NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 52 S 4.8389 8.4287 114.6821 58.3671 64.7830 175.4789 53 A 3.7353 8.0146 123.1323 54.6458 17.8892 177.1835 54 R 4.3445 8.5899 113.8072 57.0627 32.1129 176.6117 55 D 4.3469 8.1924 119.4956 57.5348 40.8101 178.6523 56 I 3.7571 7.5538 119.7604 64.6930 37.1374 178.1041 57 H 4.6028 7.9635 116.7446 58.8080 28.4852 177.9590 58 Q 3.9909 7.8302 119.4376 58.9330 28.5021 178.7173 59 L 3.9901 7.9183 119.9491 57.8064 41.5916 179.3989 60 E 3.9298 8.6987 118.6385 59.4175 29.4394 179.1257 61 A 4.0051 8.2334 120.9064 55.4778 18.3935 179.9880 62 R 3.9022 7.9737 116.2752 59.3809 30.0921 179.4037 63 I 3.7381 8.0498 119.8796 64.3806 37.0740 178.0641 64 D 4.3766 8.4484 120.1954 57.4778 40.6453 178.8867 65 S 4.0818 8.0491 113.4294 61.4249 62.4264 176.2062 66 L 3.9747 7.9805 121.4445 57.8201 41.3804 179.4300 67 A 4.1150 8.5227 120.9329 55.0015 18.2396 179.5794 68 A 3.9813 8.2364 119.5164 55.2815 18.3299 180.1585 69 R 3.8498 8.0410 116.7420 59.2134 30.1682 178.4052 70 N 4.2281 8.6133 117.3396 57.1822 38.7854 177.0342 71 S 4.1366 8.1703 116.1634 61.3098 62.8928 176.4860 72 K 3.8846 8.2249 122.4368 59.4739 31.8879 178.7534 73 L 3.9590 8.1760 119.4248 58.1117 41.5476 179.2289 74 M 4.0475 8.1118 117.9941 58.6587 32.1596 178.0962 75 E 3.9586 8.4273 118.9018 59.7512 29.6368 179.5056 76 T 4.0472 7.9611 115.7558 66.6403 68.4519 176.7893 77 L 4.0169 8.3719 121.3621 57.7203 41.7441 179.6832 78 K 3.9645 8.2900 118.5649 59.5166 31.9427 179.2509 79 E 4.1391 8.2646 118.6693 59.2608 29.2842 179.1931 80 A 3.9740 8.0265 120.9120 55.0601 18.4371 179.5279 81 R 3.8209 8.1595 117.2720 59.7865 30.1617 178.6904 82 Q 4.0041 7.9183 117.2208 59.2430 28.6874 179.0292 83 Q 4.0408 8.1315 119.0006 58.7860 28.6479 178.6620 84 L 3.9914 8.3114 120.5261 57.7559 41.7761 179.5131 85 L 3.9561 8.1257 118.7161 57.8082 41.4793 179.5034 86 A 4.0195 8.0921 120.7351 54.9172 18.2586 179.4229 87 L 3.8678 8.1320 119.0645 58.3490 42.3032 179.2281 88 R 3.8975 8.2584 118.7982 59.4305 29.9350 178.3959 89 E 4.0354 8.0760 118.2163 59.2036 29.2316 179.0865 90 E 3.9548 8.2607 118.2397 59.3070 29.8205 179.0979 91 V 3.7365 7.9508 118.3448 66.1922 31.3401 177.8298 92 D 4.3510 7.7985 117.0770 57.4356 40.7735 178.5808 93 R 4.0044 7.9076 117.4929 58.5893 30.1109 177.1963 94 L 4.4279 7.6387 122.7051 54.7101 42.0664 175.9801 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 52 S 8.43 4.84 0.00 3.86 3.91 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 53 A 8.01 3.74 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 54 R 8.59 4.34 0.00 1.88 1.96 0.00 3.15 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 1.72 0.00 55 D 8.19 4.35 0.00 2.90 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.55 3.76 1.90 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.39 0.91 0.00 0.00 57 H 7.96 4.60 0.00 3.21 3.31 0.00 5.62 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 7.83 3.99 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.60 2.55 0.00 59 L 7.92 3.99 0.00 1.85 1.72 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.70 3.93 0.00 2.14 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 2.35 2.47 0.00 61 A 8.23 4.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 7.97 3.90 0.00 2.13 1.99 0.00 3.30 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 63 I 8.05 3.74 1.99 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 1.52 0.70 0.91 0.00 0.00 64 D 8.45 4.38 0.00 2.82 2.72 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 65 S 8.05 4.08 0.00 3.91 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 66 L 7.98 3.97 0.00 1.91 1.70 0.92 0.87 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 67 A 8.52 4.11 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.24 3.98 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 69 R 8.04 3.85 0.00 2.01 1.99 0.00 3.15 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 70 N 8.61 4.23 0.00 2.70 3.00 0.00 0.00 7.25 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.17 4.14 0.00 4.04 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 72 K 8.22 3.88 0.00 1.82 1.98 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.49 7.81 73 L 8.18 3.96 0.00 1.89 1.70 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 74 M 8.11 4.05 0.00 2.14 2.06 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 2.60 2.63 0.00 75 E 8.43 3.96 0.00 2.13 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 0.00 2.33 2.49 0.00 76 T 7.96 4.05 4.37 0.00 0.00 0.00 0.00 0.00 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 77 L 8.37 4.02 0.00 1.82 1.71 0.92 0.89 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 78 K 8.29 3.96 0.00 1.99 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.55 7.81 79 E 8.26 4.14 0.00 2.19 1.99 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 2.33 2.56 0.00 80 A 8.03 3.97 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 81 R 8.16 3.82 0.00 1.89 2.10 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 82 Q 7.92 4.00 0.00 2.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.59 0.00 83 Q 8.13 4.04 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 84 L 8.31 3.99 0.00 1.83 1.72 0.92 0.51 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 85 L 8.13 3.96 0.00 1.84 1.72 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.09 4.02 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 87 L 8.13 3.87 0.00 1.90 1.88 0.92 0.70 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 88 R 8.26 3.90 0.00 1.91 2.04 0.00 3.14 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 89 E 8.08 4.04 0.00 2.09 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 0.00 2.33 2.60 0.00 90 E 8.26 3.95 0.00 2.15 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 2.31 0.00 91 V 7.95 3.74 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 1.03 0.00 0.00 0.98 0.00 0.00 92 D 7.80 4.35 0.00 2.87 2.72 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 93 R 7.91 4.00 0.00 2.00 2.03 0.00 3.18 0.00 0.00 3.22 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 94 L 7.64 4.43 0.00 1.72 1.55 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00