NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3094 8.1744 110.9422 62.2004 70.5548 173.7942 6 N 4.7905 7.8687 115.5110 53.4828 39.1358 171.5165 7 S 4.5825 8.5550 116.1228 57.7679 65.6834 173.6498 8 D 4.8712 8.5516 120.9370 54.8647 41.7344 175.7053 9 F 5.2176 8.0227 114.1410 55.3321 41.4477 173.7619 10 V 4.4230 8.7063 119.7979 61.1530 34.4241 174.2950 11 V 4.8403 8.6526 126.5414 61.2411 33.9289 174.2482 12 I 4.9250 9.1621 128.6439 59.3290 40.4777 174.1884 13 K 5.0477 9.0369 128.5006 54.2281 34.6091 174.9529 14 A 4.3929 8.7980 130.3234 52.2329 19.1268 177.4492 15 L 4.6668 8.9683 122.3899 54.6291 42.5605 175.9402 16 E 4.6627 7.6544 115.5177 54.9493 32.2200 174.4432 17 D 4.4430 8.3315 119.3398 55.7040 41.3082 177.0335 18 G 3.8816 8.4315 109.0235 45.5144 0.0000 173.8268 19 V 3.8974 7.5863 119.9151 62.8063 32.8878 174.5063 20 N 5.3008 9.0792 125.0705 51.5129 41.2976 173.6241 21 V 4.6123 8.8071 124.5904 61.3236 33.6534 174.2848 22 I 4.7202 8.7623 129.6251 59.3675 39.9822 174.8311 23 G 4.2074 8.8855 115.1985 45.0643 0.0000 172.3820 24 L 5.5527 8.8858 125.6041 52.9852 44.1122 176.2349 25 T 4.5433 8.7767 114.5387 61.7198 69.2931 174.3271 26 R 4.3622 7.8458 126.1254 56.7252 30.9990 175.0598 27 G 3.7667 8.8336 109.6014 43.6970 0.0000 173.2266 28 A 4.0535 8.5479 121.6286 54.5515 18.5478 177.7194 29 D 4.7216 7.8071 113.7893 53.3770 42.5264 175.5141 30 T 4.7764 8.2648 121.3274 61.9751 70.9244 173.2476 31 R 4.5890 8.5978 121.6736 54.6945 33.6617 174.0605 32 F 5.2628 8.5173 119.2951 57.8564 38.9649 175.2760 33 H 4.9426 8.9631 119.1115 56.4879 30.3326 174.5348 34 H 4.8397 7.7633 117.9028 54.8614 33.4062 171.8875 35 S 4.8651 8.3221 119.5869 56.4331 64.6252 172.3870 36 E 4.4001 9.2388 129.5815 54.8181 30.9359 174.5839 37 K 4.7701 8.6232 128.9277 55.6952 33.5646 175.4283 38 L 4.9337 9.1927 127.8758 53.1582 44.2943 176.1588 39 D 4.9818 9.3352 124.2325 52.6151 43.0656 175.9350 40 K 3.8892 8.7497 121.6819 58.7474 32.2159 177.0766 41 G 3.9996 9.0966 115.7277 45.0541 0.0000 173.3389 42 E 4.2812 8.0259 119.7115 56.1904 30.8647 175.9581 43 V 4.9520 8.2858 121.8956 60.9967 34.5020 174.2104 44 L 4.7432 9.1058 129.6736 53.2618 44.8116 174.8150 45 I 5.0223 8.5186 126.5643 59.6459 39.1429 174.7092 46 A 4.7186 8.9435 129.2621 50.1170 21.8091 175.2285 47 Q 4.7952 8.6146 120.9917 54.7639 30.5527 175.7923 48 F 4.8419 8.2204 120.5788 58.0453 39.5530 174.9905 49 T 4.7307 9.1529 111.5470 59.9233 72.0328 174.0289 50 E 4.1086 8.9350 121.5625 59.3267 29.5759 177.1699 51 H 4.5896 7.8866 114.5729 56.1188 29.9199 174.1966 52 T 5.5521 8.2841 116.2053 60.8779 71.2493 174.3698 53 S 4.8383 9.0020 120.0159 58.0114 64.9141 173.3038 54 A 5.0110 7.8758 121.5871 51.0103 22.6362 175.1402 55 I 5.0387 8.6038 120.6919 59.3599 40.7539 174.6964 56 K 4.5510 9.0544 128.2586 54.4989 34.7287 174.6608 57 V 4.7474 8.3801 126.7794 61.1480 33.4767 174.2751 58 R 4.4584 8.7859 128.8457 55.5344 32.2317 175.4025 59 G 4.1248 8.9997 111.7041 43.9097 0.0000 172.4672 60 K 4.5025 9.3406 120.7565 56.1575 33.0885 175.5842 61 A 5.1112 8.7529 127.8622 50.8892 23.3808 173.7945 62 Y 4.8442 9.0282 122.2370 56.2986 40.7139 174.4552 63 I 5.0116 8.4880 127.5967 59.5475 40.7038 174.4259 64 Q 5.0671 9.0564 125.5925 54.3663 31.9925 174.8770 65 T 4.7327 8.4857 112.7049 59.5206 72.3500 174.4750 66 R 3.7581 8.5332 120.4106 59.4188 29.8722 176.5828 67 H 4.6508 8.0081 112.8094 55.0107 29.5760 173.5230 68 G 3.7224 7.2483 105.7305 43.8849 0.0000 172.5861 69 V 4.2921 8.0782 119.5286 62.2230 32.5224 176.5342 70 I 4.6745 8.4483 126.3592 59.2912 42.1154 173.2680 71 E 5.1661 8.5578 125.6104 54.4287 32.1295 176.1186 72 S 4.5460 8.6212 119.0343 58.0919 64.9829 172.9399 73 E 4.8869 8.5088 120.0534 54.0135 32.7694 176.2574 74 G 3.8464 8.8573 111.2820 46.1232 0.0000 173.1082 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 5 T 8.17 4.31 4.25 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 1.22 0.00 0.00 6 N 7.87 4.79 0.00 2.77 2.80 0.00 0.00 7.30 6.75 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 7 S 8.56 4.58 0.00 4.15 3.96 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 8 D 8.55 4.87 0.00 2.82 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 9 F 8.02 5.22 0.00 3.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.71 4.42 1.96 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 0.94 0.00 0.00 0.65 0.00 0.00 11 V 8.65 4.84 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 1.09 0.00 0.00 1.16 0.00 0.00 12 I 9.16 4.93 1.87 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 1.09 0.46 0.92 0.00 0.00 13 K 9.04 5.05 0.00 1.86 1.74 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.36 7.81 14 A 8.80 4.39 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 L 8.97 4.67 0.00 1.62 1.72 1.04 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.65 4.66 0.00 2.03 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 17 D 8.33 4.44 0.00 2.69 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 18 G 8.43 