NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.4207 8.1744 117.3259 63.5241 70.2835 172.4218 3 V 4.4025 8.3030 122.9676 61.0793 34.5018 172.9602 4 S 5.1393 9.0940 122.0899 56.9955 68.1841 173.0976 5 I 4.0054 8.7504 123.0511 61.4533 38.1639 176.7922 6 Q 4.6281 8.4754 120.8818 55.7331 30.0653 175.2268 7 M 4.6099 7.3937 113.2773 53.7139 33.6947 174.3046 8 A 4.1389 8.5182 123.1684 51.5380 19.8512 178.7084 9 G 3.9204 6.5159 105.9250 46.0777 0.0000 170.6959 10 N 5.2431 7.9444 116.6477 51.3588 42.5840 174.5102 11 L 4.0638 9.0276 126.4930 53.6101 40.3835 176.6654 12 W 4.5293 8.4348 133.1326 58.8202 31.2803 175.2912 13 K 4.6834 8.3235 116.4640 55.0966 36.7108 174.8206 14 V 4.5714 8.1184 119.9958 61.7065 34.5697 174.5406 15 H 5.0382 9.0165 120.5945 55.4299 30.4729 173.7516 16 V 4.5738 7.7876 111.6442 59.6542 34.1683 174.5518 17 K 4.5778 7.9533 118.2374 54.9622 35.3352 175.3343 18 A 4.2734 8.3805 123.0236 54.0433 18.5220 178.3150 19 G 3.9084 9.1223 112.2132 44.9590 0.0000 172.9751 20 D 4.6908 7.8707 119.9262 54.0678 42.8971 174.2664 21 Q 5.2001 8.4966 121.2255 54.1214 32.1161 173.9689 22 I 5.0390 8.8168 117.7324 58.0140 41.7269 173.7825 23 E 4.8689 8.3758 121.7487 53.5644 32.6873 174.5656 24 K 3.9865 8.4013 125.7815 58.5541 32.3654 177.1629 25 G 3.9722 9.0433 115.1092 45.1166 0.0000 173.3589 26 Q 4.1580 8.0534 122.0527 55.7516 30.1737 175.2858 27 E 4.3720 8.7508 126.0523 56.9325 30.1676 176.3754 28 V 4.5197 8.9908 121.4122 63.7999 35.5667 174.2251 29 A 4.6911 7.6323 119.7645 51.2387 22.5122 174.7789 30 I 5.0516 8.8631 118.1027 59.7006 41.9067 174.7980 31 L 5.0546 8.9724 127.2000 53.2899 45.0170 174.5488 32 E 4.7898 9.2221 128.2625 55.3559 31.1335 174.7229 33 S 4.6647 9.0543 119.8189 57.9822 66.9259 174.5022 34 M 3.3300 9.2004 118.6680 56.1252 29.2817 177.0066 35 K 3.8397 8.2898 113.5934 57.5821 30.1685 174.2302 36 M 4.8245 8.1052 116.1136 53.8906 36.4201 173.7600 37 E 4.9790 8.2791 118.0057 54.7586 32.5904 176.1365 38 I 4.6929 8.5438 123.8350 58.6300 41.1831 173.4863 39 P 4.7668 0.0000 0.0000 62.9355 32.5146 175.4596 40 I 4.6471 8.7562 121.4876 59.6848 40.1851 175.1780 41 V 4.9948 8.2897 118.3916 59.0118 35.5378 175.2202 42 A 4.1035 8.8699 126.0130 52.0020 18.5028 178.5963 43 D 4.2716 8.9502 123.0917 56.8140 41.7318 175.9375 44 R 4.6083 7.2859 112.5030 54.8916 31.8635 174.5832 45 S 4.4874 8.5281 115.3434 57.8173 63.7034 173.7662 46 G 4.2256 7.7345 111.0926 46.1034 0.0000 171.7455 47 I 4.4759 7.5395 120.9553 60.8700 38.7727 175.8513 48 V 4.0985 8.8813 127.3602 62.8457 31.6945 176.5065 49 K 4.0971 8.8973 130.8416 59.2363 32.7603 176.2605 50 E 4.7590 7.8294 117.8846 55.2040 33.1977 173.7078 51 V 4.6566 8.3136 123.0208 61.2024 33.6361 175.2707 52 K 4.5259 9.0794 126.2048 56.4635 32.8717 175.8497 53 K 4.7213 7.7657 118.4978 54.6776 36.6266 174.5532 54 K 4.6379 8.0244 117.3826 54.9633 35.5647 175.2916 55 E 4.1732 8.5840 118.9461 58.2600 29.4551 178.1221 56 G 3.9318 9.0647 112.2991 45.3005 0.0000 173.1057 57 D 4.6422 7.7319 119.6215 53.6710 42.5687 175.2868 58 F 4.6531 8.7761 125.7029 58.7305 40.2986 174.4436 59 V 4.6156 7.2924 116.3648 59.6858 36.8410 173.0089 60 N 5.1225 8.1344 119.2578 51.9006 43.1416 172.8673 61 E 4.1732 8.5913 122.4305 57.6279 29.6915 176.9029 62 G 3.9213 9.0406 115.2814 45.3257 0.0000 172.5385 63 D 4.4811 8.0050 120.8314 53.2361 41.8199 175.8740 64 V 3.7573 8.2473 125.7468 62.6849 32.5759 174.6084 65 L 4.6124 8.8903 128.5187 56.4443 43.9134 175.7100 66 L 4.8274 7.3672 116.2503 55.0583 43.8186 172.8579 67 E 5.0294 9.2365 