NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 23 V 3.9982 8.0431 120.6574 63.1491 32.8881 174.8522 24 G 3.9250 8.6741 119.1978 43.7819 0.0000 168.1761 25 E 5.0365 8.3650 118.0559 55.2447 33.4842 173.5715 26 M 4.5180 8.7129 124.9131 54.3971 32.8611 175.1248 27 S 3.4988 9.7323 125.2054 59.4945 60.7785 173.4739 28 G 4.0839 8.4835 107.6820 45.4508 0.0000 174.4768 29 R 4.4037 7.7091 119.2818 54.8465 31.3280 175.7542 30 S 4.6022 8.4184 116.8930 58.3610 63.3677 173.2816 31 V 4.7156 8.4246 125.1000 61.3997 34.8391 174.2480 32 S 4.8838 8.3679 119.1801 57.3234 65.6542 173.5692 33 Q 4.3146 8.5721 122.4355 55.5601 29.8509 174.9362 34 Q 4.5148 8.1774 123.5488 54.2179 32.1732 174.7254 35 T 4.0327 8.4830 121.9637 63.4206 69.0355 174.5525 36 S 4.2461 8.5406 123.2108 58.4319 63.7280 174.5372 37 D 4.7609 8.3490 124.5814 52.1939 42.3884 177.1361 38 Q 3.9653 8.5050 118.9451 59.6679 28.8989 177.4862 39 Y 4.1047 8.1281 119.7941 60.5085 38.8516 177.6857 40 A 3.7425 8.9160 122.1560 55.2419 18.3318 179.3209 41 N 4.2076 7.9447 113.7259 56.4734 38.3421 176.8501 42 N 4.4134 8.0820 118.4762 56.3648 39.0954 176.8565 43 L 3.8111 7.7599 121.6858 57.8720 41.8709 178.6813 44 A 4.1103 7.9754 120.2542 54.3873 18.2517 178.8025 45 G 3.9470 7.1946 100.5992 43.3431 0.0000 173.7568 46 R 3.8838 7.3246 121.4347 56.8639 30.3688 175.8186 47 T 4.7540 8.2407 113.6197 59.6754 72.0032 172.5638 48 E 4.6302 8.3523 121.8224 53.8773 32.5164 175.3227 49 S 4.2231 8.6487 120.8548 57.6505 63.6326 172.4592 50 P 4.4512 0.0000 0.0000 62.5883 31.8706 175.1597 51 Q 4.6297 8.1682 120.4099 53.8583 31.1048 175.5587 52 G 3.8366 8.3863 112.5563 44.9893 0.0000 173.4051 53 S 4.3822 8.2569 114.5429 58.7796 63.4700 174.1776 54 S 4.6271 8.1449 111.8950 59.1016 67.8188 176.6430 55 L 3.9583 8.1773 122.9283 58.0792 42.0102 177.7653 56 A 4.1258 8.0800 120.0616 54.5665 18.6701 177.6819 57 S 4.8011 7.3439 109.6964 57.5158 63.2661 174.1358 58 R 4.5828 7.3522 116.7911 55.5842 34.2168 175.7770 59 I 3.9282 8.2715 121.3505 61.3813 36.6074 175.5101 60 I 4.5374 8.0959 126.3836 59.4440 39.1013 175.4142 61 E 4.6743 8.2491 122.6086 54.4898 33.4827 174.8944 62 R 4.0897 8.4732 122.3860 55.3920 30.5281 176.2151 63 L 3.9419 8.6521 125.2958 55.7787 41.9469 177.4864 64 S 4.4379 8.6805 117.9054 59.8123 63.8659 173.7343 65 S 4.6017 7.6235 113.2487 57.1227 65.5918 172.9520 66 V 4.2973 7.9674 119.6704 60.3768 33.2234 175.5363 67 A 4.2456 8.4049 128.1427 52.2400 20.0845 178.2928 68 H 4.1079 8.6176 119.6246 59.5997 29.8051 177.5194 69 S 4.3576 8.1316 115.0799 60.8262 62.6681 176.2010 70 V 3.8909 7.7339 122.0126 65.6183 31.5218 177.5945 71 I 3.8488 7.5715 119.3339 64.3637 36.9201 178.4327 72 G 3.6606 7.7114 104.9012 47.8590 0.0000 175.0957 73 F 4.1975 7.8614 122.4662 61.4463 39.2724 176.7157 74 I 3.6616 8.6286 119.4712 64.8794 36.7403 178.2964 75 Q 4.0422 8.6912 120.0873 58.4228 28.6810 178.8455 76 R 4.0108 7.8204 119.9373 58.8001 30.2987 177.3141 77 M 4.3270 7.0363 114.3373 54.7261 32.6332 175.9891 78 F 4.7676 7.9940 124.1944 57.7308 39.9314 174.6871 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 23 V 8.04 4.00 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 0.95 0.00 0.00 0.93 0.00 0.00 24 G 8.67 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 25 E 8.36 5.04 0.00 1.89 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 2.20 2.29 0.00 26 M 8.71 4.52 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 27 S 9.73 3.50 0.00 4.02 3.89 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 28 G 8.48 4.08 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 0.00 0.00 0.00 29 R 7.71 4.40 0.00 1.91 1.85 0.00 3.13 0.00 0.00 3.10 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 30 S 8.42 4.60 0.00 3.88 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 31 V 8.42 4.72 1.98 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 1.02 0.00 0.00 0.95 0.00 0.00 32 S 8.37 4.88 0.00 3.87 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 33 Q 8.57 4.31 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.73 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 34 Q 8.18 4.51 0.00 1.99 