NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8212 8.3249 115.8603 56.4872 39.8903 175.5109 2 V 3.5386 7.0859 113.1352 61.8420 32.2016 175.2093 3 N 4.6075 7.5065 119.5803 50.6333 37.7368 172.6020 4 Q 4.4227 7.1134 117.4417 55.2812 31.7040 174.1919 5 H 4.3242 8.6266 115.7659 55.4197 28.9052 175.1487 6 L 4.7304 8.5254 124.6347 53.1668 43.3807 175.6322 7 C 4.9506 8.1190 120.7568 58.5889 32.9720 175.2998 8 G 3.8183 8.4277 110.6983 46.5450 0.0000 177.2996 9 S 4.1145 8.6549 117.3150 61.2733 63.4721 176.2368 10 H 4.1314 8.2520 118.6899 58.6833 28.2371 177.4783 11 L 3.9274 7.7825 121.7290 57.9662 41.8661 179.0917 12 V 3.1822 7.4333 117.7215 65.8920 31.4423 177.4190 13 E 3.9111 8.3482 118.9646 59.1320 29.3580 178.6376 14 A 4.1621 7.9013 120.4635 55.2423 18.4712 179.5175 15 L 3.6034 7.8478 117.7803 57.8405 41.4363 179.1184 16 Y 4.2298 7.8082 119.4747 60.8030 38.5537 178.3001 17 L 3.8184 7.9346 118.5025 57.6704 41.8280 179.5146 18 V 3.7538 7.8587 117.2056 66.3883 31.7715 177.8005 19 C 4.2937 8.6461 116.7449 61.3524 28.5111 174.9903 20 G 3.6357 8.2662 110.1059 46.3007 0.0000 175.4896 21 E 4.2294 8.7611 120.2159 57.9520 29.8733 178.5158 22 R 3.9158 7.7461 119.3028 57.2013 30.3392 177.6693 23 G 3.9310 9.2169 105.4024 45.1755 0.0000 171.1802 24 F 4.8666 7.4858 112.4955 55.9259 40.3127 172.9074 25 F 4.9838 7.9862 114.7520 55.0553 40.1181 173.5848 26 Y 4.8177 9.0138 124.7318 56.1647 40.1049 175.1665 27 T 4.3301 7.9491 117.8895 58.5707 69.2875 172.5656 28 P 3.9961 0.0000 0.0000 66.2258 31.5236 178.3319 29 K 4.2264 7.8254 114.6053 56.3853 32.2567 176.7224 30 A 4.1654 7.5007 126.6835 52.5452 19.2528 176.1816 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 F 8.32 4.82 0.00 3.11 3.23 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 2 V 7.09 3.54 1.80 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 -0.26 0.00 0.00 0.66 0.00 0.00 3 N 7.51 4.61 0.00 2.64 2.73 0.00 0.00 6.76 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 4 Q 7.11 4.42 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 6.97 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 5 H 8.63 4.32 0.00 3.19 3.30 0.00 5.64 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.53 4.73 0.00 1.59 1.59 0.88 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.12 4.95 0.00 2.88 2.76 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 8 G 8.43 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 9 S 8.65 4.11 0.00 4.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.25 4.13 0.00 3.39 3.39 0.00 5.63 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.78 3.93 0.00 1.82 1.79 0.90 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.43 3.18 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 1.04 0.00 0.00 0.26 0.00 0.00 13 E 8.35 3.91 0.00 2.11 2.17 0.00 0.00 0.00 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 2.35 0.00 14 A 7.90 4.16 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.85 3.60 0.00 0.88 0.13 0.70 0.73 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 16 Y 7.81 4.23 0.00 3.21 3.21 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 17 L 7.93 3.82 0.00 1.96 1.80 0.75 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.86 3.75 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 0.76 0.00 0.00 0.88 0.00 0.00 19 C 8.65 4.29 0.00 3.20 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 20 G 8.27 3.64 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 0.00 0.00 0.00 21 E 8.76 4.23 0.00 2.10 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 0.00 2.27 2.34 0.00 22 R 7.75 3.92 0.00 1.92 2.08 0.00 3.23 0.00 0.00 3.54 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 23 G 9.22 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 7.49 4.87 0.00 2.98 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 25 F 7.99 4.98 0.00 3.21 3.08 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 0.00 0.00 0.00 0.00 26 Y 9.01 4.82 0.00 3.17 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.95 4.33 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 1.32 0.00 0.00 28 P 0.00 4.00 0.00 2.09 1.96 0.00 3.44 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.77 0.00 29 K 7.83 4.23 0.00 1.71 1.86 0.00 1.60 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.47 7.81 30 A 7.50 4.17 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