NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8265 8.3544 109.7364 44.4184 0.0000 174.2411 2 S 3.5281 9.1857 111.8113 57.7168 61.7557 170.0266 3 S 4.4225 8.3487 114.5672 60.4646 65.5219 172.1528 4 G 3.6092 9.1225 103.8048 44.0619 0.0000 172.3142 5 S 3.6055 8.3887 110.2904 59.3860 60.3084 173.3959 6 S 4.4842 8.2796 116.2680 57.4538 61.6719 173.2376 7 G 4.6274 7.7790 122.3576 44.9598 0.0000 169.7516 8 E 4.3546 8.3966 123.2860 55.2562 30.9394 175.3434 9 D 5.0231 8.4330 120.6919 51.3760 42.3698 174.5392 10 D 4.8111 8.2935 119.5684 50.7667 40.8996 174.7661 11 P 4.4962 0.0000 0.0000 61.7545 32.3398 175.4585 12 I 3.4764 8.1048 117.8762 60.6924 37.3597 174.4208 13 P 4.5378 0.0000 0.0000 62.1218 32.4081 177.0962 14 D 4.3325 8.7940 119.0730 56.4605 39.3964 178.3690 15 E 3.9928 8.1397 116.7755 58.4892 29.2144 177.2541 16 L 4.6956 7.3819 118.0857 54.3523 42.2120 176.0070 17 L 4.8484 8.2463 117.2303 52.9179 45.4513 176.3185 18 C 4.8568 8.2489 114.3088 57.4097 30.7870 173.3088 19 L 4.4459 8.2000 118.4859 55.3427 41.3578 177.4169 20 I 4.4862 7.4289 117.4948 61.5379 40.0398 176.0997 21 C 4.4875 7.9935 115.1686 57.1166 31.1140 173.5009 22 K 4.0402 7.9848 118.0854 56.9623 28.9652 174.5387 23 D 4.8757 7.5948 115.3240 51.7450 44.6069 174.5902 24 I 3.5391 8.3767 124.7544 62.5284 37.3920 176.2818 25 M 4.3370 8.3784 125.4077 53.4895 30.6383 175.2881 26 T 3.9617 8.2482 117.9672 64.6002 67.8476 173.4222 27 D 4.6805 7.5775 118.6506 50.7722 41.0560 172.9274 28 A 3.9361 8.1531 122.6638 52.5681 18.9878 177.6479 29 V 4.4263 8.1033 115.8652 59.5184 35.3286 174.8522 30 V 4.6735 8.3484 125.7421 60.4752 32.6395 175.0884 31 I 4.0801 8.3412 129.3200 60.3247 38.7627 174.8244 32 P 4.2380 0.0000 0.0000 66.6925 31.7224 177.8085 33 C 3.9153 7.8134 113.4706 60.2449 29.9064 173.6781 34 C 4.4082 8.3295 111.9387 59.7209 30.9544 174.0199 35 G 4.5671 8.3783 114.0281 44.7767 0.0000 172.2890 36 N 4.8353 8.4196 121.7523 51.6892 43.6998 173.6991 37 S 4.5870 7.9166 115.6445 57.4484 64.6560 172.6791 38 Y 5.1915 8.0570 121.4570 56.0818 42.8517 174.6847 39 C 4.3733 9.0597 120.2120 59.9478 27.7754 174.6219 40 D 4.4098 8.7258 122.9431 57.2007 40.8387 178.8853 41 E 4.1185 8.1263 117.1715 59.2946 30.4538 177.9259 42 C 3.6955 7.9917 117.9478 62.6349 27.7440 176.3514 43 I 3.5636 7.9155 119.7987 63.6978 37.2834 177.9303 44 R 3.8476 7.0998 118.9718 59.6483 30.2718 178.3156 45 T 3.9387 8.5825 115.3910 67.2247 68.4039 176.2295 46 A 4.0014 7.7750 122.9535 55.4274 18.3482 179.2613 47 L 3.7899 7.7490 115.3922 57.9738 41.5531 180.3023 48 L 4.0248 8.3454 118.0353 58.4334 42.1007 178.9537 49 E 3.8553 7.7502 117.9014 59.1161 29.4562 177.9675 50 S 4.4301 7.4008 114.6896 58.5699 63.8793 174.5543 51 D 4.5658 8.5445 123.6447 57.1599 40.6147 176.8392 52 E 4.8314 7.6277 114.0839 54.4593 33.8138 176.4747 53 H 4.5935 8.5369 116.0314 56.0572 25.9456 173.1507 54 T 5.3190 7.5177 116.1299 59.9417 69.5334 172.9875 55 C 3.6903 8.5579 125.3430 58.8174 32.2766 172.3703 56 P 4.3549 0.0000 0.0000 66.3885 31.3226 177.7611 57 T 3.9858 8.1030 114.8737 65.4649 68.4607 173.9463 58 C 4.6710 7.7522 116.2033 55.9730 31.2642 171.8637 59 H 4.0920 9.0290 121.8200 56.1097 28.3807 173.8783 60 Q 4.5654 8.5630 124.6114 54.4381 32.8014 173.7544 61 N 4.6271 8.2060 117.6868 51.0672 40.3956 173.8729 62 D 4.2526 8.7058 126.3282 54.4050 39.3168 175.5697 63 V 3.8613 7.4791 117.8108 61.2002 31.7058 175.2410 64 S 4.1122 8.8739 122.6115 57.6483 62.2692 173.5134 65 P 4.0623 0.0000 0.0000 65.2746 31.5944 177.8411 66 D 4.4522 8.1628 117.9965 56.6422 41.2278 177.1051 67 A 4.0555 7.4259 121.0906 55.1308 18.4395 177.9098 68 L 4.0474 7.8766 113.8877 54.9512 42.6709 177.5965 69 S 4.4204 8.4297 114.6881 58.5168 62.6832 176.2472 70 G 4.4128 7.8509 109.2891 42.7467 0.0000 171.3167 71 P 4.4798 0.0000 0.0000 64.1954 31.7947 176.8680 72 S 4.5192 7.8019 115.3309 59.3300 63.1957 173.6560 73 S 3.6731 8.7932 110.7662 59.0091 60.5511 172.8722 74 G 3.6260 7.6796 113.6510 45.4021 0.0000 174.2882 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 G 8.35 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 0.00 0.00 0.00 2 S 9.19 3.53 0.00 4.03 3.88 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 0.00 0.00 0.00 3 S 8.35 4.42 0.00 3.98 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 4 G 9.12 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.39 3.61 0.00 4.00 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 6 S 8.28 4.48 0.00 3.90 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 7 G 7.78 4.