NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 E 4.3259 8.4449 121.4622 56.1152 30.4892 177.3014 10 K 4.4963 9.0082 121.5073 56.3486 34.4172 174.1077 11 K 4.7507 8.3638 121.8330 55.3167 34.0610 175.1319 12 Y 5.4062 9.2118 122.0945 56.3105 43.0599 174.1522 13 I 4.9543 9.2398 121.3488 59.6920 40.5017 174.9621 14 V 4.3529 9.1478 127.5396 61.0948 33.2459 174.7739 15 G 3.0146 7.9891 116.2951 45.0619 0.0000 172.3212 16 F 5.1461 8.6845 122.4133 55.2196 41.8390 175.9938 17 K 4.4951 8.6769 121.7198 55.8014 33.3495 176.9206 18 Q 4.1729 8.6270 119.6547 57.4723 29.0557 177.0002 19 G 3.8284 9.0935 108.3323 45.5506 0.0000 173.7722 20 F 4.5826 7.5572 116.9741 56.4700 39.8410 176.8096 21 K 3.9840 8.2374 123.9648 59.3760 32.5939 177.7609 22 S 4.1916 7.7613 113.2122 58.0087 63.8689 175.1452 23 C 4.1551 8.7918 127.9871 59.6744 40.7909 175.5248 24 A 3.9039 7.9255 121.9366 55.1008 17.7245 179.6372 25 K 3.9546 7.9682 116.8598 59.4804 32.1603 179.7981 26 K 3.2561 7.6740 118.2349 59.2200 31.8260 179.0266 27 E 3.9533 8.4385 119.9470 59.2943 29.5198 178.4694 28 D 4.3330 8.1106 119.0002 57.4827 40.7184 178.9719 29 V 3.9256 7.4163 118.5431 65.4553 31.4846 178.2575 30 I 3.7340 7.7221 119.2712 64.5032 37.0361 178.6420 31 S 4.5136 9.1477 117.2352 60.5670 62.4537 176.1325 32 E 3.9385 8.4298 120.4596 58.4970 29.5219 178.1444 33 K 4.3260 7.4573 114.8276 55.9931 32.1060 177.3502 34 G 3.8653 8.4311 107.3765 45.5608 0.0000 174.2910 35 G 3.9259 7.8745 107.5045 45.6981 0.0000 173.1896 36 K 4.9146 8.6604 119.4679 53.8511 34.7740 175.9292 37 L 4.1446 8.7078 128.0349 55.8646 42.0049 176.1921 38 Q 4.4855 9.1188 125.3090 57.3865 30.6072 176.3168 39 K 4.3679 7.6102 116.7432 55.5802 36.3607 173.6346 40 C 4.6739 8.6575 124.9962 55.7992 41.1704 173.7550 41 F 4.7976 8.1268 122.9228 57.5753 39.0606 175.7937 42 K 3.9961 8.8188 121.7388 58.7851 32.5753 177.1512 43 Y 4.6150 7.7213 113.7118 59.3493 39.3097 176.6779 44 V 3.9377 7.7766 118.5415 62.9011 32.7206 176.4176 45 D 4.7577 8.7000 128.0289 52.2769 39.4542 174.2025 46 A 5.2803 7.5948 122.4240 51.4457 23.6074 175.5703 47 A 4.3833 8.8192 120.0035 50.2682 23.1362 175.9817 48 S 4.9606 8.4486 116.1517 58.1560 64.8960 173.1352 49 A 5.2250 9.1685 123.3450 50.9826 23.2173 174.7820 50 T 5.1215 8.8720 110.6656 60.3070 71.0897 173.8389 51 L 5.1166 8.9559 124.8955 53.1428 46.0733 176.2352 52 N 4.7988 8.7422 120.7124 51.7175 39.2680 175.7510 53 E 3.9686 8.6580 117.0913 59.2900 29.2710 179.5767 54 K 3.8888 8.0460 119.0885 59.3351 32.3193 178.4235 55 A 3.9171 8.2763 121.0927 55.2226 18.1982 179.6591 56 V 3.2345 7.5749 116.5667 66.0379 31.3925 177.8227 57 E 3.8436 7.9489 118.6740 59.4771 29.2770 178.7315 58 E 3.9633 8.0617 117.3800 59.1940 29.7752 179.0353 59 L 4.0211 8.1008 119.4992 57.6401 41.4615 179.6270 60 K 3.9653 8.0007 117.4365 58.7250 32.0187 178.5938 61 K 4.3515 7.3724 116.6836 55.6321 32.6423 176.0842 62 D 4.5126 7.5017 121.0947 52.7151 41.4198 175.1532 63 P 4.2553 0.0000 0.0000 65.5522 31.7074 177.7160 64 S 4.1902 9.0297 114.7594 60.4821 63.8426 174.1438 65 V 3.9741 7.5687 120.2754 61.2773 31.4787 175.9060 66 A 4.3648 8.5273 131.3148 54.8326 19.2804 176.7046 67 Y 4.6918 6.7337 110.2010 56.3424 41.1373 173.7357 68 V 5.0072 8.5653 120.2631 61.1946 34.1197 174.3282 69 E 5.0367 9.4063 125.2516 54.2478 33.3075 175.0413 70 E 4.2398 8.9214 120.4330 56.6852 30.3408 177.2812 71 D 4.8477 8.4653 125.3545 53.0377 39.3055 175.9825 72 K 4.3260 8.1068 121.7913 55.5791 34.2966 177.1228 73 L 4.5870 8.0836 119.3169 53.9043 42.7418 176.0397 74 Y 4.5816 8.5572 119.7859 56.1629 40.6487 175.3805 75 R 4.6785 8.2345 120.6583 53.6914 33.9502 175.2615 76 A 3.9985 8.6706 123.4017 53.2329 19.0448 178.5237 77 L 4.5741 8.3072 124.7031 54.1938 41.5518 176.8915 78 S 4.7111 7.7230 113.5991 56.8454 65.1368 174.9382 79 A 4.3294 8.4475 125.9706 52.3190 19.0040 176.0663 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 9 E 8.44 4.33 0.00 1.93 1.34 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 2.21 2.36 0.00 10 K 9.01 4.50 0.00 1.82 1.87 0.00 1.74 0.00 0.00 1.88 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.53 1.56 7.81 11 K 8.36 4.75 0.00 1.57 1.67 0.00 1.59 0.00 0.00 1.80 0.00 0.00 2.77 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.39 7.81 12 Y 9.21 5.41 0.00 2.92 2.91 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 13 I 9.24 4.95 2.13 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 1.36 0.89 1.26 0.00 0.00 14 V 9.15 4.35 1.91 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 0.26 0.00 0.00 0.82 0.00 0.00 15 G 7.99 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.68 5.15 0.00 2.84 2.84 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 17 K 8.68 4.50 0.00 1.74 1.89 0.00 1.96 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.54 7.81 18 Q 8.63 4.17 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.79 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 19 G 9.09 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 0.00 0.00 0.00 20 F 7.56 4.58 0.00 2.89 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 21 K 8.24 3.98 0.00 1.71 1.80 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.42 7.81 22 S 7.76 4.19 0.00 3.87 3.63 