NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2896 8.2644 123.5846 51.7878 20.3134 176.4223 3 R 4.2043 7.5029 116.7623 57.9520 32.1938 176.4791 4 K 3.8224 8.3752 119.9497 59.5923 33.3676 178.2345 5 A 4.1930 8.0066 117.6751 53.5120 18.6350 177.8176 6 L 4.4832 7.8871 118.3241 57.0142 43.0227 178.4747 7 I 3.8393 7.7367 112.6300 63.4181 37.1023 176.5500 8 E 4.2229 7.9492 119.2386 56.1100 30.2813 177.0410 9 K 4.4920 7.9074 116.9834 56.7258 36.6415 176.2694 10 A 3.8660 7.2874 119.7233 53.9330 19.1223 178.9913 11 K 3.9996 7.9391 114.9111 59.3127 32.3530 177.8477 12 R 4.3209 7.5371 115.4940 55.9077 31.7151 176.3226 13 T 4.6063 7.7978 112.4438 61.5861 68.8712 171.2092 14 P 4.3339 0.0000 0.0000 63.1729 32.1631 175.9363 15 K 3.7954 7.4691 115.0893 55.2419 31.5405 174.3442 16 F 4.0348 7.9387 127.1890 56.7183 38.6910 175.1412 17 K 4.3804 8.3868 119.8922 58.1478 33.5806 179.0920 18 V 3.6777 8.1293 112.5375 64.6575 31.4406 176.9903 19 R 4.2964 8.0846 115.0939 56.3244 30.0728 175.9725 20 A 4.2524 8.4923 123.4609 51.6877 18.3235 176.9368 21 Y 4.8919 7.7393 120.3144 55.1570 41.0459 175.4234 22 T 4.0302 8.6248 112.0894 61.8120 69.3860 173.0525 23 R 4.5519 8.1000 118.1359 55.8318 32.5006 173.2659 24 C 4.3626 9.3484 126.7773 59.2559 32.2022 173.1828 25 V 4.1470 8.1925 120.9769 64.5971 32.4093 177.2151 26 R 4.0836 8.2762 117.5700 58.7465 30.0067 175.4859 27 C 4.9958 7.7319 109.1418 56.5089 32.5038 173.5535 28 G 4.0277 8.5333 108.0970 45.5759 0.0000 173.6938 29 R 3.8152 8.0232 119.4299 56.8737 30.2165 176.5434 30 A 4.0396 8.6633 126.0471 52.3050 21.0870 176.6125 31 R 4.4544 7.8535 113.4514 55.4284 32.5928 175.8629 32 S 3.4887 8.3656 111.9841 59.4573 60.2421 171.4076 33 V 4.6352 7.1793 111.3989 59.4603 34.6380 175.6514 34 Y 4.3246 8.8735 123.1433 57.1659 37.5587 176.5014 35 R 4.0311 8.9799 123.0138 59.2310 28.9745 177.0906 36 F 3.7501 8.0294 117.7884 61.4347 39.5591 175.7514 37 F 4.2319 9.0174 121.1378 59.5215 39.2365 176.9761 38 G 4.0680 9.5352 107.8247 45.1549 0.0000 172.4507 39 L 4.7940 7.6791 118.9394 52.3784 44.6551 176.1372 40 C 4.9794 8.5544 118.2295 57.4089 31.9760 174.5221 41 R 4.1478 8.5545 116.2949 59.3423 29.0530 178.2213 42 I 3.8737 7.7486 120.9049 63.8461 37.2598 177.3052 43 C 3.8958 8.0388 116.7239 63.1190 28.1288 175.8823 44 L 3.6908 7.7354 121.4307 58.3255 41.3704 179.1905 45 R 3.7402 7.5635 118.2701 59.5363 29.7043 178.2298 46 E 4.0142 8.5617 118.7912 59.2709 29.2794 179.5526 47 L 3.9688 8.1997 118.9949 57.8361 41.7028 179.1289 48 A 3.8982 7.5521 119.0287 55.3616 18.1549 179.1253 49 H 4.3734 7.6389 114.1290 58.8833 29.0669 177.7684 50 K 4.1314 7.4777 118.6453 57.8227 32.1553 178.3332 51 G 4.0169 8.5090 107.4386 45.3357 0.0000 175.0681 52 Q 4.0084 7.8932 115.0143 56.5426 28.2435 175.5122 53 L 4.7113 7.6092 119.1890 51.9716 43.3518 174.8102 54 P 4.1466 0.0000 0.0000 64.2003 31.5964 176.8026 55 G 3.9473 8.8240 109.2148 46.1362 0.0000 173.1420 56 V 4.1335 7.3708 118.4181 61.9284 32.6567 175.1501 57 R 4.3780 7.8077 121.8797 54.9817 32.5424 174.2161 58 K 3.8735 8.7115 125.2685 56.2750 32.4107 176.8636 59 A 4.2675 8.6223 129.7232 52.6501 19.2188 176.0804 60 S 5.1792 8.5874 112.3885 58.4914 63.9725 177.1273 61 W 4.7609 8.2486 124.1845 56.7875 27.5974 174.7206 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 4.29 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 7.50 4.20 0.00 1.93 1.87 0.00 3.20 0.00 0.00 3.32 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 4 K 8.38 3.82 0.00 1.88 1.79 0.00 1.67 0.00 0.00 1.83 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.51 7.81 5 A 8.01 4.19 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 6 L 7.89 4.48 0.00 1.90 1.78 1.03 1.10 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 7 I 7.74 3.84 1.88 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 1.77 0.51 0.95 0.00 0.00 8 E 7.95 4.22 0.00 1.97 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 2.54 2.31 0.00 9 K 7.91 4.49 0.00 1.71 1.92 0.00 1.86 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.40 7.81 10 A 7.29 3.87 1.07 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 0.00 0.00 11 K 7.94 4.00 0.00 1.72 1.84 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.71 1.38 7.81 12 R 7.54 4.32 0.00 1.76 1.85 0.00 3.12 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 13 T 7.80 4.61 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 1.20 0.00 0.00 14 P 0.00 4.33 0.00 2.09 