119.5004 54.4803 33.3950 173.9752 68 L 5.3300 8.2335 122.2228 52.6278 45.8791 175.9538 69 S 4.6685 8.8097 115.2915 58.4444 63.3320 175.4513 70 N 4.9129 7.9036 114.1603 54.4246 40.7175 174.7849 71 S 4.3022 7.8531 111.0611 59.0888 62.9380 174.2352 72 T 3.2405 7.7112 112.7239 66.0321 66.1276 172.5869 73 Q 3.5733 8.2096 125.4187 56.5503 28.9541 174.2080 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 T 8.17 4.42 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 1.27 0.00 0.00 3 V 8.30 4.40 2.08 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 0.87 0.00 0.00 0.93 0.00 0.00 4 S 9.09 5.14 0.00 3.75 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 5 I 8.75 4.01 1.98 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 1.32 0.94 0.90 0.00 0.00 6 Q 8.48 4.63 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.72 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 7 M 7.39 4.61 0.00 2.05 1.95 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 8 A 8.52 4.14 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 9 G 6.52 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 0.00 0.00 0.00 10 N 7.94 5.24 0.00 2.71 2.74 0.00 0.00 7.15 6.67 0.00 0.00 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 L 9.03 4.06 0.00 1.74 1.57 0.98 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 12 W 8.43 4.53 0.00 3.26 3.38 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 13 K 8.32 4.68 0.00 1.89 1.63 0.00 1.44 0.00 0.00 1.40 0.00 0.00 2.13 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.96 0.49 7.81 14 V 8.12 4.57 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 0.87 0.00 0.00 0.90 0.00 0.00 15 H 9.02 5.04 0.00 3.06 3.26 0.00 5.68 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 V 7.79 4.57 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 0.91 0.00 0.00 0.93 0.00 0.00 17 K 7.95 4.58 0.00 1.88 1.85 0.00 1.52 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.44 7.81 18 A 8.38 4.27 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 19 G 9.12 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.87 4.69 0.00 2.90 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 21 Q 8.50 5.20 0.00 2.05 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.26 0.00 22 I 8.82 5.04 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 1.27 1.33 0.92 0.00 0.00 23 E 8.38 4.87 0.00 1.96 1.76 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 2.26 2.26 0.00 24 K 8.40 3.99 0.00 1.76 1.74 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.59 7.81 25 G 9.04 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 0.00 0.00 0.00 26 Q 8.05 4.16 0.00 2.22 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 27 E 8.75 4.37 0.00 2.04 1.87 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 0.00 2.42 2.37 0.00 28 V 8.99 4.52 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 1.00 0.00 0.00 1.03 0.00 0.00 29 A 7.63 4.69 1.21 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 30 I 8.86 5.05 2.28 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.27 0.79 0.00 0.00 31 L 8.97 5.05 0.00 1.62 1.61 0.91 0.73 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 32 E 9.22 4.79 0.00 2.20 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 2.28 2.33 0.00 33 S 9.05 4.66 0.00 3.92 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 M 9.20 3.33 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 35 K 8.29 3.84 0.00 1.84 1.85 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.44 7.81 36 M 8.11 4.82 0.00 1.91 1.85 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.43 0.00 37 E 8.28 4.98 0.00 1.29 1.21 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 1.47 1.74 0.00 38 I 8.54 4.69 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.63 0.87 0.00 0.00 39 P 0.00 4.77 0.00 2.07 2.05 0.00 3.