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 23 C 8.79 4.16 0.00 2.96 3.01 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.93 3.90 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 25 K 7.97 3.95 0.00 1.97 1.94 0.00 1.51 0.00 0.00 1.29 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.40 7.81 26 K 7.67 3.26 0.00 1.69 1.35 0.00 1.44 0.00 0.00 1.26 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.30 1.33 7.81 27 E 8.44 3.95 0.00 2.03 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 0.00 2.30 2.35 0.00 28 D 8.11 4.33 0.00 3.03 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 29 V 7.42 3.93 2.47 0.00 0.00 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 1.01 0.00 0.00 30 I 7.72 3.73 2.03 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 1.59 0.53 0.90 0.00 0.00 31 S 9.15 4.51 0.00 4.01 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 32 E 8.43 3.94 0.00 2.19 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.28 0.00 33 K 7.46 4.33 0.00 1.81 1.98 0.00 1.85 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.39 1.35 7.81 34 G 8.43 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 0.00 0.00 0.00 35 G 7.87 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 36 K 8.66 4.91 0.00 1.70 1.72 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.34 1.35 7.81 37 L 8.71 4.14 0.00 1.62 1.57 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 9.12 4.49 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.32 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 39 K 7.61 4.37 0.00 1.88 1.55 0.00 1.53 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.43 1.48 7.81 40 C 8.66 4.67 0.00 2.82 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.13 4.80 0.00 3.28 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 42 K 8.82 4.00 0.00 1.50 1.36 0.00 1.50 0.00 0.00 1.12 0.00 0.00 2.55 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 1.05 7.81 43 Y 7.72 4.62 0.00 3.05 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 44 V 7.78 3.94 2.19 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 1.02 0.00 0.00 0.94 0.00 0.00 45 D 8.70 4.76 0.00 2.89 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 46 A 7.59 5.28 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.82 4.38 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.45 4.96 0.00 3.94 4.07 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 49 A 9.17 5.22 1.24 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 0.00 0.00 0.00 50 T 8.87 5.12 4.29 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 1.24 0.00 0.00 51 L 8.96 5.12 0.00 1.50 1.47 0.62 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 52 N 8.74 4.80 0.00 2.96 2.99 0.00 0.00 6.27 7.66 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 53 E 8.66 3.97 0.00 2.04 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 0.00 2.42 2.41 0.00 54 K 8.05 3.89 0.00 1.80 1.78 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.58 1.48 7.81 55 A 8.28 3.92 1.38 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 56 V 7.57 3.23 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 0.77 0.00 0.00 0.30 0.00 0.00 57 E 7.95 3.84 0.00 2.23 2.00 0.00 0.00 0.00 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 2.32 0.00 58 E 8.06 3.96 0.00 2.07 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 0.00 2.31 2.41 0.00 59 L 8.10 4.02 0.00 1.70 1.50 0.82 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.00 3.97 0.00 1.80 1.83 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.55 7.81 61 K 7.37 4.35 0.00 1.76 1.82 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.39 7.81 62 D 7.50 4.51 0.00 2.76 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.26 0.00 2.10 2.13 0.00 3.73 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 64 S 9.03 4.19 0.00 3.50 3.17 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 0.00 0.00 0.00 0.00 65 V 7.57 3.97 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 0.43 0.00 0.00 0.52 0.00 0.00 66 A 8.53 4.36 1.19 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 0.00 0.00 67 Y 6.73 4.69 0.00 3.00 2.99 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 68 V 8.57 5.01 1.99 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 0.62 0.00 0.00 0.75 0.00 0.00 69 E 9.41 5.04 0.00 2.10 2.07 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 2.60 2.41 0.00 70 E 8.92 4.24 0.00 1.89 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 2.28 2.38 0.00 71 D 8.47 4.85 0.00 2.57 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.11 4.33 0.00 1.85 1.81 0.00 1.54 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.57 1.29 7.81 73 L 8.08 4.59 0.00 1.60 1.61 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 8.56 4.58 0.00 2.93 2.91 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 75 R 8.23 4.68 0.00 1.74 1.79 0.00 3.21 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 76 A 8.67 4.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.31 4.57 0.00 1.65 1.67 0.94 0.89 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 78 S 7.72 4.71 0.00 3.85 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 79 A 8.45 4.33 1.20 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 0.00 0.00