NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9014 8.3544 109.7371 44.8128 0.0000 172.7703 2 S 3.9139 8.1364 118.3006 61.1285 62.6339 173.7998 3 S 4.5800 8.0544 122.1094 56.7286 63.1115 173.0276 4 G 4.1584 8.1943 113.2093 43.3790 0.0000 170.6197 5 S 4.6353 8.4366 115.8782 56.8831 64.1738 175.0219 6 S 4.7441 8.4226 122.9336 57.6998 62.0087 171.9258 7 G 4.5815 7.8309 106.2287 45.3554 0.0000 172.3949 8 L 4.5683 8.4067 117.9289 53.6018 46.7745 175.5594 9 I 4.7671 9.1911 125.6365 59.9468 38.0831 173.9763 10 A 4.8847 8.9640 130.1737 51.3117 20.2587 175.4936 11 C 4.7507 9.5534 124.6249 58.2038 32.8573 172.4016 12 V 4.7390 7.9760 124.0369 61.4626 32.2666 175.6156 13 A 4.4183 8.8483 128.8611 53.1796 20.0627 177.0608 14 N 4.7243 8.2463 113.7352 52.5943 37.6354 175.3785 15 D 4.5182 8.7397 124.1557 56.0497 39.9558 178.1703 16 D 4.5112 8.4237 120.0715 57.4216 40.9907 178.3866 17 V 3.6363 7.5746 117.1499 65.7702 31.5384 175.6610 18 F 4.3110 7.9161 117.6717 57.4499 39.0785 175.2229 19 S 4.6561 7.4251 112.7977 56.5103 65.5831 173.0441 20 E 4.1369 8.5819 120.9961 56.8041 29.4049 177.5479 21 S 3.9389 7.2744 114.3300 60.8553 63.7072 173.5288 22 E 4.8257 8.0845 122.4736 56.4963 34.8665 178.8317 23 T 3.9324 8.3140 114.5146 66.8795 68.6164 175.6536 24 R 3.9436 8.1364 119.7630 59.7841 30.1722 177.8834 25 A 3.8481 8.0813 119.6809 55.4073 18.2671 179.6216 26 K 4.0300 8.0407 115.3434 59.5810 32.1485 178.7124 27 F 4.3584 8.5125 119.2402 61.4868 39.6269 176.6935 28 E 4.1200 8.4934 117.6099 59.6372 29.3609 178.9328 29 S 3.9972 8.4345 113.4167 61.5901 62.1671 176.1446 30 L 3.6509 7.2448 120.5408 57.8301 41.6552 179.2630 31 F 4.4102 8.4739 117.1623 60.1286 38.0163 177.8761 32 R 4.3027 8.4343 119.2105 59.4274 29.4853 177.6079 33 T 3.9199 7.7125 111.5583 66.3759 67.1718 174.5901 34 Y 4.4526 7.6792 118.1260 58.3680 38.4322 174.9615 35 D 5.1347 7.8774 116.9853 52.8432 43.5025 177.7832 36 K 4.1986 8.5421 120.6965 57.9440 32.9673 177.1138 37 D 4.6880 8.0328 116.2227 54.2125 41.2024 175.6686 38 T 4.1318 7.7278 109.2372 62.1646 69.3686 173.7571 39 T 4.6752 8.5377 116.7213 60.0128 71.4356 173.3700 40 F 4.8006 8.8546 122.0267 55.6412 41.9887 174.5758 41 Q 4.1499 8.6195 124.1003 54.3946 31.4652 173.3397 42 Y 4.4568 8.3188 124.5576 57.1322 39.0266 175.6968 43 F 4.8999 9.2064 123.4753 55.1451 40.5359 174.9141 44 K 3.9124 8.7612 124.6219 57.8402 32.5844 175.6225 45 S 4.4146 8.7820 122.0936 58.7441 61.7574 170.8231 46 F 4.1551 7.8079 114.3764 57.6332 39.1542 175.3808 47 K 3.9312 7.3959 120.2403 57.6604 30.3154 174.0335 48 R 5.0840 8.1509 115.0852 54.6104 35.1437 176.2110 49 V 4.4578 8.4834 120.2472 61.3351 34.5047 174.2070 50 R 4.5562 9.1075 130.5700 55.8447 31.4029 175.2420 51 I 4.1369 8.7251 129.0359 59.5357 39.0187 174.5566 52 N 5.0859 8.4683 125.8090 52.2606 40.2439 174.9940 53 F 5.0379 9.3308 121.8182 55.8305 41.7832 175.5981 54 S 4.5847 8.5433 113.3204 59.2086 63.4711 174.1216 55 N 5.0771 7.7405 117.9399 50.5011 39.8816 173.1624 56 P 4.4537 0.0000 0.0000 64.1426 31.3247 177.9435 57 L 4.1192 7.2828 120.3302 56.9666 41.6122 178.3995 58 S 3.8914 8.5019 112.3336 62.0158 62.2746 176.7041 59 A 2.5800 7.2912 120.6356 54.8793 18.1715 179.0613 60 A 4.0946 8.0307 119.3494 55.4355 18.5402 179.3636 61 D 4.2291 7.9245 116.1023 57.5357 40.6467 179.0213 62 A 3.8738 7.8569 120.4794 54.7328 18.4886 179.5667 63 R 3.9664 8.1805 118.1088 59.3959 30.1045 178.5109 64 L 3.9515 7.7231 117.1059 58.8687 40.4319 178.2107 65 R 4.2617 8.1384 116.1923 57.0560 30.8935 176.6014 66 L 4.7315 7.3645 119.6693 55.0583 44.5515 174.7304 67 H 4.4521 8.7463 119.4372 57.3338 27.9106 177.6302 68 K 4.0823 8.8080 113.4578 59.5220 32.0257 176.7581 69 T 3.6910 7.7970 107.6218 61.1836 68.6756 172.8062 70 E 4.0266 8.6895 125.5946 56.5253 