NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 W 4.6982 8.2593 120.6119 57.0330 30.4630 173.9178 20 S 4.4579 8.2844 114.4836 56.6782 65.2242 171.8071 21 L 4.6724 8.6671 122.5253 53.1974 44.5205 176.4170 22 R 4.4657 8.6152 126.6305 54.3809 31.3207 175.0365 23 W 5.4012 7.6157 120.9168 55.0078 31.3129 174.1274 24 R 4.7583 8.4352 114.5861 54.7580 31.8808 174.4448 25 M 4.4361 8.7977 120.6370 55.0140 32.8986 176.2207 26 Q 4.1825 8.8098 125.0435 58.0464 29.7709 176.0591 27 K 4.5722 7.7837 117.4024 54.8965 35.1225 174.8950 28 S 4.8901 8.6221 121.9039 57.0857 65.4912 173.0077 29 T 4.7148 8.0870 112.1653 61.0303 71.6365 173.4227 30 T 4.4621 8.2184 108.3304 61.2207 69.0857 174.0181 31 I 3.7856 7.7727 123.8328 61.9542 36.9518 175.5296 32 A 4.5891 8.4887 127.3225 51.8185 19.2249 177.1638 33 A 4.3257 7.7222 122.9754 52.4929 16.6126 176.2904 34 I 4.4897 7.6026 119.2680 58.8482 40.7358 175.8368 35 A 4.0622 8.7028 128.1319 52.2929 18.7206 176.9997 36 G 3.9581 8.2410 109.2705 45.0267 0.0000 171.2157 37 C 4.8600 8.0760 112.7151 54.3013 44.6086 173.1678 38 S 4.6785 8.4564 115.7258 58.0909 64.1363 174.3868 39 G 3.9166 8.6639 109.5586 46.3472 0.0000 174.0267 40 A 3.9763 7.8397 119.8315 51.4685 19.7099 178.1275 41 A 3.9270 8.4247 125.6235 52.5421 18.8165 178.1558 42 T 4.5879 8.2023 108.9124 59.8250 69.8372 173.8927 43 F 4.6418 7.1355 118.0889 56.1647 39.4930 174.9324 44 G 4.3010 9.9691 106.4135 46.7264 0.0000 174.4722 45 G 3.9206 8.5347 104.9957 45.0882 0.0000 174.4736 46 L 4.2838 7.9514 120.2395 54.2934 42.3460 176.4730 47 A 4.4692 8.0518 121.0533 51.9610 20.3948 177.9724 48 G 3.5951 7.8776 108.8126 47.2679 0.0000 174.1630 49 G 4.2072 8.4526 109.4351 45.0291 0.0000 173.5967 50 I 3.6196 8.2900 118.1007 64.5312 36.8676 178.4726 51 V 3.6331 7.8033 118.4945 66.0519 31.3266 178.0585 52 G 3.4635 7.9005 105.0783 47.9968 0.0000 175.0382 53 C 4.3004 8.0865 118.7718 59.8131 40.0458 176.2798 54 I 3.6431 7.9199 121.2805 64.2258 36.6321 178.3586 55 A 4.0329 8.2730 121.7274 55.1241 18.3412 179.5148 56 A 4.1873 8.0431 118.9979 55.2534 18.5321 180.0068 57 G 3.5482 8.0627 103.9977 47.9869 0.0000 176.1152 58 I 3.7707 7.8696 122.4532 63.9131 37.1114 178.2128 59 L 3.9420 8.2736 121.1104 58.1332 41.8637 178.9032 60 A 3.9740 7.9102 120.1799 55.2682 18.3184 179.7474 61 I 3.5303 7.7214 118.1643 64.3860 36.9642 178.5826 62 L 4.2810 8.0475 118.9724 58.1254 41.8104 179.3727 63 Q 4.3084 8.3339 118.0244 58.8264 28.1421 178.8457 64 G 3.4923 8.0989 106.8520 47.8740 0.0000 175.1152 65 F 4.4810 7.9120 118.1453 58.4145 39.1258 177.3038 66 E 2.0000 7.3612 119.7971 58.4962 29.1702 179.4761 67 V 3.4982 6.9128 118.6938 64.7049 31.2987 178.0643 68 N 4.8684 8.1763 118.2421 54.4810 38.2782 177.0166 69 W 4.5831 7.7362 116.8058 59.0516 28.8546 177.9465 70 H 4.6068 7.8384 116.4696 58.1518 28.2817 175.8567 71 N 4.8137 8.3289 114.2386 52.2250 40.5989 174.8072 72 G 3.8217 8.0726 104.5412 45.1897 0.0000 173.2875 73 G 4.0024 10.1828 105.2680 45.2753 0.0000 171.5622 74 G 4.1225 7.1545 104.7002 46.5769 0.0000 171.8386 75 G 3.9696 7.7624 105.9619 45.6827 0.0000 170.4297 76 D 5.0813 8.3343 119.4172 52.5072 42.8894 175.8591 77 R 4.5723 8.6050 122.8979 54.1707 32.7888 174.9405 78 S 4.8145 8.0992 114.6336 56.7495 66.3071 172.6289 79 N 4.7787 8.2069 117.0835 51.4748 41.4883 172.2096 80 P 4.4578 0.0000 0.0000 63.1066 32.0316 176.5516 81 V 4.0001 7.9541 118.2310 62.1383 31.3856 174.8889 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 19 W 8.26 4.70 0.00 3.26 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 20 S 8.28 4.46 0.00 4.06 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 L 8.67 4.67 0.00 1.69 1.77 1.02 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 22 R 8.62 4.47 0.00 1.76 1.78 0.00 3.18 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.46 0.00 23 W 7.62 5.40 0.00 3.58 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 24 R 8.44 4.76 0.00 1.91 1.87 0.00 3.04 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 25 M 8.80 4.44 0.00 2.11 2.16 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 2.71 2.79 0.00 26 Q 8.81 4.18 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.67 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 27 K 7.78 4.57 0.00 1.71 1.63 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.47 7.81 28 S 8.62 4.89 0.00 3.89 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 29 T 8.09 