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 40 I 8.76 4.65 1.99 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 1.23 0.97 0.91 0.00 0.00 41 V 8.29 4.99 2.21 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 0.80 0.00 0.00 0.93 0.00 0.00 42 A 8.87 4.10 1.32 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 0.00 0.00 43 D 8.95 4.27 0.00 2.63 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 44 R 7.29 4.61 0.00 1.91 1.84 0.00 3.09 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00 45 S 8.53 4.49 0.00 3.89 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 46 G 7.73 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 47 I 7.54 4.48 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 0.90 0.96 0.00 0.00 48 V 8.88 4.10 2.23 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 1.03 0.00 0.00 0.97 0.00 0.00 49 K 8.90 4.10 0.00 1.88 1.90 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.38 7.81 50 E 7.83 4.76 0.00 2.05 1.71 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 2.29 2.29 0.00 51 V 8.31 4.66 2.08 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 1.04 0.00 0.00 0.93 0.00 0.00 52 K 9.08 4.53 0.00 1.74 1.83 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.55 7.81 53 K 7.77 4.72 0.00 1.67 1.67 0.00 1.80 0.00 0.00 1.82 0.00 0.00 3.14 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.36 7.81 54 K 8.02 4.64 0.00 1.86 1.85 0.00 1.51 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.45 7.81 55 E 8.58 4.17 0.00 1.91 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 2.21 2.26 0.00 56 G 9.06 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 57 D 7.73 4.64 0.00 2.89 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 58 F 8.78 4.65 0.00 3.08 2.96 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 0.00 0.00 0.00 59 V 7.29 4.62 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 1.08 0.00 0.00 0.80 0.00 0.00 60 N 8.13 5.12 0.00 2.66 2.60 0.00 0.00 6.31 7.75 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 61 E 8.59 4.17 0.00 1.95 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 2.28 2.40 0.00 62 G 9.04 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 0.00 0.00 0.00 63 D 8.01 4.48 0.00 2.79 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 64 V 8.25 3.76 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 1.17 0.00 0.00 0.94 0.00 0.00 65 L 8.89 4.61 0.00 1.75 1.79 0.91 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 66 L 7.37 4.83 0.00 1.94 1.72 0.92 0.45 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 67 E 9.24 5.03 0.00 2.00 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 2.19 2.26 0.00 68 L 8.23 5.33 0.00 1.56 1.59 0.97 1.36 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 69 S 8.81 4.67 0.00 3.72 3.87 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 0.00 0.00 0.00 0.00 70 N 7.90 4.91 0.00 2.70 2.68 0.00 0.00 6.85 7.77 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 71 S 7.85 4.30 0.00 4.02 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 72 T 7.71 3.24 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 73 Q 8.21 3.57 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.65 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00