NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1284 8.0093 114.2680 60.1148 38.9097 174.9652 2 E 3.6718 8.5134 120.1297 55.8060 29.8237 175.2832 3 A 4.1601 9.1940 127.9268 51.1123 19.0858 178.1068 4 I 4.0688 8.0274 123.9263 61.6485 37.8257 176.0850 5 R 4.7556 8.7288 126.7398 55.5334 30.9741 175.3877 6 C 4.8326 8.4656 116.3891 54.0513 44.0593 174.4209 7 G 3.4736 9.0061 111.4963 47.6481 0.0000 172.9841 8 G 4.1305 7.4420 107.5735 43.0483 0.0000 173.6191 9 S 4.0736 8.4312 113.4257 61.2178 63.1448 176.3926 10 R 2.5100 7.4747 120.4326 57.5558 29.6437 177.3959 11 D 4.5651 7.2850 116.6549 55.2425 41.4393 176.5417 12 C 4.7145 7.6915 116.8127 57.5016 39.5043 175.4547 13 Y 4.3591 7.1469 118.1123 61.1951 37.5081 177.9209 14 R 3.9772 8.2284 119.2430 59.1405 30.0690 176.3808 15 P 4.2213 0.0000 0.0000 66.4085 31.4135 179.0891 16 C 4.4550 8.2910 117.1979 59.2294 36.0444 175.9534 17 Q 4.3968 8.7688 123.1312 58.4712 28.4129 178.0842 18 K 3.9988 7.9624 120.0451 59.2925 32.2883 178.9732 19 R 4.0662 8.3742 118.2383 59.1932 30.2074 178.2376 20 T 4.3290 8.3415 107.5832 64.4517 69.8438 174.7509 21 G 3.7201 7.0246 109.4319 45.0462 0.0000 173.1046 22 C 5.0429 8.3413 117.8811 54.5040 43.6968 172.8066 23 P 4.3869 0.0000 0.0000 63.2364 31.4999 175.2611 24 N 4.4817 7.9903 117.3124 54.6937 39.1341 173.4883 25 A 5.2737 8.5756 123.7454 50.7139 22.9005 174.9841 26 K 4.5053 8.8619 118.6640 54.7277 35.2306 175.8151 27 C 4.8985 8.8423 126.6390 55.1778 42.1772 171.3289 28 I 4.5073 8.3408 122.1549 59.7002 40.0757 175.1371 29 N 4.3427 9.3983 122.2847 54.2340 35.5627 174.3854 30 K 3.9587 8.2644 113.9295 57.3464 30.0370 174.7628 31 T 4.9778 7.8681 108.3793 59.9095 72.2116 172.3378 32 C 4.5786 9.3508 123.1677 57.1357 42.0662 173.7762 33 K 4.2102 9.2494 127.9274 54.9883 31.8746 174.3079 34 C 4.9025 8.3160 123.7851 56.5217 39.7442 173.1183 35 Y 4.3959 9.4258 121.2488 58.0117 40.4652 176.4893 36 G 3.8659 8.1268 108.1325 47.2235 0.0000 176.0535 37 C 4.9951 8.4457 111.3488 55.4875 40.1644 174.0501 38 S 4.3304 8.0694 118.5813 58.7627 62.3308 174.7169 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 1 I 8.01 4.13 1.85 0.00 0.00 0.83 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 1.10 0.89 0.00 0.00 2 E 8.51 3.67 0.00 2.17 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 2.26 2.30 0.00 3 A 9.19 4.16 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 4 I 8.03 4.07 1.85 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 1.33 0.50 0.90 0.00 0.00 5 R 8.73 4.76 0.00 1.68 1.84 0.00 3.36 0.00 0.00 3.47 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.40 0.00 6 C 8.47 4.83 0.00 3.09 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 7 G 9.01 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 G 7.44 4.13 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 0.00 0.00 0.00 9 S 8.43 4.07 0.00 4.05 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 10 R 7.47 2.51 0.00 1.67 1.82 0.00 3.15 0.00 0.00 3.36 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.56 0.00 11 D 7.29 4.57 0.00 2.87 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.69 4.71 0.00 3.11 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 13 Y 7.15 4.36 0.00 3.07 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 14 R 8.23 3.98 0.00 1.88 1.96 0.00 3.36 0.00 0.00 3.40 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 15 P 0.00 4.22 0.00 2.31 2.29 0.00 3.70 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 2.27 2.06 0.00 16 C 8.29 4.45 0.00 3.15 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 17 Q 8.77 4.40 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.19 0.00 18 K 7.96 4.00 0.00 1.93 2.02 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.53 7.81 19 R 8.37 4.07 0.00 1.78 1.97 0.00 3.20 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 20 T 8.34 4.33 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 1.25 0.00 0.00 21 G 7.02 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.34 5.04 0.00 2.91 3.09 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.39 0.00 1.53 2.00 0.00 3.70 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 1.68 1.74 0.00 24 N 7.99 4.48 0.00 3.05 2.94 0.00 0.00 6.74 7.52 0.00 0.00 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 A 8.58 5.27 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.86 4.51 0.00 1.81 1.77 0.00 2.01 0.00 0.00 1.70 0.00 0.00 2.76 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.59 7.81 27 C 8.84 4.90 0.00 3.05 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 28 I 8.34 4.51 1.90 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 1.32 1.45 0.99 0.00 0.00 29 N 9.40 4.34 0.00 2.91 2.88 0.00 0.00 7.03 7.62 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 30 K 8.26 3.96 0.00 1.94 1.87 0.00 1.61 0.00 0.00 1.99 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.34 7.81 31 T 7.87 4.98 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 1.25 0.00 0.00 32 C 9.35 4.58 0.00 2.81 3.09 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.25 4.21 0.00 1.71 1.66 0.00 0.76 0.00 0.00 1.12 0.00 0.00 2.38 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.24 1.49 7.81 34 C 8.32 4.90 0.00 2.93 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 35 Y 9.43 4.40 0.00 3.06 2.94 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 36 G 8.13 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 37 C 8.45 5.00 0.00 2.94 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 38 S 8.07 4.33 0.00 3.80 3.81 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