NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 W 4.6992 8.2593 120.6108 56.9145 30.4417 173.9552 20 S 4.4680 8.3426 115.0874 56.3417 65.5811 171.5441 21 L 4.6206 8.5886 122.0552 53.2245 44.3586 176.4548 22 R 4.3743 8.6165 127.0883 54.5758 31.0265 175.1746 23 W 5.3929 7.6553 121.0897 54.9236 31.5059 174.1452 24 R 4.7962 8.4285 113.9534 54.9522 31.7717 174.3167 25 M 4.4605 8.7328 120.0446 54.7297 32.8569 176.2676 26 Q 4.1425 8.8018 125.4122 57.8973 29.7250 175.8869 27 K 4.5197 7.8244 117.7506 54.7244 34.7504 174.9281 28 S 4.8664 8.6871 122.2814 56.9847 65.1285 173.1984 29 T 4.7632 8.1426 112.7736 60.6564 71.8055 173.4058 30 T 4.4814 8.2583 108.0159 61.2194 69.1241 173.8584 31 I 3.8235 7.7352 123.6641 61.7605 36.8360 175.6669 32 A 4.4552 8.4449 127.4176 51.8464 19.4903 177.9056 33 A 4.3563 7.6621 119.8502 51.9360 15.9765 175.7143 34 I 4.5136 7.5247 119.5350 58.6928 40.7492 175.9321 35 A 4.1111 8.5327 127.6770 51.9056 18.8675 177.3386 36 G 3.9252 8.2443 109.5486 45.2844 0.0000 170.9304 37 C 4.8186 8.1055 112.7286 54.5473 44.4990 172.9265 38 S 4.7348 8.4076 115.4864 58.0014 64.0649 174.3533 39 G 3.8240 8.6543 110.0779 45.8890 0.0000 174.0303 40 A 3.8793 8.1551 120.6241 51.8996 19.2074 178.2830 41 A 3.8965 8.2326 125.2366 52.3964 18.8667 178.0255 42 T 4.7360 8.1542 109.2717 60.1568 70.1115 174.2296 43 F 4.5063 7.2066 118.3219 56.6209 38.8952 174.7074 44 G 3.9419 9.9392 106.1346 46.6391 0.0000 174.0644 45 G 3.9012 8.4546 103.8258 45.6342 0.0000 174.4201 46 L 4.1809 7.7470 119.6365 54.1108 42.4097 177.2788 47 A 4.5104 8.3486 125.0983 52.2502 20.5493 179.1177 48 G 3.6225 8.4737 112.5652 47.3673 0.0000 174.8676 49 G 4.2101 8.4515 112.2542 45.0296 0.0000 173.0487 50 I 3.6492 8.2335 118.0247 64.5269 36.9185 178.5123 51 V 3.6474 7.7765 118.6806 65.9461 31.3207 178.1784 52 G 3.4170 7.9402 105.0982 47.7375 0.0000 175.1279 53 C 4.2730 8.1535 118.8016 59.8754 40.9968 176.2526 54 I 3.6321 7.8694 121.1192 64.3265 36.6584 178.2675 55 A 3.9993 8.1796 121.5613 55.2855 18.3111 179.5699 56 A 4.1906 8.3863 119.5667 55.1336 18.4362 180.2127 57 G 3.5362 7.9343 103.9812 47.9874 0.0000 176.1465 58 I 3.7614 8.0153 122.6728 63.9001 37.0827 178.1872 59 L 3.9639 8.2638 121.1213 58.2522 41.9450 178.9539 60 A 3.9691 7.9607 120.2898 55.0938 18.3023 179.7120 61 I 3.5448 7.7165 118.1832 64.4843 37.0101 178.5104 62 L 4.2979 8.2309 118.7894 58.2240 41.6788 179.3856 63 Q 4.3013 8.3920 118.0524 58.8026 28.6976 179.0921 64 G 3.3938 8.0340 106.7284 47.7952 0.0000 175.6441 65 F 4.6149 8.0750 119.4673 59.2487 38.8390 177.2458 66 E 2.0000 7.0933 119.2237 58.6490 29.1132 179.6134 67 V 3.4636 6.9341 117.9219 64.7571 31.2901 178.0382 68 N 4.8659 8.4281 118.5173 54.4922 38.3024 177.0844 69 W 4.5847 7.7357 116.8591 59.1679 28.8233 177.9363 70 H 4.6399 8.0282 116.7832 58.0561 28.2823 175.7831 71 N 4.8366 8.3209 113.8980 52.2133 40.1525 175.1009 72 G 3.8995 7.8858 105.1530 45.0552 0.0000 173.3085 73 G 4.0083 9.0954 104.4034 45.1223 0.0000 172.7100 74 G 4.2292 9.0917 106.6212 44.4637 0.0000 171.6983 75 G 4.1919 7.7580 107.2622 45.1616 0.0000 171.0711 76 D 5.0723 8.2139 119.2585 52.4391 42.6968 176.2457 77 R 4.5994 8.6134 122.8857 54.1496 33.0534 174.9667 78 S 4.8270 8.1383 114.4634 56.7687 66.2872 172.6646 79 N 4.8518 8.1748 117.3173 51.5591 41.5661 172.3932 80 P 4.4337 0.0000 0.0000 62.7533 32.1607 176.7843 81 V 4.0177 8.0295 119.9941 61.9639 31.5024 175.2475 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 19 W 8.26 4.70 0.00 3.25 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 20 S 8.34 4.47 0.00 4.04 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 21 L 8.59 4.62 0.00 1.68 1.77 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 22 R 8.62 4.37 0.00 1.76 1.79 0.00 3.16 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.47 0.00 23 W 7.66 5.39 0.00 3.53 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 24 R 8.43 4.80 0.00 1.92 1.87 0.00 3.04 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 25 M 8.73 4.46 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.79 0.00 26 Q 8.80 4.14 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.73 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 27 K 7.82 4.52 0.00 1.70 1.63 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.45 7.81 28 S 8.69 4.87 0.00 3.90 3.76 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 29 T 8.14 4.76 