NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 E 4.2263 8.4449 120.2262 56.8353 30.3291 175.0598 11 E 3.4322 8.7117 122.7068 55.9081 26.1935 169.3727 12 E 4.3253 8.0103 118.9842 53.3507 32.0070 174.4231 13 L 3.8844 8.5483 128.7366 55.5463 41.9417 176.2603 14 V 4.2580 7.9842 125.4510 60.6221 33.4966 174.6743 15 D 4.4529 8.6228 126.4822 53.1453 40.4717 174.3860 16 P 4.2336 0.0000 0.0000 66.6729 30.7787 176.4956 17 L 3.8966 8.6199 120.3563 58.0986 41.5290 178.4495 18 T 4.0559 7.8150 112.5872 65.3984 68.9648 176.3909 19 T 4.1812 7.7910 117.9622 66.8042 68.7167 176.7603 20 I 3.8798 8.1862 121.6792 64.0064 36.8187 178.8204 21 R 3.9932 8.1513 119.2908 59.5245 30.1304 178.2053 22 E 4.0724 8.4410 118.7193 59.1198 29.2289 178.7137 23 H 4.0137 8.0618 118.7050 59.8331 30.2870 177.4917 24 C 4.3460 8.1349 117.7778 59.9074 40.0339 175.6585 25 E 3.9071 7.9585 118.8228 58.1449 30.3077 177.9940 26 Q 4.5680 7.3350 118.7615 53.8352 27.8270 173.9716 27 T 4.5605 7.8266 115.8024 63.0124 73.3851 175.7242 28 E 3.6961 8.3452 127.7252 59.1816 31.0485 179.2494 29 K 3.9995 8.1899 117.9239 59.7058 32.6564 179.1589 30 C 3.9885 8.1225 116.1915 62.7831 27.9399 176.3471 31 V 3.7097 8.2848 120.2333 65.8107 31.0068 177.7813 32 K 4.2370 7.7217 113.2232 56.9745 31.8655 176.5319 33 A 4.6059 7.4322 121.5354 53.7132 20.9051 178.9926 34 R 3.6087 8.8142 115.9737 59.4550 29.8756 178.3823 35 E 3.8885 8.2901 119.0850 59.3762 29.5398 178.7705 36 R 3.9629 7.9765 116.1689 59.6480 30.2706 177.8965 37 L 4.0739 8.2211 120.6289 56.9534 42.0169 178.3996 38 E 3.8422 8.0738 118.1332 59.6268 29.7971 179.6969 39 L 4.0159 7.7903 118.5232 58.6596 41.7351 178.2050 40 C 4.2149 8.7507 118.7121 58.9810 41.6586 175.0447 41 D 4.2611 7.7571 118.2548 57.3926 41.2843 178.6023 42 A 4.0866 8.7938 122.4110 55.5161 18.2703 179.8643 43 R 3.8055 7.8709 113.3281 59.4797 29.4698 178.9232 44 V 3.5414 8.0780 118.4330 65.7612 31.4953 177.8993 45 S 4.2717 8.6526 114.6295 61.3756 62.7521 176.5154 46 S 4.2070 7.7956 115.8095 60.7394 63.2678 175.3154 47 R 4.0295 7.4585 121.0954 56.2762 30.3508 176.6605 48 S 4.6321 8.6123 116.0258 59.1434 64.6018 174.3793 49 H 4.9419 8.1077 119.0419 55.8968 30.1474 172.9106 50 T 4.5278 7.8278 111.3482 59.9019 68.8202 173.9773 51 E 4.1548 8.5816 126.6915 57.4165 30.1365 176.7666 52 E 4.0910 7.5615 119.6510 56.7066 30.2717 176.0336 53 Q 4.5635 8.1423 120.8313 54.9050 32.9333 175.6951 54 C 5.4340 8.4507 118.0139 57.0728 40.4340 176.1914 55 T 3.4337 7.3421 117.6197 67.1807 67.8033 175.3336 56 E 3.6718 8.0136 117.8605 59.4570 29.8805 178.7984 57 E 3.9328 8.0943 117.3238 59.6264 29.8522 179.2215 58 L 3.9586 7.9368 119.9367 58.3713 41.9896 178.9195 59 F 4.6324 8.2227 117.6816 61.0038 38.7769 177.0636 60 D 4.5349 8.5211 118.6738 57.9835 40.5902 178.8831 61 F 4.2117 8.3767 120.7663 61.1017 39.4800 176.8265 62 L 3.9763 8.6306 119.8619 57.5494 41.2741 179.0612 63 H 4.0935 9.2345 118.7964 59.2345 29.6500 177.0974 64 A 4.0022 7.6910 122.2491 55.5122 18.4236 178.8224 65 R 3.4827 8.2020 117.6750 60.2481 29.9723 177.9601 66 D 4.3379 8.8169 118.2095 57.7993 41.1395 178.1989 67 H 4.0291 7.8464 118.0267 59.6226 29.5237 175.8260 68 C 4.0627 7.9539 119.1690 60.0382 41.9792 175.4215 69 V 3.7118 8.0888 119.5236 66.1970 30.7215 177.6863 70 A 4.2678 8.3560 120.3952 55.7329 18.0962 178.9686 71 H 4.0138 7.8742 114.4671 58.7534 29.9114 175.8820 72 K 4.4728 7.8713 117.4006 56.6944 35.1053 177.8317 73 L 3.8400 8.9768 121.4707 58.6156 40.4560 178.9145 74 F 4.1213 8.3040 115.7350 59.3638 38.8382 177.1961 75 N 4.6252 8.3877 116.3810 55.7537 38.3177 177.1130 76 K 4.1536 7.4228 118.0353 58.2108 32.6469 177.8161 77 L 4.1295 6.4723 114.7273 54.6886 42.2433 177.3904 78 K 4.1976 8.3268 118.4519 56.7102 32.2836 176.6545 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 10 E 8.44 4.23 0.00 1.97 1.99 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 2.21 2.34 0.00 11 E 8.71 3.43 0.00 2.13 1.94 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 2.22 2.41 0.00 12 E 8.01 4.33 0.00 1.87 1.83 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 2.16 2.24 0.00 13 L 8.55 3.88 0.00 1.61 1.62 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 14 V 7.98 4.26 2.07 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 0.86 0.00 0.00 0.95 0.00 0.00 15 D 8.62 4.45 0.00 2.73 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 16 P 0.00 4.23 0.00 2.25 2.31 0.00 3.72 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 2.02 2.01 0.00 17 L 8.62 3.90 0.00 1.74 1.82 0.91 0.95 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 18 T 7.82 4.06 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 19 T 7.79 4.18 4.40 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 1.21 0.00 0.00 20 I 8.19 3.88 1.88 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 1.53 1.53 0.95 0.00 0.00 21 R 8.15 3.99 0.00 1.88 2.03 0.00 3.37 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.83 0.00 22 E 8.44 4.07 0.00 2.24 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.65 0.00 23 H 8.06 4.01 0.00 3.11 3.53 0.00 5.92 