28.0990 175.6590 71 F 4.2934 9.2157 126.4092 58.1654 38.6278 175.0944 72 L 3.3150 9.1966 126.3548 55.7005 38.9397 175.4187 73 G 4.0881 8.3903 108.4348 45.0190 0.0000 174.3654 74 K 4.6105 8.0697 119.9936 54.2960 34.0569 175.8055 75 E 4.6918 9.0312 127.0470 56.8127 29.8455 175.5765 76 M 4.8870 8.6616 125.2713 53.9669 35.6861 174.2917 77 K 4.8525 8.9237 121.0458 54.8476 36.5338 175.3957 78 L 5.1809 8.2583 120.4020 53.9985 45.6719 175.0412 79 Y 4.7489 9.2054 121.6687 55.9630 41.6494 175.3725 80 F 4.4417 9.1236 121.4949 56.7023 39.3268 174.7297 81 A 3.9241 8.7459 126.3976 52.0663 18.7190 176.8528 82 Q 3.8517 8.9220 124.0428 57.2894 28.9660 176.7041 83 T 3.2431 8.2524 116.1515 62.6113 69.3226 170.8380 84 L 4.3732 8.2304 117.9233 56.4043 42.6287 176.3734 85 H 4.9622 7.3364 110.9303 53.0356 31.8341 172.4529 86 I 3.7131 8.3678 119.2376 62.0002 39.1581 173.6486 87 G 3.9539 8.1613 112.3939 44.0635 0.0000 173.0983 88 S 3.8329 9.0854 123.7649 56.8555 63.1376 170.5090 89 S 4.3170 8.5771 122.6858 58.9331 63.1254 173.1762 90 H 4.8225 8.3198 121.2335 53.1952 32.3657 171.7150 91 L 3.7432 8.7085 121.2001 55.5636 41.5781 176.8604 92 A 4.0659 8.6480 128.9669 51.8567 18.7654 175.1933 93 P 4.4903 0.0000 0.0000 61.5404 32.1945 174.4515 94 P 4.4937 0.0000 0.0000 62.0076 32.0371 175.3368 95 N 4.0712 8.4696 116.0090 51.9023 37.7348 173.5789 96 P 4.6028 0.0000 0.0000 62.5229 32.7665 174.6320 97 D 4.7821 8.0879 115.6758 51.2177 42.3206 174.6617 98 K 3.7951 8.4384 120.9879 57.4459 32.4517 175.7783 99 S 4.5561 7.9457 117.0703 58.0588 64.8458 176.1061 100 G 4.0027 8.3303 110.1875 42.7223 0.0000 170.0979 101 P 4.3336 0.0000 0.0000 62.6628 32.2008 177.2937 102 S 4.6020 8.2225 117.4356 56.9865 64.8540 173.6277 103 S 4.5385 8.2898 116.1303 58.3334 63.8876 174.4678 104 G 3.7168 8.1905 108.5736 46.0576 0.0000 172.7552 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 1 G 8.35 3.90 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 0.00 0.00 0.00 2 S 8.14 3.91 0.00 3.92 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 3 S 8.05 4.58 0.00 3.88 3.80 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 0.00 0.00 0.00 4 G 8.19 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.44 4.64 0.00 3.84 3.81 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 0.00 0.00 0.00 6 S 8.42 4.74 0.00 3.94 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 7 G 7.83 4.58 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 0.00 0.00 0.00 8 L 8.41 4.57 0.00 1.71 1.48 0.59 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 9 I 9.19 4.77 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 1.18 1.01 0.95 0.00 0.00 10 A 8.96 4.88 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.55 4.75 0.00 3.23 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.98 4.74 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 0.75 0.00 0.00 0.71 0.00 0.00 13 A 8.85 4.42 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 N 8.25 4.72 0.00 3.11 3.00 0.00 0.00 7.10 8.44 0.00 0.00 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 D 8.74 4.52 0.00 2.75 2.78 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 16 D 8.42 4.51 0.00 2.90 2.81 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 0.00 0.00 0.00 17 V 7.57 3.64 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 0.32 0.00 0.00 1.21 0.00 0.00 18 F 7.92 4.31 0.00 3.14 3.03 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.43 4.66 0.00 3.84 3.65 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 0.00 0.00 0.00 0.00 20 E 8.58 4.14 0.00 2.04 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 0.00 2.22 2.35 0.00 21 S 7.27 3.94 0.00 3.86 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 22 E 8.08 4.83 0.00 1.95 1.90 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 