2.06 0.00 3.86 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 15 K 7.47 3.80 0.00 1.16 0.74 0.00 1.73 0.00 0.00 1.46 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.93 1.21 7.81 16 F 7.94 4.03 0.00 3.26 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 17 K 8.39 4.38 0.00 1.97 2.10 0.00 1.56 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 18 V 8.13 3.68 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 0.74 0.00 0.00 1.03 0.00 0.00 19 R 8.08 4.30 0.00 1.93 2.12 0.00 3.36 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 1.76 1.84 0.00 20 A 8.49 4.25 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 21 Y 7.74 4.89 0.00 3.04 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 22 T 8.62 4.03 4.31 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 1.26 0.00 0.00 23 R 8.10 4.55 0.00 1.78 1.81 0.00 3.59 0.00 0.00 3.32 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.53 0.00 24 C 9.35 4.36 0.00 2.95 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 25 V 8.19 4.15 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 0.90 0.00 0.00 1.04 0.00 0.00 26 R 8.28 4.08 0.00 1.86 2.00 0.00 3.21 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 27 C 7.73 5.00 0.00 3.04 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 28 G 8.53 4.03 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 0.00 0.00 0.00 29 R 8.02 3.82 0.00 1.94 1.91 0.00 3.22 0.00 0.00 3.37 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.88 0.00 30 A 8.66 4.04 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 31 R 7.85 4.45 0.00 1.81 1.86 0.00 3.36 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 32 S 8.37 3.49 0.00 3.95 3.82 0.00 0.00 0.00 0.00 0.00 0.00 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 7.18 4.64 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 0.98 0.00 0.00 0.98 0.00 0.00 34 Y 8.87 4.32 0.00 3.36 3.16 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 35 R 8.98 4.03 0.00 1.96 2.17 0.00 3.13 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 36 F 8.03 3.75 0.00 3.08 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 37 F 9.02 4.23 0.00 3.24 3.20 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 38 G 9.54 4.07 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 0.00 0.00 0.00 39 L 7.68 4.79 0.00 1.74 1.58 0.95 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 40 C 8.55 4.98 0.00 3.22 3.16 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 41 R 8.55 4.15 0.00 2.21 2.46 0.00 3.04 0.00 0.00 3.39 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.84 0.00 42 I 7.75 3.87 1.89 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 1.67 0.88 0.92 0.00 0.00 43 C 8.04 3.90 0.00 2.97 3.02 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 44 L 7.74 3.69 0.00 1.62 1.80 0.16 0.29 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 45 R 7.56 3.74 0.00 1.95 2.00 0.00 3.17 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 46 E 8.56 4.01 0.00 2.14 2.00 0.00 0.00 0.00 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 2.37 0.00 47 L 8.20 3.97 0.00 1.60 1.67 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.55 3.90 1.18 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 0.00 0.00 49 H 7.64 4.37 0.00 3.32 3.33 0.00 5.67 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.48 4.13 0.00 1.89 1.89 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.68 7.81 51 G 8.51 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 0.00 0.00 0.00 52 Q 7.89 4.01 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.70 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 53 L 7.61 4.71 0.00 1.60 1.63 0.58 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.15 0.00 2.26 2.05 0.00 3.93 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.16 0.00 55 G 8.82 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 56 V 7.37 4.13 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 0.71 0.00 0.00 1.21 0.00 0.00 57 R 7.81 4.38 0.00 1.75 1.72 0.00 3.31 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.55 0.00 58 K 8.71 3.87 0.00 1.74 1.73 0.00 1.87 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.38 7.81 59 A 8.62 4.27 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.59 5.18 0.00 3.90 3.89 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 61 W 8.25 4.76 0.00 3.37 3.04 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 0.00 0.00 0.00