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 24 C 8.13 4.35 0.00 2.96 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 25 E 7.96 3.91 0.00 2.18 2.22 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 2.78 2.71 0.00 26 Q 7.34 4.57 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.54 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 27 T 7.83 4.56 4.35 0.00 0.00 0.00 0.00 0.00 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 28 E 8.35 3.70 0.00 2.02 1.86 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 2.37 2.40 0.00 29 K 8.19 4.00 0.00 1.83 1.81 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.43 7.81 30 C 8.12 3.99 0.00 3.22 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 31 V 8.28 3.71 2.11 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 1.06 0.00 0.00 1.08 0.00 0.00 32 K 7.72 4.24 0.00 1.84 1.85 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.63 7.81 33 A 7.43 4.61 1.49 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 34 R 8.81 3.61 0.00 1.83 2.18 0.00 3.13 0.00 0.00 2.78 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 35 E 8.29 3.89 0.00 2.28 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 2.34 0.00 36 R 7.98 3.96 0.00 1.98 2.01 0.00 3.27 0.00 0.00 3.18 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.95 0.00 37 L 8.22 4.07 0.00 1.69 1.62 0.85 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.07 3.84 0.00 1.94 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 2.27 2.45 0.00 39 L 7.79 4.02 0.00 1.84 1.71 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.75 4.21 0.00 2.92 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 41 D 7.76 4.26 0.00 2.77 2.79 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 42 A 8.79 4.09 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.87 3.81 0.00 2.08 2.18 0.00 2.78 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.62 0.00 44 V 8.08 3.54 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 0.83 0.00 0.00 1.00 0.00 0.00 45 S 8.65 4.27 0.00 4.03 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 46 S 7.80 4.21 0.00 4.03 4.07 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 47 R 7.46 4.03 0.00 1.95 1.92 0.00 3.17 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 48 S 8.61 4.63 0.00 3.85 3.90 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 49 H 8.11 4.94 0.00 3.01 3.25 0.00 5.89 0.00 0.00 0.00 0.00 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.83 4.53 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 1.20 0.00 0.00 51 E 8.58 4.15 0.00 1.97 1.96 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 2.24 2.20 0.00 52 E 7.56 4.09 0.00 1.94 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 2.30 2.28 0.00 53 Q 8.14 4.56 0.00 2.04 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.90 0.00 0.00 0.00 0.00 0.00 2.31 2.51 0.00 54 C 8.45 5.43 0.00 2.91 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 55 T 7.34 3.43 4.07 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 0.54 0.00 0.00 56 E 8.01 3.67 0.00 2.05 1.84 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 2.51 2.51 0.00 57 E 8.09 3.93 0.00 2.21 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 58 L 7.94 3.96 0.00 1.70 1.70 1.03 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.22 4.63 0.00 3.33 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.52 4.53 0.00 2.97 2.83 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 61 F 8.38 4.21 0.00 3.18 3.34 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 62 L 8.63 3.98 0.00 1.91 1.93 1.15 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 63 H 9.23 4.09 0.00 3.16 3.55 0.00 5.58 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 7.69 4.00 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 65 R 8.20 3.48 0.00 0.86 1.66 0.00 3.17 0.00 0.00 3.17 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 66 D 8.82 4.34 0.00 2.79 2.71 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 67 H 7.85 4.03 0.00 3.28 3.44 0.00 5.62 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 C 7.95 4.06 0.00 3.00 3.44 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 69 V 8.09 3.71 2.26 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 0.97 0.00 0.00 0.98 0.00 0.00 70 A 8.36 4.27 1.39 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 0.00 0.00 0.00 71 H 7.87 4.01 0.00 3.21 3.48 0.00 5.89 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 72 K 7.87 4.47 0.00 1.84 1.79 0.00 1.84 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.41 7.81 73 L 8.98 3.84 0.00 1.73 1.88 0.78 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 74 F 8.30 4.12 0.00 3.09 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 75 N 8.39 4.63 0.00 2.76 2.90 0.00 0.00 7.00 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 7.42 4.15 0.00 1.84 1.82 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.59 7.81 77 L 6.47 4.13 0.00 1.29 1.41 0.34 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.33 4.20 0.00 1.71 1.69 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.40 7.81