NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.7757 8.0276 122.7556 55.1367 43.7874 175.2037 2 K 5.0964 9.0409 125.1248 55.8219 37.0410 172.9008 3 C 5.2658 9.0533 116.7522 55.5511 45.4214 174.9377 4 N 5.2391 8.8624 120.7038 52.0511 38.2637 174.1618 5 Q 4.6717 8.4237 121.7384 55.7123 28.6118 179.6358 6 L 4.5414 8.5969 118.4309 54.9684 40.6334 176.5398 7 I 4.3042 9.2894 118.0631 62.6448 39.0613 174.5146 8 P 4.2652 0.0000 0.0000 60.8557 31.8046 173.7790 9 P 4.6399 0.0000 0.0000 62.7830 29.9352 176.1188 10 F 4.9598 8.1670 114.6262 55.0662 39.4234 174.3607 11 W 5.4901 7.9777 125.1546 55.7242 31.2876 175.0018 12 K 4.2898 8.8100 116.4798 55.9482 35.6359 175.1891 13 T 4.7789 8.4551 118.9926 63.5591 69.1079 175.4169 14 C 4.7354 8.6450 124.2824 55.8959 35.4095 172.2280 15 P 4.5444 0.0000 0.0000 61.8284 31.9341 175.6973 16 K 3.9326 8.3843 120.5980 58.5195 32.6032 175.6538 17 G 4.3775 8.6014 119.1296 45.9635 0.0000 175.0507 18 K 4.7497 7.4113 120.8640 54.4046 30.4871 176.9062 19 N 4.9375 7.8021 112.9171 53.4237 39.2339 174.8346 20 L 5.0017 7.7618 117.6908 53.8572 47.1167 174.0736 21 C 5.5841 8.7718 115.7374 57.3627 39.4627 172.0749 22 Y 5.0096 8.2244 116.6737 57.3795 41.6121 173.8752 23 K 4.3305 8.9549 120.9750 56.1329 34.7756 174.8046 24 M 5.1726 9.5451 129.7882 54.8991 32.1883 175.9661 25 T 4.8981 8.8817 114.7996 60.7587 71.8487 173.5341 26 M 4.7495 8.6978 122.8485 54.2917 33.2532 177.6074 27 R 4.2252 8.7241 122.2301 58.8765 30.6357 177.8932 28 A 4.1394 8.2737 120.5792 54.8313 18.7517 177.8793 29 A 4.4972 7.6341 116.1663 50.0132 20.7208 174.1716 30 P 4.2994 0.0000 0.0000 65.4125 32.0665 177.2370 31 M 5.1467 7.1343 117.7955 53.9653 34.1436 175.0489 32 V 3.8737 7.6092 120.2275 61.6764 33.2559 174.0184 33 P 4.3345 0.0000 0.0000 63.6930 30.0751 176.0929 34 V 3.9741 8.7656 125.9853 64.0006 31.2840 175.9609 35 K 4.6471 7.6519 118.4079 55.7138 34.9433 175.2462 36 R 4.1373 7.6474 117.0662 55.5561 34.1630 174.7489 37 G 3.7524 5.7444 108.2585 46.4607 0.0000 170.4703 38 C 5.3719 8.9522 117.9175 55.9683 35.5206 173.4947 39 I 4.3615 8.5765 119.1923 60.2889 40.2445 172.7098 40 D 4.8705 9.1397 116.2193 55.5596 42.7328 177.5118 41 V 4.5411 7.4246 116.0378 59.6149 34.5057 174.9282 42 C 4.2708 8.6907 121.9240 56.2685 44.0881 172.2960 43 P 4.4257 0.0000 0.0000 61.5881 33.0997 174.8587 44 K 4.1116 8.5297 120.5016 56.2865 31.7542 177.4733 45 S 2.8015 8.4603 123.5723 58.2475 63.2104 174.5726 46 S 4.4527 7.2959 118.8553 56.9219 64.1194 175.1204 47 L 3.8842 8.3641 123.6535 57.9704 42.1816 178.1728 48 L 4.3051 7.4741 117.8889 56.1103 42.4414 176.3280 49 I 4.9906 7.6620 119.3793 59.3249 41.6545 174.1466 50 K 4.3772 9.0533 128.7656 55.5081 33.7245 174.8159 51 Y 5.0730 7.8646 125.4496 57.1574 38.8071 175.6548 52 M 4.4233 9.1116 127.1255 54.6838 31.6054 174.1322 53 C 5.4599 8.4570 120.8753 55.9904 39.7397 171.2699 54 C 4.8844 8.8923 115.0514 55.2873 44.4745 173.4288 55 N 4.6188 8.8844 114.0507 53.0652 38.8324 174.7121 56 T 4.3265 7.6932 109.0495 60.1447 70.3072 174.3222 57 D 4.8199 8.3757 123.6414 55.0355 41.6050 178.5118 58 K 4.0678 8.6746 120.2715 57.6250 31.3974 177.0424 59 C 4.1111 8.0288 113.0859 57.9280 41.4944 173.7320 60 N 4.5079 7.6325 119.9122 52.7329 37.1140 174.6028 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 L 8.03 4.78 0.00 1.72 1.67 1.02 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 2 K 9.04 5.10 0.00 2.21 1.95 0.00 0.61 0.00 0.00 1.06 0.00 0.00 2.20 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.15 1.26 7.81 3 C 9.05 5.27 0.00 2.88 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 4 N 8.86 5.24 0.00 2.92 2.95 0.00 0.00 6.14 7.50 0.00 0.00 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 Q 8.42 4.67 0.00 1.87 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.70 0.00 0.00 0.00 0.00 0.00 1.69 1.16 0.00 6 L 8.60 4.54 0.00 2.01 1.14 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 7 I 9.29 4.30 1.87 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.60 0.94 0.00 0.00 8 P 0.00 4.27 0.00 1.69 1.81 0.00 3.58 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.49 0.00 9 P 0.00 4.64 0.00 2.06 2.17 0.00 3.50 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 10 F 8.17 4.96 0.00 2.89 2.98 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 0.00 0.00 0.00 11 W 7.98 5.49 0.00 3.57 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 12 K 8.81 4.29 0.00 1.72 1.74 0.00 1.22 0.00 0.00 1.85 0.00 0.00 2.74 