NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2360 8.2644 123.5823 52.7229 19.8860 176.1192 2 T 4.1113 7.6782 113.0933 60.4523 68.6833 167.3085 3 V 4.2998 8.5061 126.9381 61.5013 34.4379 171.8681 4 V 4.1334 8.2537 113.8022 62.1840 33.3519 176.2672 5 S 4.9762 8.3168 113.4218 58.8499 65.6395 179.3572 6 G 3.7025 9.2233 118.7558 44.5958 0.0000 170.0784 7 Q 3.6677 9.2009 130.1002 55.2929 28.9955 174.2807 8 K 4.6535 7.9826 117.7713 56.0498 34.3689 174.3801 9 Q 4.6358 7.2609 117.6461 54.3065 33.3931 174.7444 10 D 4.3804 8.1186 114.4645 54.0292 43.8762 175.2461 11 R 4.4225 8.2472 122.9080 55.9264 32.7103 173.7565 12 Q 4.0836 8.5944 125.8715 58.3170 29.7777 176.2105 13 G 4.2530 8.4982 104.6818 45.2203 0.0000 172.8758 14 G 4.1594 7.9817 108.7602 44.5743 0.0000 175.6614 15 E 3.5846 8.9702 122.0735 56.4285 29.5988 175.6817 16 R 4.4145 8.0676 120.8473 55.4604 31.5624 173.4047 17 R 4.0006 8.5516 125.4658 56.6263 30.8526 175.7688 18 R 4.3625 8.4429 122.4582 58.0463 31.2712 177.0105 19 S 3.5096 7.7575 111.4822 59.6663 64.0020 172.0575 20 Q 4.3581 7.9366 113.0050 55.4261 28.9437 175.0163 21 L 3.7052 7.5395 121.9706 55.0155 41.9567 175.9284 22 D 4.6014 8.6389 125.8474 53.4221 41.9027 177.4863 23 R 4.2275 8.5101 122.5787 58.1155 30.4019 176.6586 24 D 5.2915 7.8982 117.8212 53.4155 40.9079 175.1532 25 Q 4.8600 7.8456 119.2831 55.1412 32.6103 173.3861 26 C 4.6679 8.8653 119.6275 57.4586 34.0684 174.5207 27 A 4.8404 8.3859 128.8851 52.5751 19.1757 176.3963 28 Y 4.4061 7.8677 118.3845 60.2789 40.7594 175.9120 29 C 4.3498 8.3185 113.1239 58.2111 30.8290 174.1091 30 K 4.3053 8.2917 118.9698 57.7238 30.0230 175.4199 31 E 4.3187 7.9157 117.6273 54.5522 30.5989 174.9646 32 K 4.7141 8.8994 120.3869 54.9265 34.5900 174.4074 33 G 3.5551 7.7150 117.7306 45.0329 0.0000 173.1790 34 H 5.1416 7.6253 114.1886 53.1856 31.5035 173.2717 35 W 4.8570 8.7809 119.1378 54.4792 30.8131 177.4809 36 A 4.0903 8.6499 123.1995 55.5698 17.8533 180.1722 37 K 4.1457 8.3297 112.8462 58.4770 32.2308 177.0190 38 D 4.8631 8.3336 117.5695 53.5725 42.1105 174.8615 39 C 4.0070 8.2162 119.8296 58.5036 31.7195 172.3445 40 P 4.4635 0.0000 0.0000 63.5835 31.1951 176.5475 41 K 4.1711 7.5666 119.5611 57.3658 32.8779 176.2627 42 K 3.9713 7.2968 118.6461 55.4875 31.8229 175.1212 43 P 4.3740 0.0000 0.0000 64.4629 31.8076 176.6823 44 R 4.4541 7.2978 112.4876 54.4937 31.4312 173.5573 45 G 4.2332 8.3006 108.4592 42.8272 0.0000 170.0308 46 P 4.5460 0.0000 0.0000 62.4361 32.1294 175.7191 47 R 4.5720 8.3802 117.6277 55.6501 32.4038 174.9641 48 G 3.5842 8.6286 109.9075 45.4824 0.0000 170.4057 49 P 4.4036 0.0000 0.0000 62.5643 30.2656 176.5066 50 R 4.4505 7.9972 123.5358 53.9006 31.5149 174.5560 51 P 4.6308 0.0000 0.0000 62.0587 29.4764 177.2099 52 Q 4.4570 7.4988 119.5673 55.1809 29.9906 176.0286 53 T 4.3237 7.8752 122.9152 61.1777 67.2407 176.3782 54 S 4.4883 7.0159 115.7452 57.7471 65.0734 172.9898 55 L 4.1937 8.3489 129.9158 54.4912 48.4340 174.3135 56 L 3.9998 8.1084 122.4900 55.2753 41.8360 174.5168 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 4.24 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 T 7.68 4.11 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 V 8.51 4.30 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 0.79 0.00 0.00 0.96 0.00 0.00 4 V 8.25 4.13 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 0.85 0.00 0.00 0.93 0.00 0.00 5 S 8.32 4.98 0.00 3.83 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 6 G 9.22 3.70 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 0.00 0.00 0.00 7 Q 9.20 3.67 0.00 2.39 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 7.27 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 8 K 7.98 4.65 0.00 1.69 1.70 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.43 7.81 9 Q 7.26 4.64 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 10 D 8.12 4.38 0.00 2.54 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.25 4.42 0.00 1.74 1.71 0.00 3.27 0.00 0.00 3.14 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.54 0.00 12 Q 8.59 4.08 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.54 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 13 G 8.50 