NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9294 8.3544 109.7356 45.4999 0.0000 172.6516 2 S 4.3128 8.2362 112.3774 56.3558 62.4786 172.9797 3 S 4.3544 8.1339 113.2429 57.9519 64.6605 172.9350 4 G 4.1008 8.2382 110.1743 44.9248 0.0000 172.9469 5 S 3.6006 8.4576 115.2766 59.1512 61.9290 174.0716 6 S 4.5222 7.8023 116.7557 58.3916 62.3095 175.6035 7 G 4.2266 7.8135 117.0029 44.4468 0.0000 170.8399 8 S 4.3664 7.8492 114.2320 60.3300 63.7270 174.7720 9 S 4.2430 7.7645 115.0877 57.3160 63.1567 172.0737 10 P 4.3339 0.0000 0.0000 63.2123 30.1776 174.5688 11 S 4.5846 8.0073 117.3634 59.7431 65.8254 176.2534 12 L 3.8526 7.5669 120.1545 57.0909 42.4072 179.5687 13 L 4.1132 7.9232 118.7862 57.2711 41.4311 178.4662 14 E 3.9732 7.7110 118.8078 59.3855 29.3355 177.9337 15 P 4.2865 0.0000 0.0000 65.9140 30.3327 178.0731 16 L 4.3048 7.8082 116.6071 56.1954 41.5227 178.8187 17 L 4.8561 8.7283 120.7241 56.2112 42.1807 178.6734 18 A 4.1090 8.1070 119.2369 55.0616 18.3069 179.1963 19 M 4.1876 7.6476 116.8659 57.2480 32.1124 176.3505 20 G 3.4870 7.5533 109.1185 45.6228 0.0000 174.8128 21 F 4.3666 7.0332 120.1905 56.6515 39.6692 174.6989 22 P 4.7118 0.0000 0.0000 62.7237 32.7625 176.0575 23 V 3.7509 8.1416 115.9057 66.4650 31.6349 178.2655 24 H 4.1278 7.7857 114.3447 59.3640 27.9734 177.2660 25 T 3.9988 7.9753 117.2557 66.4666 68.7342 176.3974 26 A 3.9500 7.7593 122.5105 55.4105 18.1682 179.7835 27 L 3.8510 8.3006 117.7528 57.6697 41.7181 179.6353 28 K 3.5911 7.5115 118.2835 59.4227 31.9694 179.1926 29 A 2.5800 7.1705 120.5847 54.4399 18.1962 179.5719 30 L 3.7106 7.4539 116.8920 57.9925 41.5651 179.6507 31 A 4.0663 7.8459 119.5109 54.8241 18.2613 179.4100 32 A 3.9058 7.1229 119.0144 55.5217 18.5282 179.7729 33 T 4.0613 7.7080 107.3009 62.9830 69.0575 175.2464 34 G 3.9091 8.2896 110.2036 46.6905 0.0000 173.2764 35 R 3.6493 7.7356 113.8248 56.7717 28.0591 178.2437 36 K 4.0940 8.0928 117.6913 58.9242 32.8608 177.7009 37 T 4.1625 7.3962 109.2655 61.0309 70.0601 173.1646 38 A 4.0341 8.5881 129.4714 55.7822 18.7931 179.6901 39 E 3.9595 8.5129 114.7948 59.8479 29.5891 179.1017 40 E 3.9232 7.8500 118.1102 59.7128 29.5258 179.3035 41 A 3.9852 7.7109 120.2045 55.4256 18.2792 179.6303 42 L 3.7929 7.8643 117.0066 57.9512 41.3322 179.7018 43 A 3.9973 7.9604 120.2738 54.5543 18.3317 179.2172 44 W 4.0622 8.0655 126.3428 59.8788 30.9954 178.2485 45 L 4.1722 8.3238 119.4557 57.9264 40.9442 178.9370 46 H 4.4606 8.5337 115.3839 58.1934 28.6626 176.7314 47 D 4.5299 7.3462 119.2056 55.6780 41.5030 177.9303 48 H 4.0701 7.5188 116.6921 58.1396 28.9408 177.3972 49 C 3.7432 7.9147 114.6730 61.2036 29.7075 174.5956 50 N 4.6779 7.7031 119.1396 50.5914 36.9910 173.0122 51 D 4.5328 7.3429 118.1086 52.5346 45.0302 175.2971 52 P 4.4321 0.0000 0.0000 64.6841 31.6244 177.2183 53 S 4.4577 7.9020 112.3630 58.8625 63.7638 174.3055 54 L 4.5382 7.1728 121.1529 52.6748 41.0581 173.7728 55 D 4.5562 8.2419 120.7411 53.9806 40.7534 175.7222 56 D 4.8543 8.2322 123.0657 52.0234 44.9869 174.7121 57 P 4.0968 0.0000 0.0000 64.8560 31.5585 177.6417 58 I 3.9812 6.9710 120.4928 61.1212 34.6463 174.2631 59 S 4.1922 8.2806 118.6236 58.1176 63.7619 175.4927 60 G 4.1418 8.5242 115.7866 43.1764 0.0000 170.7421 61 P 4.5318 0.0000 0.0000 62.1237 32.3445 177.1412 62 S 4.0664 8.7286 114.3157 62.1881 62.7883 176.5551 63 S 4.1602 8.1429 112.7384 61.2751 62.5006 174.0549 64 G 3.7476 7.3023 109.9257 45.7860 0.0000 173.0247 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 3.93 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 2 S 8.24 4.31 0.00 3.92 3.85 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 0.00 0.00 0.00 3 S 8.13 4.35 0.00 4.01 3.85 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 0.00 0.00 0.00 4 G 8.24 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 5 S 8.46 3.60 0.00 4.06 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 6 S 7.80 4.52 0.00 3.86 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 7.81 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 8 S 7.85 4.37 0.00 3.83 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 9 S 7.76 4.24 0.00 3.89 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 10 P 0.00 4.33 0.00 2.17 2.09 0.00 3.70 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 11 S 8.01 4.58 0.00 3.84 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 12 L 7.57 3.85 0.00 1.64 1.68 0.90 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.92 4.11 0.00 1.65 1.71 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 