NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3586 8.2649 123.5819 52.1202 21.0327 177.1736 3 K 4.2802 7.9857 117.6223 57.0697 34.5811 174.3856 4 H 3.4093 9.5942 114.1005 58.5642 29.6262 174.5721 5 P 4.4303 0.0000 0.0000 63.4667 32.6364 176.0654 6 V 4.4332 7.8680 119.8752 60.8270 34.4831 172.0939 7 P 4.3623 0.0000 0.0000 62.7502 31.7842 176.4406 8 K 4.2055 8.5951 123.1659 58.4298 32.6912 177.1996 9 K 4.5786 7.6195 115.9268 54.0277 36.0401 175.5144 10 K 3.7472 8.8054 123.5254 57.0469 32.3332 176.4599 11 T 3.9225 8.4675 122.9148 63.5353 69.1739 174.6036 12 S 4.2360 8.5915 120.1919 58.1068 64.0430 175.3941 13 K 4.1761 8.7137 127.2243 59.6442 32.1353 179.3719 14 A 3.9786 8.0820 122.4062 55.2286 18.3546 179.4960 15 R 3.8018 7.9722 115.1593 59.6134 30.3178 178.0725 16 R 3.9719 8.4966 119.2085 59.5699 30.1626 178.2296 17 D 4.3893 8.0678 118.0174 57.0288 40.7289 178.9050 18 A 3.9612 8.2257 121.8689 55.1940 18.2001 179.6341 19 R 3.8996 7.7964 115.8613 59.2242 30.2958 177.8693 20 R 4.5353 7.5978 116.2225 56.0498 29.7705 177.8570 21 S 3.9392 7.7526 115.7376 61.8708 62.2008 175.3661 22 H 4.8921 7.8361 113.2537 56.0000 28.6325 175.9657 23 H 4.2579 8.2055 119.6842 58.1716 28.8006 176.2199 24 A 4.0616 7.9542 120.8488 52.5327 18.5301 176.8127 25 L 4.5298 8.1400 120.2843 53.7928 43.4197 176.1307 26 T 4.7126 7.8936 108.8560 58.8027 71.3240 172.1491 27 P 4.3597 0.0000 0.0000 61.8802 31.9018 174.4743 28 P 4.2296 0.0000 0.0000 63.0291 31.8638 176.2738 29 I 4.0320 8.2486 121.7595 60.9750 36.5811 174.8685 30 L 5.1267 8.1412 124.5208 53.1755 45.0207 176.2999 31 V 4.6030 9.0560 113.0073 59.4188 36.4415 172.9043 32 P 4.9674 0.0000 0.0000 62.7217 31.9787 175.6132 33 C 4.7756 8.1935 118.3664 55.9801 31.1666 172.1272 34 P 4.5334 0.0000 0.0000 66.0972 32.4872 178.4896 35 E 4.2503 8.1478 113.6191 56.2875 28.4637 179.8994 36 C 4.3007 8.9803 129.4020 59.9911 32.1179 172.0252 37 K 4.0995 8.3958 120.6081 56.9568 32.0781 175.9375 38 A 4.3387 7.7184 120.2203 53.1596 20.0390 175.4806 39 M 5.0031 8.4473 117.4631 53.8364 34.0435 176.3089 40 K 4.7157 9.0938 122.3626 53.9034 35.8817 173.9966 41 P 5.0007 0.0000 0.0000 60.7520 32.2763 174.7505 42 P 4.2986 0.0000 0.0000 63.5922 31.8629 175.2935 43 H 4.1876 8.5681 113.6000 56.5134 26.3615 175.6906 44 T 4.3638 7.6538 107.7437 59.7752 70.9939 173.6197 45 V 3.0837 7.9062 126.5185 63.1044 31.8225 174.5142 46 C 4.6978 8.0515 125.1277 56.6510 34.6622 171.2698 47 P 4.1259 0.0000 0.0000 64.3763 31.1099 176.2334 48 E 3.9972 9.0017 119.3869 56.4533 29.3520 173.8307 49 C 4.6628 8.4387 110.5930 59.0319 30.4605 174.1560 50 G 4.0903 5.3800 111.8957 44.0801 0.0000 174.1877 51 Y 4.0492 7.7875 125.6613 58.5588 42.6618 173.1377 52 Y 4.2909 8.3505 113.1950 56.9440 38.6659 173.9668 53 A 4.0915 8.8600 127.6773 52.7444 18.7329 176.9482 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 2 A 8.26 4.36 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.99 4.28 0.00 1.80 1.66 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.51 7.81 4 H 9.59 3.41 0.00 3.16 3.03 0.00 5.73 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.43 0.00 2.05 1.99 0.00 3.73 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 2.04 2.09 0.00 6 V 7.87 4.43 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 1.01 0.00 0.00 7 P 0.00 4.36 0.00 2.08 1.97 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 8 K 8.60 4.21 0.00 1.69 1.83 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.52 7.81 9 K 7.62 4.58 0.00 1.73 1.63 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.37 7.81 10 K 8.81 3.75 0.00 1.71 1.76 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.49 7.81 11 T 8.47 3.92 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 