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.59 3.90 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 0.95 0.00 0.00 1.06 0.00 0.00 20 N 9.08 5.30 0.00 2.59 2.60 0.00 0.00 6.29 8.13 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 21 V 8.81 4.61 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 22 I 8.76 4.72 1.42 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.44 0.08 0.00 0.00 23 G 8.89 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 24 L 8.89 5.55 0.00 1.86 1.72 0.97 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.78 4.54 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 1.38 0.00 0.00 26 R 7.85 4.36 0.00 1.89 1.97 0.00 3.19 0.00 0.00 3.07 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.43 0.00 27 G 8.83 3.77 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 0.00 0.00 0.00 28 A 8.55 4.05 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 D 7.81 4.72 0.00 2.63 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 30 T 8.26 4.78 4.25 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 1.27 0.00 0.00 31 R 8.60 4.59 0.00 1.81 1.92 0.00 2.77 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 32 F 8.52 5.26 0.00 2.91 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.96 4.94 0.00 3.18 3.50 0.00 5.77 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.76 4.84 0.00 3.31 3.10 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.32 4.87 0.00 3.75 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 36 E 9.24 4.40 0.00 2.14 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 37 K 8.62 4.77 0.00 1.78 1.68 0.00 1.79 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.52 1.39 7.81 38 L 9.19 4.93 0.00 1.56 1.53 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 39 D 9.34 4.98 0.00 2.57 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.75 3.89 0.00 1.78 1.75 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.45 1.52 7.81 41 G 9.10 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.03 4.28 0.00 1.99 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 2.32 2.40 0.00 43 V 8.29 4.95 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 0.81 0.00 0.00 0.94 0.00 0.00 44 L 9.11 4.74 0.00 1.73 1.46 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.52 5.02 1.80 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 1.30 0.79 0.79 0.00 0.00 46 A 8.94 4.72 1.13 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 47 Q 8.61 4.80 0.00 1.96 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.93 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 48 F 8.22 4.84 0.00 3.04 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 49 T 9.15 4.73 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 1.32 0.00 0.00 50 E 8.93 4.11 0.00 1.95 2.06 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 0.00 2.08 2.30 0.00 51 H 7.89 4.59 0.00 3.43 3.23 0.00 5.80 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.28 5.55 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 1.41 0.00 0.00 53 S 9.00 4.84 0.00 3.79 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 54 A 7.88 5.01 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 55 I 8.60 5.04 1.90 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.86 0.91 0.00 0.00 56 K 9.05 4.55 0.00 1.68 1.40 0.00 1.60 0.00 0.00 1.41 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.25 1.32 7.81 57 V 8.38 4.75 2.06 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 0.82 0.00 0.00 0.90 0.00 0.00 58 R 8.79 4.46 0.00 1.86 1.71 0.00 3.10 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 59 G 9.00 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 9.34 4.50 0.00 1.85 1.72 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.42 7.81 61 A 8.75 5.11 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 0.00 0.00 0.00 0.00 0.00 62 Y 9.03 4.84 0.00 3.03 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 63 I 8.49 5.01 1.92 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 1.21 0.57 0.90 0.00 0.00 64 Q 9.06 5.07 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.53 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 65 T 8.49 4.73 4.11 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 0.00 0.00 0.00 1.15 0.00 0.00 66 R 8.53 3.76 0.00 1.58 1.73 0.00 3.28 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 67 H 8.01 4.65 0.00 3.16 3.26 0.00 5.69 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 68 G 7.25 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.08 4.29 1.95 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 0.10 0.00 0.00 0.85 0.00 0.00 70 I 8.45 4.67 1.81 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 1.19 1.49 0.84 0.00 0.00 71 E 8.56 5.17 0.00 1.84 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 0.00 2.21 2.26 0.00 72 S 8.62 4.55 0.00 3.95 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 73 E 8.51 4.89 0.00 1.83 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 74 G 8.86 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00