2.16 2.17 0.00 23 T 8.31 3.93 4.30 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 1.33 0.00 0.00 24 R 8.14 3.94 0.00 1.92 1.79 0.00 2.21 0.00 0.00 2.79 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.29 0.00 25 A 8.08 3.85 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 0.00 0.00 0.00 0.00 0.00 26 K 8.04 4.03 0.00 2.23 1.99 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.14 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.64 7.81 27 F 8.51 4.36 0.00 3.04 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.49 4.12 0.00 2.10 1.58 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 1.47 2.07 0.00 29 S 8.43 4.00 0.00 3.81 4.04 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 0.00 0.00 0.00 30 L 7.24 3.65 0.00 1.12 1.13 0.96 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.47 4.41 0.00 3.22 3.12 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 R 8.43 4.30 0.00 2.02 1.95 0.00 3.42 0.00 0.00 3.26 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.50 0.00 33 T 7.71 3.92 4.15 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 0.00 0.00 0.00 0.33 0.00 0.00 34 Y 7.68 4.45 0.00 3.19 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 35 D 7.88 5.13 0.00 2.91 2.65 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 0.00 0.00 0.00 0.00 36 K 8.54 4.20 0.00 1.77 1.88 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.45 7.81 37 D 8.03 4.69 0.00 2.66 2.67 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 0.00 0.00 0.00 0.00 38 T 7.73 4.13 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 39 T 8.54 4.68 4.19 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 1.18 0.00 0.00 40 F 8.85 4.80 0.00 2.74 2.65 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 0.00 0.00 0.00 0.00 41 Q 8.62 4.15 0.00 1.98 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 1.82 2.13 0.00 42 Y 8.32 4.46 0.00 2.72 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.21 4.90 0.00 3.12 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 44 K 8.76 3.91 0.00 1.85 1.82 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.40 7.81 45 S 8.78 4.41 0.00 3.97 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 46 F 7.81 4.16 0.00 3.39 3.07 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 47 K 7.40 3.93 0.00 1.75 1.89 0.00 1.49 0.00 0.00 1.11 0.00 0.00 2.66 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.47 7.81 48 R 8.15 5.08 0.00 1.92 1.92 0.00 3.01 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.93 0.00 49 V 8.48 4.46 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 0.09 0.00 0.00 0.56 0.00 0.00 50 R 9.11 4.56 0.00 2.19 1.97 0.00 3.11 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 51 I 8.73 4.14 1.33 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.57 -0.63 0.00 0.00 52 N 8.47 5.09 0.00 2.47 2.65 0.00 0.00 6.40 8.93 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 53 F 9.33 5.04 0.00 2.82 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.54 4.58 0.00 3.84 4.03 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.74 5.08 0.00 2.92 2.92 0.00 0.00 6.07 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.45 0.00 2.21 2.23 0.00 3.77 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 1.99 1.99 0.00 57 L 7.28 4.12 0.00 1.74 1.64 0.92 0.61 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 58 S 8.50 3.89 0.00 4.32 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 59 A 7.29 2.58 0.76 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 0.00 0.00 60 A 8.03 4.09 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.92 4.23 0.00 2.50 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 0.00 0.00 0.00 0.00 62 A 7.86 3.87 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.18 