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 0.00 0.00 0.00 0.00 14 G 7.98 4.16 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 0.00 0.00 0.00 15 E 8.97 3.58 0.00 1.92 1.92 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 2.30 2.28 0.00 16 R 8.07 4.41 0.00 1.74 1.82 0.00 3.28 0.00 0.00 3.12 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.41 0.00 17 R 8.55 4.00 0.00 1.79 1.80 0.00 3.27 0.00 0.00 3.14 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 18 R 8.44 4.36 0.00 1.89 1.81 0.00 3.38 0.00 0.00 3.36 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 19 S 7.76 3.51 0.00 4.06 3.78 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.94 4.36 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.91 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 21 L 7.54 3.71 0.00 1.78 1.59 0.82 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.64 4.60 0.00 2.91 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 R 8.51 4.23 0.00 1.91 2.14 0.00 3.56 0.00 0.00 3.33 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 24 D 7.90 5.29 0.00 2.85 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 25 Q 7.85 4.86 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.17 0.00 26 C 8.87 4.67 0.00 2.91 2.84 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 27 A 8.39 4.84 1.17 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 0.00 0.00 0.00 0.00 0.00 28 Y 7.87 4.41 0.00 2.87 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 C 8.32 4.35 0.00 3.20 3.24 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 0.00 30 K 8.29 4.31 0.00 1.81 2.14 0.00 1.44 0.00 0.00 0.82 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.24 1.37 7.81 31 E 7.92 4.32 0.00 2.07 1.63 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 2.29 2.29 0.00 32 K 8.90 4.71 0.00 1.83 1.71 0.00 1.61 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.27 1.38 7.81 33 G 7.71 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 0.00 0.00 0.00 34 H 7.63 5.14 0.00 3.29 3.32 0.00 5.52 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 W 8.78 4.86 0.00 3.37 3.22 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 36 A 8.65 4.09 1.41 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 37 K 8.33 4.15 0.00 1.90 1.94 0.00 1.94 0.00 0.00 1.82 0.00 0.00 3.16 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.53 1.58 7.81 38 D 8.33 4.86 0.00 2.61 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 8.22 4.01 0.00 2.96 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.46 0.00 2.17 2.07 0.00 3.57 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.79 0.00 41 K 7.57 4.17 0.00 1.79 2.01 0.00 1.86 0.00 0.00 1.90 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.50 7.81 42 K 7.30 3.97 0.00 1.70 1.59 0.00 1.64 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.04 0.34 7.81 43 P 0.00 4.37 0.00 2.18 2.17 0.00 3.80 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 44 R 7.30 4.45 0.00 1.88 1.88 0.00 3.14 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 45 G 8.30 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 0.00 0.00 0.00 0.00 46 P 0.00 4.55 0.00 2.21 2.08 0.00 3.74 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 47 R 8.38 4.57 0.00 1.86 1.91 0.00 3.43 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.60 0.00 48 G 8.63 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.40 0.00 2.20 2.13 0.00 3.72 0.00 0.00 3.67 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 50 R 8.00 4.45 0.00 1.78 1.89 0.00 3.21 0.00 0.00 3.28 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 51 P 0.00 4.63 0.00 2.18 2.10 0.00 3.71 0.00 0.00 3.72 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 52 Q 7.50 4.46 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.43 7.55 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 53 T 7.88 4.32 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 1.21 0.00 0.00 54 S 7.02 4.49 0.00 4.04 3.77 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 55 L 8.35 4.19 0.00 1.52 1.56 0.92 1.12 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 56 L 8.11 4.00 0.00 1.75 1.58 0.92 0.81 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