773 41.4144 179.4427 48 A 3.9238 7.6894 119.8734 55.3981 18.2708 179.0999 49 H 4.4285 7.6005 114.0229 58.7032 28.8253 177.7352 50 K 4.2141 7.8044 119.5082 58.1874 32.4745 177.8991 51 G 4.1115 8.1806 105.8437 45.5506 0.0000 174.5176 52 Q 4.1601 7.9043 116.6177 56.2427 29.0245 176.2859 53 L 4.4906 7.2603 119.9623 51.3549 41.3271 172.4594 54 P 4.2757 0.0000 0.0000 63.8318 30.9342 176.5523 55 G 3.9690 8.8446 112.0050 46.6838 0.0000 173.9018 56 V 4.1912 7.5121 120.1049 60.6569 30.6242 174.8330 57 R 4.2949 7.7614 124.4634 54.6429 31.7610 175.0834 58 K 4.2894 8.2961 118.4184 55.2020 32.8504 177.2366 59 A 4.4075 8.5239 126.4439 51.5141 19.3486 176.5117 60 S 5.1234 8.4901 115.6647 58.1651 64.7837 177.1558 61 W 4.2746 8.3030 123.2604 57.3872 27.1945 174.0586 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 4.36 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 3 R 7.35 4.48 0.00 1.97 1.84 0.00 3.19 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 4 K 9.25 3.86 0.00 1.82 1.90 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.50 7.81 5 A 8.24 3.91 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 8.31 4.50 0.00 1.77 1.79 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.17 4.47 1.96 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 1.39 0.96 0.90 0.00 0.00 8 E 7.63 4.48 0.00 2.14 2.33 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 2.33 2.31 0.00 9 K 7.84 3.53 0.00 0.99 1.59 0.00 1.61 0.00 0.00 1.52 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.74 0.77 7.81 10 A 7.79 4.11 1.26 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 0.00 0.00 0.00 11 K 7.93 4.15 0.00 1.95 1.85 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.44 7.81 12 R 7.13 3.64 0.00 1.86 1.77 0.00 3.32 0.00 0.00 3.20 7.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 13 T 7.40 3.60 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 1.17 0.00 0.00 14 P 0.00 4.39 0.00 2.53 2.37 0.00 3.75 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 2.10 1.95 0.00 15 K 8.71 3.74 0.00 1.77 1.46 0.00 1.83 0.00 0.00 1.88 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.56 1.18 7.81 16 F 8.92 4.79 0.00 2.96 2.90 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 17 K 8.88 4.28 0.00 1.89 1.96 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.52 7.81 18 V 7.70 3.96 2.11 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 0.76 0.00 0.00 0.97 0.00 0.00 19 R 7.87 4.38 0.00 1.98 2.10 0.00 3.59 0.00 0.00 3.36 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 20 A 7.80 4.31 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 21 Y 8.42 4.56 0.00 3.04 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 22 T 7.57 2.92 4.32 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 1.26 0.00 0.00 23 R 7.93 3.98 0.00 1.96 2.01 0.00 3.48 0.00 0.00 3.43 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.42 0.00 24 C 8.29 4.55 0.00 3.19 2.96 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 25 V 8.48 4.09 2.11 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 0.79 0.00 0.00 0.95 0.00 0.00 26 R 7.75 4.75 0.00 1.76 1.93 0.00 3.17 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 27 C 7.96 4.69 0.00 3.07 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 28 G 7.99 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.75 4.12 0.00 1.93 1.92 0.00 3.27 0.00 0.00 3.37 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 30 A 8.32 4.28 1.40 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 0.00 0.00 0.00 31 R 7.25 4.07 0.00 1.78 2.02 0.00 3.33 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 32 S 7.60 4.78 0.00 3.99 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 33 V 7.83 4.49 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 0.89 0.00 0.00 1.05 0.00 0.00 34 Y 9.62 4.27 0.00 3.20 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 35 R 8.93 3.92 0.00 1.94 2.01 0.00 3.17 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.64 0.00 36 F 8.33 3.99 0.00 2.85 2.68 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 0.00 0.00 0.00 0.00 37 F 8.40 4.95 0.00 3.35 2.99 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 38 G 8.57 4.16 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 0.00 0.00 0.00 39 L 7.50 4.89 0.00 1.81 1.57 0.82 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.26 4.98 0.00 3.18 3.22 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 41 R 8.50 3.80 0.00 2.18 2.48 0.00 2.80 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.75 0.00 42 I 7.71 3.80 1.87 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 1.65 0.53 0.91 0.00 0.00 43 C 8.00 4.14 0.00 2.94 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 L 7.95 3.58 0.00 1.43 1.64 0.45 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.17 3.72 0.00 1.87 2.08 0.00 3.31 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 46 E 8.43 4.11 0.00 2.09 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 2.32 2.48 0.00 47 L 8.32 3.95 0.00 1.55 1.63 0.86 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.69 3.92 1.20 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 49 H 7.60 4.43 0.00 3.31 3.32 0.00 5.66 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.80 4.21 0.00 1.84 1.86 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.68 7.81 51 G 8.18 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 0.00 0.00 0.00 52 Q 7.90 4.16 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 7.01 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 53 L 7.26 4.49 0.00 1.75 1.59 0.23 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.28 0.00 2.23 2.18 0.00 4.03 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 55 G 8.84 3.97 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 0.00 0.00 0.00 56 V 7.51 4.19 2.18 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 0.79 0.00 0.00 1.16 0.00 0.00 57 R 7.76 4.29 0.00 1.83 1.86 0.00 3.29 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 58 K 8.30 4.29 0.00 1.82 1.77 0.00 1.85 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.40 7.81 59 A 8.52 4.41 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.49 5.12 0.00 3.93 3.86 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 0.00 0.00 0.00 61 W 8.30 4.27 0.00 3.36 3.03 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 0.00 0.00 0.00