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 30 T 8.26 4.48 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 31 I 7.74 3.82 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 1.23 0.54 0.93 0.00 0.00 32 A 8.44 4.46 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 33 A 7.66 4.36 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 34 I 7.52 4.51 1.86 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 1.33 0.70 0.89 0.00 0.00 35 A 8.53 4.11 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 36 G 8.24 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 37 C 8.11 4.82 0.00 3.02 3.20 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 38 S 8.41 4.73 0.00 3.86 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.65 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 0.00 0.00 0.00 40 A 8.16 3.88 1.24 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 0.00 0.00 41 A 8.23 3.90 0.26 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 42 T 8.15 4.74 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 1.21 0.00 0.00 43 F 7.21 4.51 0.00 3.25 3.28 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 44 G 9.94 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 0.00 0.00 0.00 45 G 8.45 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 0.00 0.00 0.00 46 L 7.75 4.18 0.00 1.76 1.56 0.94 0.66 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 47 A 8.35 4.51 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 48 G 8.47 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.45 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.23 3.65 1.84 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 1.50 0.89 0.89 0.00 0.00 51 V 7.78 3.65 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 1.07 0.00 0.00 0.90 0.00 0.00 52 G 7.94 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.15 4.27 0.00 3.15 3.25 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 54 I 7.87 3.63 1.96 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.69 0.86 0.00 0.00 55 A 8.18 4.00 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 56 A 8.39 4.19 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 57 G 7.93 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.02 3.76 2.03 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.62 0.95 0.00 0.00 59 L 8.26 3.96 0.00 1.92 1.95 0.79 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 60 A 7.96 3.97 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 61 I 7.72 3.54 2.06 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 1.47 0.96 1.10 0.00 0.00 62 L 8.23 4.30 0.00 1.81 1.94 1.01 1.20 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 63 Q 8.39 4.30 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.51 0.00 64 G 8.03 3.39 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 0.00 65 F 8.08 4.61 0.00 3.21 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.09 2.00 0.00 1.52 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 1.71 2.09 0.00 67 V 6.93 3.46 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 0.75 0.00 0.00 0.88 0.00 0.00 68 N 8.43 4.87 0.00 3.16 3.30 0.00 0.00 6.61 7.44 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 69 W 7.74 4.58 0.00 3.44 3.39 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 70 H 8.03 4.64 0.00 3.22 3.37 0.00 5.61 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 71 N 8.32 4.84 0.00 2.80 2.82 0.00 0.00 7.25 7.79 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 72 G 7.89 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 0.00 0.00 0.00 73 G 9.10 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 0.00 0.00 0.00 74 G 9.09 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 75 G 7.76 4.19 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 0.00 0.00 0.00 76 D 8.21 5.07 0.00 2.66 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 R 8.61 4.60 0.00 1.34 1.48 0.00 2.21 0.00 0.00 2.56 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.03 0.00 78 S 8.14 4.83 0.00 3.91 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 79 N 8.17 4.85 0.00 2.62 2.66 0.00 0.00 7.02 7.69 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 80 P 0.00 4.43 0.00 2.07 1.96 0.00 3.66 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 2.01 2.06 0.00 81 V 8.03 4.02 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 0.71 0.00 0.00 0.94 0.00 0.00