NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 P 4.4106 0.0000 0.0000 61.5605 32.0721 174.1100 4 R 4.2534 7.8034 117.3195 52.9431 34.4327 172.8651 5 P 4.1274 0.0000 0.0000 66.2938 32.3387 178.1087 6 L 3.7119 7.9309 116.7898 57.9891 41.6043 179.3801 7 D 4.4178 8.1369 118.9159 57.0086 40.4953 178.8455 8 V 3.6241 7.6892 118.5097 65.5880 31.7204 177.7539 9 L 4.0113 7.6667 118.3404 57.9837 41.3825 178.7403 10 N 4.4288 7.8001 116.1942 56.8852 38.5726 176.1311 11 R 4.4224 7.5592 115.7773 56.8360 30.5028 176.8968 12 S 4.6985 8.5290 114.6983 57.6973 64.2795 173.8655 13 L 4.2246 7.5362 121.9947 56.3664 41.5606 177.2843 14 K 4.0869 9.2491 122.6880 56.6274 30.1457 175.9300 15 S 4.9912 7.7609 112.4941 55.4355 66.5917 171.5565 16 P 4.9158 0.0000 0.0000 63.5245 32.1666 175.5588 17 V 4.7962 8.8796 114.5204 60.4228 37.4192 173.4588 18 I 5.0908 8.6900 121.6616 59.7036 40.7486 174.9226 19 V 4.6951 9.1802 127.2983 61.0149 34.0405 173.9709 20 R 4.6732 8.1087 128.3570 54.5907 31.7752 174.7600 21 L 5.2328 8.3963 126.2820 52.4199 44.6726 176.3472 22 K 4.0727 8.1567 120.7032 58.0652 32.7211 176.2318 23 G 4.0171 8.4639 109.1312 45.2806 0.0000 173.1793 24 G 3.5905 7.3256 111.1906 45.7622 0.0000 174.7694 25 R 4.2648 7.8465 120.7638 55.9325 31.6200 175.2507 26 E 5.1921 8.9353 120.2555 54.6610 34.0883 174.8325 27 F 5.2822 9.4123 118.5805 55.9849 43.5130 174.4131 28 R 5.0325 8.8886 121.5552 54.4352 33.5247 175.4723 29 G 4.3557 8.0769 108.6669 46.8474 0.0000 171.0325 30 T 4.8824 7.7148 117.0990 62.1336 69.9962 174.6649 31 L 4.3561 8.6256 129.7714 55.7223 42.6035 176.1052 32 D 4.5525 9.3540 126.4908 55.7936 43.0250 175.7247 33 G 4.2217 7.3135 103.0269 46.0221 0.0000 170.3890 34 Y 5.8901 7.5417 115.7440 57.6785 40.2644 172.4715 35 D 4.9518 8.2050 118.8348 51.3358 42.8685 175.7776 36 I 3.3781 8.5388 111.6274 64.7053 37.2745 176.4658 37 H 4.5177 8.3190 115.3010 55.5814 28.2557 174.9830 38 M 3.1267 8.9934 119.5062 56.4137 31.3172 176.0190 39 N 4.8345 8.4356 113.2913 52.9266 39.9903 174.2238 40 L 5.3837 8.8305 120.5891 53.0070 46.5919 175.5916 41 V 4.8359 8.4166 119.7542 61.2251 34.5122 174.3340 42 L 5.3553 8.9190 127.2482 52.8895 45.5472 175.2597 43 L 4.8901 8.5415 121.4929 53.8639 44.6436 175.4951 44 D 4.7278 8.7729 123.1566 55.0612 38.3126 172.3853 45 A 5.8158 8.4711 122.2098 49.1173 23.5454 175.4935 46 E 5.0702 8.6166 117.4285 54.5170 33.7868 174.9895 47 E 3.9362 9.1633 125.8861 54.6721 30.5649 174.5211 48 I 4.7324 8.0106 121.8056 59.6055 40.2121 174.6021 49 Q 4.4462 8.4299 125.6220 55.1452 32.1046 174.4708 50 N 4.2226 10.3041 121.7927 54.1777 36.4388 174.9784 51 G 3.9791 8.5570 104.2222 45.0688 0.0000 173.4687 52 E 4.5405 8.4403 120.1509 53.7123 31.6419 175.4990 53 V 3.7278 8.4244 123.3385 63.7145 31.5314 175.4420 54 V 4.1777 8.4166 127.2975 62.1756 32.4495 175.6129 55 R 4.7105 6.8871 122.7116 56.8268 32.7465 172.5510 56 K 5.1937 8.6731 124.5590 54.8981 35.0867 175.8639 57 V 4.5292 9.0117 116.2739 59.5676 35.9285 176.9231 58 G 3.6393 9.1436 112.5981 47.8200 0.0000 173.3927 59 S 5.7159 7.0838 112.6609 58.5554 64.6945 177.1017 60 V 4.4877 7.5799 113.0347 59.8221 36.3989 174.5177 61 V 4.5153 8.3037 122.9673 61.4656 33.0224 174.7999 62 I 4.1822 8.4400 130.7124 59.4654 38.6882 176.1339 63 R 4.2368 8.7005 126.8619 56.3805 30.6750 177.4645 64 G 4.1284 10.1708 113.3244 47.5696 0.0000 174.8487 65 D 3.8047 8.1509 118.1481 56.8006 41.3357 177.0761 66 T 4.3542 8.0074 114.0008 63.3716 69.1426 174.6994 67 V 4.1206 