NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5001 M 4.4277 8.3044 120.3282 55.6358 33.3141 175.8143 5002 E 4.4791 8.4544 115.9798 53.9944 29.3340 170.7164 5003 V 3.8418 7.5019 120.8390 60.8617 34.0092 176.1779 5004 N 4.5741 8.6864 119.1222 53.1508 37.8430 175.8828 5005 Q 3.8434 8.0427 126.3036 58.0713 29.2768 178.6911 5006 L 4.4591 7.8639 116.2850 55.1465 41.4987 178.4488 5007 G 3.6571 10.0106 107.9232 48.1218 0.0000 175.6672 5008 F 4.3872 8.2192 122.5711 61.2347 39.4924 177.1203 5009 I 3.4006 7.3305 118.7445 64.1639 36.8766 178.0932 5010 A 4.0611 8.4646 122.1105 55.3681 17.9835 179.6335 5011 T 3.9462 8.1250 110.5045 65.1759 67.6407 175.8895 5012 A 4.2653 8.4690 122.8140 55.5655 18.2626 179.3679 5013 L 4.0536 8.1406 117.4245 57.7226 41.6304 179.3155 5014 F 4.0299 8.3049 120.7069 60.2607 39.6086 175.8830 5015 V 3.9960 7.3454 117.4566 63.1846 31.7184 175.3139 5016 L 4.5444 9.3563 116.8607 57.3280 43.4669 178.0296 5017 V 3.5496 7.8741 117.1917 66.2212 31.0327 176.0397 5018 P 4.2558 0.0000 0.0000 65.8834 31.4683 178.0555 5019 S 4.1849 7.8954 112.7155 61.0614 62.4954 176.0305 5020 V 3.5841 9.1048 122.2268 65.0688 30.9373 177.6746 5021 F 4.2654 8.1800 120.9037 61.4800 39.0031 177.2689 5022 L 3.7738 8.0641 118.1624 57.1219 41.3909 178.6036 5023 I 4.1485 7.3751 115.9537 62.0315 36.8814 176.3959 5024 I 4.3050 7.2615 119.6122 63.2240 38.6898 177.8153 5025 L 3.9989 7.5285 118.4500 57.9293 41.5763 178.5769 5026 Y 4.1755 8.3673 120.4844 60.1528 38.3748 177.6553 5027 V 3.0638 7.7941 118.5856 66.2029 31.4054 178.1649 5028 Q 4.0475 7.5138 115.0843 59.0217 28.4226 178.6765 5029 T 3.9274 8.3254 119.2978 66.7424 68.2542 176.6325 5030 E 3.8429 7.5765 119.4056 58.7393 29.2183 178.4046 5031 S 4.7202 7.1822 111.9838 58.9566 63.2562 175.5892 5032 Q 4.2287 8.4426 121.9746 57.3935 29.7098 176.6539 5033 Q 4.2182 7.2406 116.7938 56.4337 29.5591 176.7744 5034 K 4.3910 7.0891 121.7580 57.6830 29.9348 172.6591 5035 S 4.7100 7.2144 118.3413 56.0000 67.7217 174.5721 5036 S 4.2325 8.6997 114.6662 59.0254 61.9778 173.8768 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 5001 M 8.30 4.43 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.60 0.00 5002 E 8.45 4.48 0.00 1.96 1.83 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 2.17 2.36 0.00 5003 V 7.50 3.84 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.97 0.00 0.00 5004 N 8.69 4.57 0.00 2.75 2.78 0.00 0.00 6.86 7.12 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 5005 Q 8.04 3.84 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.64 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 5006 L 7.86 4.46 0.00 1.75 1.78 0.90 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 5007 G 10.01 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5008 F 8.22 4.39 0.00 3.06 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 5009 I 7.33 3.40 1.80 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 -0.36 0.83 0.00 0.00 5010 A 8.46 4.06 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 5011 T 8.13 3.95 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 5012 A 8.47 4.27 1.69 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 0.00 0.00 5013 L 8.14 4.05 0.00 1.91 1.77 0.94 0.97 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 5014 F 8.30 4.03 0.00 3.03 3.39 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 5015 V 7.35 4.00 2.28 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 0.83 0.00 0.00 1.11 0.00 0.00 5016 L 9.36 4.54 0.00 1.81 1.65 0.99 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 5017 V 7.87 3.55 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 1.07 0.00 0.00 0.95 0.00 0.00 5018 P 0.00 4.26 0.00 2.13 2.03 0.00 3.78 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 5019 S 7.90 4.18 0.00 3.89 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 5020 V 9.10 3.58 2.13 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 0.81 0.00 0.00 0.97 0.00 0.00 5021 F 8.18 4.27 0.00 3.16 3.40 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 5022 L 8.06 3.77 0.00 1.67 1.53 0.88 0.62 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 5023 I 7.38 4.15 1.89 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 1.51 0.62 0.95 0.00 0.00 5024 I 7.26 4.30 2.12 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.95 0.00 0.00 5025 L 7.53 4.00 0.00 1.41 1.62 0.74 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 5026 Y 8.37 4.18 0.00 2.95 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5027 V 7.79 3.06 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 0.94 0.00 0.00 1.06 0.00 0.00 5028 Q 7.51 4.05 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.58 0.00 5029 T 8.33 3.93 4.29 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 1.16 0.00 0.00 5030 E 7.58 3.84 0.00 1.68 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 2.29 0.00 5031 S 7.18 4.72 0.00 3.94 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5032 Q 8.44 4.23 0.00 1.98 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 7.18 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 5033 Q 7.24 4.22 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 5034 K 7.09 4.39 0.00 1.75 2.04 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.53 7.81 5035 S 7.21 4.71 0.00 4.03 3.68 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 5036 S 8.70 4.23 0.00 3.81 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00