14 E 7.71 3.97 0.00 2.06 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 0.00 2.35 2.50 0.00 15 P 0.00 4.29 0.00 2.30 2.33 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.06 0.00 16 L 7.81 4.30 0.00 1.90 1.80 0.88 0.55 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 17 L 8.73 4.86 0.00 1.88 1.71 0.92 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.11 4.11 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 19 M 7.65 4.19 0.00 2.11 2.48 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.88 0.00 20 G 7.55 3.49 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 0.00 0.00 0.00 21 F 7.03 4.37 0.00 3.49 3.01 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 0.00 0.00 0.00 0.00 22 P 0.00 4.71 0.00 2.02 2.27 0.00 3.91 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 2.22 2.11 0.00 23 V 8.14 3.75 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 1.07 0.00 0.00 0.90 0.00 0.00 24 H 7.79 4.13 0.00 3.38 3.60 0.00 5.51 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 25 T 7.98 4.00 4.39 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 26 A 7.76 3.95 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.30 3.85 0.00 1.78 1.65 0.94 0.72 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 28 K 7.51 3.59 0.00 1.79 1.38 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.52 7.81 29 A 7.17 2.58 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.45 3.71 0.00 1.82 1.60 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 31 A 7.85 4.07 1.20 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 0.00 0.00 32 A 7.12 3.91 0.51 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 0.00 0.00 33 T 7.71 4.06 4.47 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 1.32 0.00 0.00 34 G 8.29 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.74 3.65 0.00 1.84 1.91 0.00 3.16 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.55 0.00 36 K 8.09 4.09 0.00 1.73 1.85 0.00 1.78 0.00 0.00 1.63 0.00 0.00 3.17 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.41 7.81 37 T 7.40 4.16 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 1.22 0.00 0.00 38 A 8.59 4.03 1.32 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 0.00 0.00 0.00 39 E 8.51 3.96 0.00 2.03 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 2.42 2.43 0.00 40 E 7.85 3.92 0.00 2.19 2.03 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 2.35 2.50 0.00 41 A 7.71 3.99 1.23 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 42 L 7.86 3.79 0.00 1.95 1.76 1.09 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 43 A 7.96 4.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 W 8.07 4.06 0.00 3.40 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.32 4.17 0.00 1.74 1.61 0.14 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 46 H 8.53 4.46 0.00 3.21 3.38 0.00 5.64 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 7.35 4.53 0.00 2.46 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 48 H 7.52 4.07 0.00 2.17 2.66 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 C 7.91 3.74 0.00 3.05 3.19 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 50 N 7.70 4.68 0.00 2.73 2.75 0.00 0.00 6.72 8.07 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 51 D 7.34 4.53 0.00 2.73 2.43 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 52 P 0.00 4.43 0.00 2.16 2.16 0.00 3.71 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 1.96 1.93 0.00 53 S 7.90 4.46 0.00 4.00 4.01 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 0.00 0.00 0.00 0.00 54 L 7.17 4.54 0.00 1.64 1.66 0.93 0.95 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 55 D 8.24 4.56 0.00 2.68 2.64 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 56 D 8.23 4.85 0.00 2.70 2.56 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 57 P 0.00 4.10 0.00 2.18 2.19 0.00 3.83 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 58 I 6.97 3.98 1.94 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.07 1.00 0.00 0.00 59 S 8.28 4.19 0.00 3.97 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 60 G 8.52 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 0.00 0.00 0.00 61 P 0.00 4.53 0.00 2.23 2.22 0.00 3.85 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.99 0.00 62 S 8.73 4.07 0.00 3.88 3.99 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 63 S 8.14 4.16 0.00 3.82 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 64 G 7.30 3.75 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 0.00 0.00 0.00