4.71 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 1.22 0.00 0.00 30 T 8.22 4.46 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 1.22 0.00 0.00 31 I 7.77 3.79 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 1.23 0.54 0.91 0.00 0.00 32 A 8.49 4.59 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 33 A 7.72 4.33 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 34 I 7.60 4.49 1.86 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 1.34 0.70 0.89 0.00 0.00 35 A 8.70 4.06 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 36 G 8.24 3.96 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 0.00 37 C 8.08 4.86 0.00 3.02 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 S 8.46 4.68 0.00 3.87 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 39 G 8.66 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.84 3.98 1.19 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 0.00 0.00 41 A 8.42 3.93 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 T 8.20 4.59 4.20 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 1.17 0.00 0.00 43 F 7.14 4.64 0.00 3.23 3.29 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 0.00 44 G 9.97 4.30 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 0.00 45 G 8.53 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.95 4.28 0.00 1.58 1.44 0.62 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.05 4.47 1.19 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 0.00 0.00 48 G 7.88 3.60 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 0.00 49 G 8.45 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 0.00 0.00 0.00 0.00 50 I 8.29 3.62 1.85 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 1.50 0.68 0.89 0.00 0.00 51 V 7.80 3.63 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 1.08 0.00 0.00 0.90 0.00 0.00 52 G 7.90 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.09 4.30 0.00 3.15 3.27 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 54 I 7.92 3.64 1.94 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.09 0.86 0.00 0.00 55 A 8.27 4.03 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 56 A 8.04 4.19 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 57 G 8.06 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 7.87 3.77 2.06 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.83 0.94 0.00 0.00 59 L 8.27 3.94 0.00 1.91 1.95 0.80 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 60 A 7.91 3.97 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.72 3.53 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.66 1.07 0.00 0.00 62 L 8.05 4.28 0.00 1.85 1.91 1.01 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.33 4.31 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.59 0.00 64 G 8.10 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.91 4.48 0.00 3.18 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 66 E 7.36 2.00 0.00 1.63 1.25 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 1.84 1.99 0.00 67 V 6.91 3.50 1.94 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 0.76 0.00 0.00 0.88 0.00 0.00 68 N 8.18 4.87 0.00 3.18 3.24 0.00 0.00 6.64 7.48 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 69 W 7.74 4.58 0.00 3.43 3.37 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 70 H 7.84 4.61 0.00 3.26 3.35 0.00 5.61 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 71 N 8.33 4.81 0.00 2.82 2.84 0.00 0.00 7.36 7.69 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 72 G 8.07 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 0.00 0.00 0.00 73 G 10.18 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.15 4.12 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 0.00 0.00 0.00 75 G 7.76 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 76 D 8.33 5.08 0.00 2.68 2.62 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 0.00 0.00 0.00 0.00 77 R 8.60 4.57 0.00 1.37 1.48 0.00 2.21 0.00 0.00 2.62 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.94 0.00 78 S 8.10 4.81 0.00 3.91 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.21 4.78 0.00 2.62 2.67 0.00 0.00 6.97 7.69 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 80 P 0.00 4.46 0.00 2.20 2.03 0.00 3.76 0.00 0.00 3.69 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 81 V 7.95 4.00 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 0.71 0.00 0.00 0.96 0.00 0.00