8.2535 122.8587 62.4896 32.4283 174.4275 68 V 4.4559 8.2962 123.3394 63.7775 33.0427 175.3775 69 F 5.1071 7.4566 113.4146 55.6710 41.1566 172.2538 70 V 5.1478 8.6562 119.9670 61.2822 34.1138 174.7675 71 S 4.8568 8.8905 120.9229 56.0512 66.5712 171.9859 72 P 4.6990 0.0000 0.0000 62.2398 32.5515 176.3386 73 A 4.0882 8.5154 122.6264 52.9764 18.6971 177.1528 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 3 P 0.00 4.41 0.00 2.05 2.08 0.00 3.68 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 1.92 2.11 0.00 4 R 7.80 4.25 0.00 1.98 1.76 0.00 3.32 0.00 0.00 3.33 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 5 P 0.00 4.13 0.00 2.11 2.08 0.00 3.60 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 6 L 7.93 3.71 0.00 1.65 1.68 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.14 4.42 0.00 3.01 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 8 V 7.69 3.62 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.91 0.00 0.00 9 L 7.67 4.01 0.00 1.36 1.16 0.53 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 10 N 7.80 4.43 0.00 3.06 3.05 0.00 0.00 7.34 8.06 0.00 0.00 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 R 7.56 4.42 0.00 2.03 1.96 0.00 3.16 0.00 0.00 3.31 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 12 S 8.53 4.70 0.00 3.97 3.84 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 13 L 7.54 4.22 0.00 1.63 1.67 1.12 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 14 K 9.25 4.09 0.00 1.94 2.02 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.37 7.81 15 S 7.76 4.99 0.00 3.87 3.92 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 0.00 0.00 0.00 16 P 0.00 4.92 0.00 2.12 2.12 0.00 3.76 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 17 V 8.88 4.80 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.03 0.00 0.00 18 I 8.69 5.09 1.95 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 1.15 1.32 0.92 0.00 0.00 19 V 9.18 4.70 2.13 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 0.80 0.00 0.00 0.93 0.00 0.00 20 R 8.11 4.67 0.00 1.30 0.66 0.00 2.88 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.39 0.00 21 L 8.40 5.23 0.00 1.66 1.68 1.15 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.16 4.07 0.00 1.79 1.82 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.41 7.81 23 G 8.46 4.02 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 0.00 0.00 0.00 24 G 7.33 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.85 4.26 0.00 1.75 1.76 0.00 3.07 0.00 0.00 3.36 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 26 E 8.94 5.19 0.00 1.79 1.77 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 2.08 2.17 0.00 27 F 9.41 5.28 0.00 2.89 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 28 R 8.89 5.03 0.00 1.75 1.81 0.00 3.21 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 29 G 8.08 4.36 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 0.00 30 T 7.71 4.88 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 1.23 0.00 0.00 31 L 8.63 4.36 0.00 1.85 1.59 1.11 1.03 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 32 D 9.35 4.55 0.00 2.65 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.31 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 34 Y 7.54 5.89 0.00 2.97 2.95 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 35 D 8.20 4.95 0.00 2.86 2.77 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 36 I 8.54 3.38 1.82 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.33 0.91 