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.53 7.81 13 T 8.46 4.78 4.34 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 1.34 0.00 0.00 14 C 8.65 4.74 0.00 2.91 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 15 P 0.00 4.54 0.00 2.23 2.18 0.00 3.74 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 2.09 1.96 0.00 16 K 8.38 3.93 0.00 1.74 1.78 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.47 7.81 17 G 8.60 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.41 4.75 0.00 1.97 1.86 0.00 1.69 0.00 0.00 1.93 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.37 7.81 19 N 7.80 4.94 0.00 2.71 2.84 0.00 0.00 7.02 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.76 5.00 0.00 1.80 1.78 0.99 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 21 C 8.77 5.58 0.00 2.84 3.02 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 0.00 0.00 0.00 22 Y 8.22 5.01 0.00 3.04 3.07 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 23 K 8.95 4.33 0.00 1.81 1.74 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.39 1.45 7.81 24 M 9.55 5.17 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.27 0.00 25 T 8.88 4.90 4.31 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 1.34 0.00 0.00 26 M 8.70 4.75 0.00 2.00 2.05 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 2.73 2.56 0.00 27 R 8.72 4.23 0.00 1.81 1.96 0.00 3.34 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 28 A 8.27 4.14 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 29 A 7.63 4.50 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.30 0.00 2.20 2.11 0.00 3.80 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 2.00 2.00 0.00 31 M 7.13 5.15 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 32 V 7.61 3.87 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 0.95 0.00 0.00 33 P 0.00 4.33 0.00 2.15 2.13 0.00 3.83 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 2.02 2.00 0.00 34 V 8.77 3.97 2.25 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 0.75 0.00 0.00 1.04 0.00 0.00 35 K 7.65 4.65 0.00 1.83 1.95 0.00 1.75 0.00 0.00 1.95 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.54 1.49 7.81 36 R 7.65 4.14 0.00 1.45 1.53 0.00 3.32 0.00 0.00 3.41 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.53 0.00 37 G 5.74 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 38 C 8.95 5.37 0.00 2.90 3.08 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 0.00 0.00 0.00 0.00 39 I 8.58 4.36 1.87 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 1.33 0.85 0.93 0.00 0.00 40 D 9.14 4.87 0.00 2.65 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 41 V 7.42 4.54 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 0.82 0.00 0.00 0.95 0.00 0.00 42 C 8.69 4.27 0.00 3.00 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 43 P 0.00 4.43 0.00 2.25 2.02 0.00 3.78 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.63 0.00 44 K 8.53 4.11 0.00 1.76 1.83 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.45 7.81 45 S 8.46 2.80 0.00 3.68 3.32 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 46 S 7.30 4.45 0.00 3.99 3.97 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 47 L 8.36 3.88 0.00 1.57 1.72 0.89 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.47 4.31 0.00 1.62 1.70 0.92 0.68 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 49 I 7.66 4.99 2.02 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.98 1.15 0.00 0.00 50 K 9.05 4.38 0.00 1.79 1.78 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.38 7.81 51 Y 7.86 5.07 0.00 2.87 2.76 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 52 M 9.11 4.42 0.00 2.28 2.04 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 53 C 8.46 5.46 0.00 2.97 3.07 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 54 C 8.89 4.88 0.00 2.99 3.21 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 55 N 8.88 4.62 0.00 2.81 2.96 0.00 0.00 5.93 7.72 0.00 0.00 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 T 7.69 4.33 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 1.21 0.00 0.00 57 D 8.38 4.82 0.00 2.66 2.70 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 58 K 8.67 4.07 0.00 1.96 1.94 0.00 1.64 0.00 0.00 1.81 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.33 7.81 59 C 8.03 4.11 0.00 3.08 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 60 N 7.63 4.51 0.00 2.84 2.74 0.00 0.00 6.77 7.32 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