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.40 4.35 0.00 2.08 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 9 D 8.43 5.02 0.00 2.74 2.66 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 10 D 8.29 4.81 0.00 2.79 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.50 0.00 2.20 2.12 0.00 3.80 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 1.98 1.98 0.00 12 I 8.10 3.48 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 0.52 0.91 0.00 0.00 13 P 0.00 4.54 0.00 2.21 2.17 0.00 3.69 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 2.06 1.94 0.00 14 D 8.79 4.33 0.00 2.92 2.96 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 15 E 8.14 3.99 0.00 2.07 2.16 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 2.28 2.36 0.00 16 L 7.38 4.70 0.00 1.85 1.70 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17 L 8.25 4.85 0.00 1.61 1.50 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 18 C 8.25 4.86 0.00 3.37 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 19 L 8.20 4.45 0.00 1.92 1.82 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.43 4.49 1.96 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.73 0.90 0.00 0.00 21 C 7.99 4.49 0.00 3.07 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 22 K 7.98 4.04 0.00 1.92 1.91 0.00 1.77 0.00 0.00 1.87 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.32 7.81 23 D 7.59 4.88 0.00 2.57 2.49 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 24 I 8.38 3.54 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 1.41 0.64 0.91 0.00 0.00 25 M 8.38 4.34 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.58 0.00 26 T 8.25 3.96 4.25 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 0.00 0.00 1.22 0.00 0.00 27 D 7.58 4.68 0.00 2.62 2.51 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 0.00 28 A 8.15 3.94 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 0.00 0.00 0.00 0.00 0.00 29 V 8.10 4.43 2.12 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 0.82 0.00 0.00 1.04 0.00 0.00 30 V 8.35 4.67 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 1.00 0.00 0.00 0.90 0.00 0.00 31 I 8.34 4.08 1.99 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.23 1.06 0.00 0.00 32 P 0.00 4.24 0.00 2.22 2.17 0.00 3.88 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 33 C 7.81 3.92 0.00 3.11 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.33 4.41 0.00 3.06 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 35 G 8.38 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.42 4.84 0.00 2.67 1.90 0.00 0.00 6.83 8.24 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 37 S 7.92 4.59 0.00 3.76 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 38 Y 8.06 5.19 0.00 2.91 2.75 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 39 C 9.06 4.37 0.00 3.11 2.88 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 0.00 0.00 0.00 40 D 8.73 4.41 0.00 2.80 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.13 4.12 0.00 2.23 2.18 0.00 0.00 0.00 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 2.39 0.00 42 C 7.99 3.70 0.00 3.32 3.07 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 0.00 0.00 0.00 0.00 43 I 7.92 3.56 1.98 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 1.46 1.20 1.01 0.00 0.00 44 R 7.10 3.85 0.00 2.11 2.04 0.00 3.32 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 45 T 8.58 3.94 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 1.18 0.00 0.00 46 A 7.77 4.00 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 47 L 7.75 3.79 0.00 1.67 1.41 0.87 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.35 4.02 0.00 1.68 1.70 0.90 1.07 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 49 E 7.75 3.86 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 50 S 7.40 4.43 0.00 3.99 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 D 8.54 4.57 0.00 2.65 2.75 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 52 E 7.63 4.83 0.00 1.91 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 53 H 8.54 4.59 0.00 3.17 3.27 0.00 5.85 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 T 7.52 5.32 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 1.33 0.00 0.00 55 C 8.56 3.69 0.00 2.92 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 56 P 0.00 4.35 0.00 2.15 2.06 0.00 3.73 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.68 0.00 57 T 8.10 3.99 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 58 C 7.75 4.67 0.00 3.03 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 59 H 9.03 4.09 0.00 3.19 3.44 0.00 5.48 0.00 0.00 0.00 0.00 6.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Q 8.56 4.57 0.00 2.25 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.89 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 61 N 8.21 4.63 0.00 2.59 2.71 0.00 0.00 6.87 8.04 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 62 D 8.71 4.25 0.00 2.81 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 63 V 7.48 3.86 2.19 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 1.14 0.00 0.00 0.95 0.00 0.00 64 S 8.87 4.11 0.00 3.91 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.06 0.00 2.20 2.22 0.00 3.77 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 2.01 2.03 0.00 66 D 8.16 4.45 0.00 2.68 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 A 7.43 4.06 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 68 L 7.88 4.05 0.00 1.66 1.69 0.97 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.43 4.42 0.00 3.98 3.94 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 70 G 7.85 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 P 0.00 4.48 0.00 2.19 2.19 0.00 3.76 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 1.99 1.99 0.00 72 S 7.80 4.52 0.00 3.88 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 73 S 8.79 3.67 0.00 4.02 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00