NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.0840 8.0093 120.7866 61.0987 39.1178 174.6049 2 T 4.4058 8.1287 116.4116 59.7588 71.1452 171.3954 3 A 4.5638 7.7293 123.8196 50.8684 22.9594 177.2966 4 K 4.3388 8.2250 118.9314 55.2995 33.8220 175.2599 5 P 4.3546 0.0000 0.0000 61.9596 31.8484 176.4574 6 A 4.0707 8.4103 123.2442 52.5114 18.7126 178.3043 7 K 4.1737 8.8143 122.7113 59.0404 32.5284 177.6067 8 T 4.5705 7.3362 107.4353 57.9002 68.3297 170.9283 9 P 4.1511 0.0000 0.0000 64.1609 32.2841 176.1237 10 T 4.9539 8.4653 117.6341 60.9242 69.7129 175.1556 11 S 4.4651 8.4490 122.1106 56.8398 65.4742 172.8603 12 P 4.1980 0.0000 0.0000 65.9529 30.9489 178.8138 13 K 3.9264 7.9223 117.5302 59.5631 32.3549 178.6483 14 E 4.0095 8.1222 118.6658 59.4140 29.2426 179.4209 15 Q 3.9801 8.5825 118.5110 58.8214 28.7878 178.4528 16 A 3.9533 8.2656 122.0963 55.0879 18.3098 179.8761 17 I 3.7361 7.8207 118.3763 64.4043 37.1755 178.6397 18 G 3.7136 7.9775 106.5974 47.8362 0.0000 175.3250 19 L 3.8805 8.1746 123.4281 57.8339 42.1446 179.1989 20 S 4.0643 7.9877 115.0021 61.6930 62.8410 176.9777 21 V 3.6842 8.2564 121.3275 66.1069 30.9543 178.1746 22 T 4.0307 8.2638 115.7271 66.8120 68.3024 176.5648 23 F 4.1635 8.9328 120.0244 60.7392 38.9587 177.8591 24 L 4.1180 8.3426 118.6983 57.6543 41.1215 179.7171 25 S 4.2407 8.0069 113.6925 61.1376 63.1308 176.1078 26 F 4.3466 8.2512 120.0188 59.8559 38.9325 178.0755 27 L 4.0674 8.3952 118.9112 57.7360 41.4523 179.4667 28 L 4.0396 7.9427 118.8400 57.4135 41.6443 177.8633 29 P 4.2968 0.0000 0.0000 65.5406 31.3052 178.5862 30 A 4.2166 7.6454 117.0027 55.1530 18.2975 179.8625 31 G 3.6526 8.7802 104.6817 47.6288 0.0000 175.5640 32 W 4.1733 8.4643 130.1830 60.2598 31.1844 177.9392 33 V 4.0152 8.3278 117.9889 66.2145 31.0313 177.8794 34 L 4.0346 8.2416 118.8659 58.1423 41.2689 179.0355 35 Y 3.9700 8.1010 118.2581 60.0887 38.9409 176.6311 36 H 4.3006 7.4001 115.0251 55.3635 28.8304 176.6345 37 L 3.8528 7.1525 123.9654 57.8594 41.3381 179.0330 38 D 4.1667 7.6249 117.3765 57.4105 41.0656 177.7131 39 N 4.2117 7.7727 115.2231 56.5080 38.4707 176.5517 40 Y 4.5589 6.9445 116.8110 61.0267 38.2028 177.8009 41 K 4.1967 8.1640 118.3831 58.1564 33.5490 178.0323 42 K 4.3872 7.5326 121.2591 53.4643 30.6314 176.1867 43 S 4.3048 7.6424 118.3792 59.0220 63.7226 175.8843 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 I 8.01 4.08 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 1.47 1.35 0.91 0.00 0.00 2 T 8.13 4.41 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 1.21 0.00 0.00 3 A 7.73 4.56 1.22 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 0.00 0.00 4 K 8.22 4.34 0.00 1.88 1.82 0.00 1.59 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.46 7.81 5 P 0.00 4.35 0.00 2.06 2.03 0.00 3.69 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 6 A 8.41 4.07 1.27 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 0.00 0.00 7 K 8.81 4.17 0.00 1.76 1.89 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.43 7.81 8 T 7.34 4.57 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 1.21 0.00 0.00 9 P 0.00 4.15 0.00 2.05 2.06 0.00 3.63 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 10 T 8.47 4.95 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 1.21 0.00 0.00 11 S 8.45 4.47 0.00 4.04 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 12 P 0.00 4.20 0.00 2.16 2.16 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 13 K 7.92 3.93 0.00 1.78 1.78 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.46 7.81 14 E 8.12 4.01 0.00 2.21 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 2.32 2.34 0.00 15 Q 8.58 3.98 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.67 0.00 16 A 8.27 3.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.82 3.74 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.70 0.91 0.00 0.00 18 G 7.98 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 19 L 8.17 3.88 0.00 1.68 1.57 0.54 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 20 S 7.99 4.06 0.00 4.10 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 21 V 8.26 3.68 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 1.07 0.00 0.00 1.04 0.00 0.00 22 T 8.26 4.03 4.59 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 23 F 8.93 4.16 0.00 2.99 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.34 4.12 0.00 1.93 1.79 0.96 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.01 4.24 0.00 4.04 4.06 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.25 4.35 0.00 3.20 3.10 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 27 L 8.40 4.07 0.00 1.76 1.77 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 28 L 7.94 4.04 0.00 1.83 1.76 0.95 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.30 0.00 2.18 2.09 0.00 3.81 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.14 0.00 30 A 7.65 4.22 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 31 G 8.78 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 W 8.46 4.17 0.00 3.43 3.56 0.00 0.00 0.00 0.00 0.00 0.00 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 8.33 4.02 2.29 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 1.18 0.00 0.00 1.31 0.00 0.00 34 L 8.24 4.03 0.00 1.98 1.75 0.98 0.86 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 35 Y 8.10 3.97 0.00 2.89 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 36 H 7.40 4.30 0.00 2.39 2.38 0.00 5.88 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.15 3.85 0.00 1.65 1.65 0.92 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 38 D 7.62 4.17 0.00 2.59 2.48 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 0.00 0.00 0.00 0.00 39 N 7.77 4.21 0.00 2.42 2.78 0.00 0.00 6.93 7.46 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 40 Y 6.94 4.56 0.00 3.10 2.94 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 0.00 0.00 0.00 0.00 41 K 8.16 4.20 0.00 1.88 1.88 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.58 7.81 42 K 7.53 4.39 0.00 1.67 1.72 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.43 7.81 43 S 7.64 4.30 0.00 4.20 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00