0.00 0.00 37 H 8.32 4.52 0.00 3.43 3.33 0.00 5.77 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 M 8.99 3.13 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 39 N 8.44 4.83 0.00 2.97 2.73 0.00 0.00 6.81 6.13 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 40 L 8.83 5.38 0.00 1.49 1.50 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.42 4.84 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.90 0.00 0.00 42 L 8.92 5.36 0.00 1.53 1.51 0.87 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.54 4.89 0.00 1.57 1.54 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.77 4.73 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 45 A 8.47 5.82 1.43 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 0.00 0.00 46 E 8.62 5.07 0.00 1.85 1.75 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 2.27 2.27 0.00 47 E 9.16 3.94 0.00 1.32 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.49 0.00 48 I 8.01 4.73 1.80 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.45 0.89 0.00 0.00 49 Q 8.43 4.45 0.00 2.04 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.16 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 50 N 10.30 4.22 0.00 2.84 2.83 0.00 0.00 7.39 7.65 0.00 0.00 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 G 8.56 3.98 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 0.00 0.00 0.00 52 E 8.44 4.54 0.00 2.01 1.81 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 2.20 2.18 0.00 53 V 8.42 3.73 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 0.72 0.00 0.00 0.91 0.00 0.00 54 V 8.42 4.18 2.17 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 0.73 0.00 0.00 0.95 0.00 0.00 55 R 6.89 4.71 0.00 1.90 1.67 0.00 3.17 0.00 0.00 3.47 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.42 0.00 56 K 8.67 5.19 0.00 1.65 1.68 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.42 7.81 57 V 9.01 4.53 2.14 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 0.81 0.00 0.00 1.07 0.00 0.00 58 G 9.14 3.64 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 0.00 0.00 0.00 59 S 7.08 5.72 0.00 3.96 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 60 V 7.58 4.49 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 0.75 0.00 0.00 0.59 0.00 0.00 61 V 8.30 4.52 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 0.78 0.00 0.00 0.90 0.00 0.00 62 I 8.44 4.18 1.72 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.06 0.80 0.00 0.00 63 R 8.70 4.24 0.00 1.81 1.86 0.00 3.29 0.00 0.00 3.32 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.57 0.00 64 G 10.17 4.13 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 0.00 0.00 0.00 65 D 8.15 3.80 0.00 2.63 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.01 4.35 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 1.22 0.00 0.00 67 V 8.25 4.12 2.17 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 0.74 0.00 0.00 0.91 0.00 0.00 68 V 8.30 4.46 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 1.02 0.00 0.00 0.92 0.00 0.00 69 F 7.46 5.11 0.00 3.03 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 70 V 8.66 5.15 2.13 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 0.90 0.00 0.00 0.95 0.00 0.00 71 S 8.89 4.86 0.00 3.98 4.05 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 0.00 0.00 0.00 72 P 0.00 4.70 0.00 1.97 2.05 0.00 3.85 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 2.03 2.10 0.00 73 A 8.52 4.09 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