3.97 0.00 1.79 2.11 0.00 3.23 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.51 0.00 64 L 7.72 3.95 0.00 1.74 1.75 0.89 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 65 R 8.14 4.26 0.00 1.86 2.10 0.00 3.37 0.00 0.00 3.32 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.47 0.00 66 L 7.36 4.73 0.00 1.59 1.39 0.05 0.67 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 67 H 8.75 4.45 0.00 3.56 3.29 0.00 5.90 0.00 0.00 0.00 0.00 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.81 4.08 0.00 1.74 1.86 0.00 1.85 0.00 0.00 0.66 0.00 0.00 2.61 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.55 1.21 7.81 69 T 7.80 3.69 4.30 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 1.29 0.00 0.00 70 E 8.69 4.03 0.00 2.02 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 2.52 2.34 0.00 71 F 9.22 4.29 0.00 3.22 3.28 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.20 3.32 0.00 1.15 1.50 -0.51 0.89 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 73 G 8.39 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.07 4.61 0.00 2.02 1.86 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.68 7.81 75 E 9.03 4.69 0.00 2.04 1.93 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 2.35 2.47 0.00 76 M 8.66 4.89 0.00 2.31 1.99 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.64 0.00 77 K 8.92 4.85 0.00 1.92 1.85 0.00 1.99 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.44 7.81 78 L 8.26 5.18 0.00 1.36 1.48 1.05 1.02 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 79 Y 9.21 4.75 0.00 2.92 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 80 F 9.12 4.44 0.00 2.95 3.05 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 81 A 8.75 3.92 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 82 Q 8.92 3.85 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.95 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 83 T 8.25 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 1.22 0.00 0.00 84 L 8.23 4.37 0.00 1.44 1.62 0.86 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 85 H 7.34 4.96 0.00 3.14 3.21 0.00 5.58 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.37 3.71 1.86 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 1.33 0.69 0.86 0.00 0.00 87 G 8.16 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 88 S 9.09 3.83 0.00 4.05 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 89 S 8.58 4.32 0.00 3.90 3.80 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 0.00 0.00 0.00 90 H 8.32 4.82 0.00 3.06 3.21 0.00 5.74 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.71 3.74 0.00 1.60 1.67 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.65 4.07 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 93 P 0.00 4.49 0.00 2.19 2.07 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 94 P 0.00 4.49 0.00 2.20 2.10 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 95 N 8.47 4.07 0.00 2.85 2.89 0.00 0.00 6.08 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 96 P 0.00 4.60 0.00 2.20 2.15 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 97 D 8.09 4.78 0.00 2.74 2.62 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 98 K 8.44 3.80 0.00 1.73 1.79 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.41 7.81 99 S 7.95 4.56 0.00 3.95 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 0.00 100 G 8.33 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 0.00 101 P 0.00 4.33 0.00 2.19 2.07 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 102 S 8.22 4.60 0.00 3.88 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 0.00 103 S 8.29 4.54 0.00 3.98 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 0.00 104 G 8.19 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