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.70 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 35 T 8.48 4.03 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 36 S 8.54 4.25 0.00 3.86 3.79 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 0.00 0.00 0.00 0.00 37 D 8.35 4.76 0.00 2.99 2.86 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 0.00 0.00 0.00 38 Q 8.51 3.97 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.94 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 39 Y 8.13 4.10 0.00 3.10 3.11 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 0.00 40 A 8.92 3.74 1.36 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 41 N 7.94 4.21 0.00 2.90 2.88 0.00 0.00 7.06 7.41 0.00 0.00 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 N 8.08 4.41 0.00 2.89 2.70 0.00 0.00 6.82 6.80 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 43 L 7.76 3.81 0.00 1.17 1.38 0.84 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 44 A 7.98 4.11 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 45 G 7.19 3.95 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 0.00 0.00 0.00 46 R 7.32 3.88 0.00 1.84 1.87 0.00 3.19 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 47 T 8.24 4.75 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 1.28 0.00 0.00 48 E 8.35 4.63 0.00 1.88 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 2.18 2.27 0.00 49 S 8.65 4.22 0.00 4.02 3.86 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 0.00 0.00 0.00 50 P 0.00 4.45 0.00 2.06 2.03 0.00 3.63 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 51 Q 8.17 4.63 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.04 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 52 G 8.39 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 0.00 0.00 0.00 53 S 8.26 4.38 0.00 3.99 3.89 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 54 S 8.14 4.63 0.00 3.98 4.08 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 55 L 8.18 3.96 0.00 1.61 1.74 0.92 1.02 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 56 A 8.08 4.13 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 57 S 7.34 4.80 0.00 4.03 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 58 R 7.35 4.58 0.00 1.88 1.81 0.00 3.21 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.94 0.00 59 I 8.27 3.93 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 1.41 0.47 0.93 0.00 0.00 60 I 8.10 4.54 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 1.42 0.78 0.91 0.00 0.00 61 E 8.25 4.67 0.00 1.89 1.78 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 2.21 2.28 0.00 62 R 8.47 4.09 0.00 1.77 1.84 0.00 3.27 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 1.61 1.65 0.00 63 L 8.65 3.94 0.00 1.68 1.65 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 64 S 8.68 4.44 0.00 3.98 3.99 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.62 4.60 0.00 3.95 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 66 V 7.97 4.30 2.10 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 0.89 0.00 0.00 0.96 0.00 0.00 67 A 8.40 4.25 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 68 H 8.62 4.11 0.00 3.23 3.29 0.00 5.68 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.13 4.36 0.00 4.08 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 70 V 7.73 3.89 2.29 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 1.19 0.00 0.00 0.97 0.00 0.00 71 I 7.57 3.85 1.86 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 1.47 0.65 0.92 0.00 0.00 72 G 7.71 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.86 4.20 0.00 3.22 3.29 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 74 I 8.63 3.66 2.20 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.97 1.12 0.00 0.00 75 Q 8.69 4.04 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.98 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 76 R 7.82 4.01 0.00 1.98 1.88 0.00 3.20 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 77 M 7.04 4.33 0.00 1.38 0.97 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 78 F 7.99 4.77 0.00 3.01 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