12 S 8.59 4.24 0.00 3.88 3.73 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 13 K 8.71 4.18 0.00 2.01 2.06 0.00 1.55 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.51 7.81 14 A 8.08 3.98 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.97 3.80 0.00 1.81 2.11 0.00 3.25 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 16 R 8.50 3.97 0.00 1.86 1.99 0.00 3.13 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 17 D 8.07 4.39 0.00 2.72 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.23 3.96 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 19 R 7.80 3.90 0.00 1.84 2.18 0.00 3.28 0.00 0.00 3.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 20 R 7.60 4.54 0.00 2.03 1.86 0.00 3.17 0.00 0.00 3.01 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.56 0.00 21 S 7.75 3.94 0.00 3.87 3.57 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 22 H 7.84 4.89 0.00 3.13 3.28 0.00 5.95 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.21 4.26 0.00 3.37 3.37 0.00 5.68 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.95 4.06 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 25 L 8.14 4.53 0.00 1.65 1.64 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.89 4.71 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 27 P 0.00 4.36 0.00 2.20 2.10 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 28 P 0.00 4.23 0.00 2.20 2.10 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 29 I 8.25 4.03 1.88 0.00 0.00 0.87 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 1.41 0.92 0.00 0.00 30 L 8.14 5.13 0.00 1.49 1.55 0.92 0.94 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 V 9.06 4.60 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.96 0.00 0.00 32 P 0.00 4.97 0.00 1.95 1.98 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 33 C 8.19 4.78 0.00 3.27 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 34 P 0.00 4.53 0.00 2.31 2.31 0.00 3.85 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 2.10 2.16 0.00 35 E 8.15 4.25 0.00 1.96 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 2.28 2.36 0.00 36 C 8.98 4.30 0.00 3.14 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 37 K 8.40 4.10 0.00 1.76 1.80 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.44 7.81 38 A 7.72 4.34 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 39 M 8.45 5.00 0.00 1.88 1.97 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 40 K 9.09 4.72 0.00 1.61 1.65 0.00 1.64 0.00 0.00 1.93 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.36 7.81 41 P 0.00 5.00 0.00 1.93 1.97 0.00 3.71 0.00 0.00 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.94 0.00 42 P 0.00 4.30 0.00 2.09 1.90 0.00 3.84 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 43 H 8.57 4.19 0.00 3.27 3.39 0.00 5.68 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 44 T 7.65 4.36 4.17 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 1.19 0.00 0.00 45 V 7.91 3.08 1.79 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 0.59 0.00 0.00 0.10 0.00 0.00 46 C 8.05 4.70 0.00 2.86 2.61 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 47 P 0.00 4.13 0.00 2.19 2.02 0.00 3.82 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 1.96 1.93 0.00 48 E 9.00 4.00 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.37 0.00 49 C 8.44 4.66 0.00 3.00 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 50 G 5.38 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.79 4.05 0.00 2.65 2.57 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 52 Y 8.35 4.29 0.00 2.86 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 53 A 8.86 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