NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3682 8.2649 123.5842 51.7927 20.0426 176.8852 2 I 3.5650 8.3626 123.4050 63.1343 37.1916 175.9155 3 G 4.1005 8.7288 106.3276 44.8830 0.0000 172.4081 4 T 5.0868 7.4587 108.5244 59.7186 72.1281 173.1196 5 W 5.3665 8.1502 118.4779 55.4345 32.1306 173.0231 6 D 4.9079 8.7332 120.0084 52.5316 43.7208 175.3452 7 C 4.5429 9.1600 123.7990 58.7291 32.2323 173.5900 8 D 4.7845 8.6603 126.4258 53.7720 39.9917 178.4525 9 T 3.8192 7.9314 110.5999 64.4083 69.0171 174.7880 10 C 4.7525 7.1576 112.7655 57.0628 30.7059 173.6959 11 L 3.6237 8.1732 116.5874 56.8271 38.6754 174.6494 12 V 4.4373 7.8603 117.0780 61.2250 34.9156 174.6075 13 Q 4.6119 8.5720 125.9137 54.6709 30.4909 174.6757 14 N 4.6983 7.6223 118.5518 51.2379 42.4463 174.7580 15 K 4.4178 8.1662 121.5598 54.3104 33.8951 175.9290 16 P 4.5451 0.0000 0.0000 66.0554 31.3458 178.2284 17 E 4.0083 8.2679 116.3865 59.0302 29.5465 176.8277 18 A 4.2788 7.3504 120.5110 53.0214 18.8498 175.8750 19 V 4.7086 8.2856 114.5806 63.9112 38.2369 174.4932 20 K 4.8407 7.8219 117.2104 53.2246 35.2732 175.4683 21 C 3.9356 8.7806 123.8737 59.8922 32.1154 174.9540 22 V 3.5342 8.5285 125.7185 66.0231 31.4965 177.1482 23 A 4.1926 8.0737 121.4285 54.9445 18.3182 177.8304 24 C 4.7109 7.7900 105.3142 57.0096 31.2393 174.2698 25 E 3.7728 8.8126 116.1714 57.8960 26.2840 174.5777 26 T 4.1890 7.7544 111.3051 60.4542 70.0785 175.0069 27 P 4.0247 0.0000 0.0000 63.6896 32.0007 175.9534 28 K 2.8498 7.6923 117.8136 55.9613 29.4088 173.1766 29 P 4.1021 0.0000 0.0000 62.4253 32.3330 177.2835 30 G 3.8099 8.3125 111.2367 44.5813 0.0000 173.0314 31 T 4.5799 8.0319 122.5092 60.8137 71.4041 175.0019 32 G 3.7115 8.9510 115.5906 47.6591 0.0000 173.8889 33 V 4.4304 7.3705 118.3001 60.3246 34.0617 175.2818 34 K 4.1403 8.8682 126.6907 59.5257 32.3011 177.1608 35 R 4.1521 7.8683 120.7213 56.4125 30.1088 176.2016 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 A 8.26 4.37 1.28 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 2 I 8.36 3.56 1.92 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 1.37 0.71 0.97 0.00 0.00 3 G 8.73 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 T 7.46 5.09 4.23 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 1.24 0.00 0.00 5 W 8.15 5.37 0.00 3.65 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 6 D 8.73 4.91 0.00 2.54 2.52 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 0.00 0.00 0.00 0.00 7 C 9.16 4.54 0.00 2.99 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 8 D 8.66 4.78 0.00 2.96 2.92 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 9 T 7.93 3.82 4.27 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 1.25 0.00 0.00 10 C 7.16 4.75 0.00 3.09 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 11 L 8.17 3.62 0.00 1.79 1.77 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.86 4.44 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.99 0.00 0.00 13 Q 8.57 4.61 0.00 1.84 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.44 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 14 N 7.62 4.70 0.00 1.44 1.96 0.00 0.00 7.13 6.99 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 15 K 8.17 4.42 0.00 1.74 1.71 0.00 1.64 0.00 0.00 1.78 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.35 7.81 16 P 0.00 4.55 0.00 2.08 2.28 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.35 0.00 17 E 8.27 4.01 0.00 1.98 2.04 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 2.34 2.33 0.00 18 A 7.35 4.28 1.46 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 19 V 8.29 4.71 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 1.04 0.00 0.00 20 K 7.82 4.84 0.00 1.77 1.71 0.00 1.91 0.00 0.00 0.61 0.00 0.00 2.72 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.49 1.39 7.81 21 C 8.78 3.94 0.00 3.14 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.53 3.53 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 0.92 0.00 0.00 0.94 0.00 0.00 23 A 8.07 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 24 C 7.79 4.71 0.00 3.05 2.97 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 25 E 8.81 3.77 0.00 2.04 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 2.30 0.00 26 T 7.75 4.19 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 1.33 0.00 0.00 27 P 0.00 4.02 0.00 1.98 2.11 0.00 3.79 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 1.99 2.05 0.00 28 K 7.69 2.85 0.00 1.88 1.54 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.82 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.30 0.47 7.81 29 P 0.00 4.10 0.00 1.97 1.88 0.00 3.40 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.99 0.00 30 G 8.31 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 0.00 0.00 0.00 31 T 8.03 4.58 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 G 8.95 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.37 4.43 2.09 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 0.86 0.00 0.00 0.94 0.00 0.00 34 K 8.87 4.14 0.00 1.81 1.90 0.00 1.84 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.51 1.51 7.81 35 R 7.87 4.15 0.00 1.81 1.84 0.00 3.25 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00