NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2963 8.3049 118.1773 54.9914 32.8609 174.6695 2 K 4.7572 7.8058 117.5797 55.4917 34.9533 174.2307 3 Y 4.9714 9.1757 121.2577 56.2768 42.3775 174.6113 4 Q 5.1507 8.4975 119.5283 54.2010 31.8345 176.9473 5 V 3.5176 8.6679 113.1292 64.6162 31.5944 178.3178 6 K 3.8029 8.2038 118.6482 60.3280 31.8787 177.9375 7 Q 4.0401 8.1552 118.0847 58.5541 28.6937 178.7007 8 V 3.4014 7.8682 119.1047 65.0618 31.0640 178.0021 9 A 3.8437 8.2719 121.5452 54.9352 18.0642 179.2566 10 E 3.8195 7.9162 116.0931 59.4541 29.6907 178.7271 11 I 3.9203 7.9874 119.7691 63.0478 37.3298 177.3248 12 S 4.5359 8.1331 112.8638 57.9545 63.9033 174.7860 13 G 3.9612 8.3818 110.9588 45.4299 0.0000 174.3461 14 V 3.9229 6.6326 111.8527 60.3330 32.8578 175.7900 15 S 4.4958 7.9799 115.4932 57.4410 64.5248 175.3480 16 I 3.5297 8.2088 122.1989 64.5707 36.7095 178.3974 17 R 3.8718 7.9540 118.9338 59.8379 29.7323 178.4380 18 T 3.5981 7.5522 115.1576 66.5383 68.1961 176.4393 19 L 3.8332 7.1038 118.9520 58.0806 41.9184 179.1137 20 H 4.4218 8.0984 115.8866 59.1693 28.6352 176.9150 21 H 4.0297 8.4015 119.9725 60.0150 29.6211 176.7741 22 Y 4.3221 8.7484 118.1794 60.7157 37.1782 178.3691 23 D 4.9080 8.6335 121.1459 56.7849 41.2495 177.8665 24 N 4.3576 8.1372 115.1454 56.4988 38.7387 177.0323 25 I 3.8105 7.8572 119.4177 62.0058 37.1176 176.3406 26 E 3.8138 7.8612 119.2864 56.8498 28.5226 174.8846 27 L 3.9990 8.0547 119.7991 56.3156 42.7025 176.4425 28 L 4.6121 8.3270 122.8849 53.3417 43.4806 174.2667 29 N 5.4476 8.4925 123.1699 49.7555 40.1746 173.5962 30 P 3.8518 0.0000 0.0000 62.5909 31.8544 176.7672 31 S 4.2013 8.7727 116.6079 60.8766 63.4160 174.2032 32 A 4.6848 7.8946 121.8198 50.3514 22.1488 174.5790 33 L 5.0793 8.1571 119.0581 53.0896 44.8638 176.6427 34 T 4.3710 8.4639 116.5515 60.7933 68.6001 175.2949 35 D 4.2030 8.7352 125.1452 57.6339 40.7972 177.8994 36 A 4.1808 7.7391 118.0930 52.4273 18.5873 177.9364 37 G 4.0666 8.7210 106.2627 45.0001 0.0000 174.0063 38 Y 4.3890 8.1581 118.5080 58.4232 38.5012 175.6847 39 R 4.7170 8.7115 120.5844 55.3856 32.1413 175.1075 40 L 5.3066 8.8267 121.5772 53.3670 44.7857 174.9343 41 Y 5.1646 9.5184 122.7347 56.5730 40.3049 176.1665 42 S 5.0115 9.7929 118.8758 57.1779 65.1287 174.9305 43 D 4.4450 8.8401 119.9100 57.3889 40.3509 178.9546 44 A 4.0117 8.0331 120.8385 55.4245 18.4729 179.2055 45 D 4.4203 8.0408 116.9550 57.5383 40.8355 179.2020 46 L 3.9479 7.9521 121.8359 58.1095 41.4779 179.9080 47 E 3.8819 8.0618 118.0892 61.1668 29.6486 180.8952 48 R 4.0298 8.0000 120.1929 59.4675 29.9758 178.2799 49 L 3.9294 7.9987 119.7650 57.9656 41.9250 179.1028 50 Q 3.5854 7.8273 118.1421 58.8343 28.6931 178.0771 51 Q 3.9260 7.9362 119.2808 59.3200 28.8552 179.2544 52 I 3.6757 7.8604 120.5013 64.8731 37.0473 178.4995 53 L 4.1482 7.7443 117.7875 58.0730 41.5325 179.0423 54 F 4.6887 8.2630 118.4574 60.2702 38.8970 177.1945 55 F 3.8329 8.9162 116.9491 61.1006 38.7894 178.0737 56 K 4.1985 8.5044 118.9888 59.4873 31.7340 178.8156 57 E 4.0856 8.9846 119.3788 59.2918 29.5557 178.8651 58 I 3.9050 7.7775 117.7123 62.5043 37.3500 176.8743 59 G 3.9703 7.7385 108.0275 44.8115 0.0000 174.1042 60 F 4.5116 7.7345 117.8704 57.6044 39.7067 175.3319 61 R 4.6785 8.6571 119.5656 54.6280 32.6341 177.2572 62 L 3.8149 8.4710 119.9823 58.4199 41.5673 179.7047 63 D 4.2716 8.0126 117.7564 57.4174 41.0082 178.4473 64 E 3.9116 8.1508 118.3597 59.5803 29.5916 179.3586 65 I 3.3143 8.0458 120.0690 64.0494 37.0780 178.2074 66 K 3.7601 8.5016 123.1011 60.3231 31.8713 179.2547 67 E 3.8398 8.2607 117.5634 61.0602 29.5362 180.5609 68 M 4.3902 7.5043 116.4442 58.1285 32.0749 178.4413 69 L 3.8680 7.5199 118.1645 57.0023 42.0280 178.2421 70 D 4.7338 7.9899 116.8239 54.8503 42.4344 176.7407 71 H 4.7907 7.5711 119.1121 53.9771 30.3692 171.6455 72 P 4.3872 0.0000 0.0000 63.2444 31.1758 176.9364 73 N 4.5295 7.7586 116.3428 54.0839 39.2727 174.7990 74 F 4.2505 8.0905 120.4001 57.9196 39.3939 173.6567 75 D 4.2477 8.6367 128.6379 54.8248 41.0680 177.3415 76 R 4.0355 8.7078 129.3279 59.5271 30.1438 179.3306 77 K 3.8445 8.2485 122.9987 60.1388 31.6362 181.4500 78 A 4.1786 7.9522 121.6646 54.7082 18.2585 179.6314 79 A 4.0197 7.3771 118.5749 55.5369 18.6772 179.9426 80 L 4.1801 8.4482 117.8414 57.9017 41.5475 179.8379 81 Q 3.9582 8.0249 118.1700 59.0519 28.7585 178.2929 82 S 4.9221 8.4696 117.7757 61.3794 62.9333 176.9563 83 Q 3.7990 8.2991 121.8824 58.7047 28.6524 178.1315 84 K 3.8470 7.7689 120.2831 59.5547 32.3054 178.4601 85 E 3.9331 8.7232 119.1249 59.6828 29.5145 179.5299 86 I 3.7028 7.9972 119.8434 64.4219 37.1303 178.5326 87 L 3.9919 8.0380 119.8089 57.8162 41.2945 179.5389 88 M 3.9924 8.1060 118.7598 58.4498 31.9170 178.7565 89 K 3.8763 8.1093 118.5529 59.5954 32.1791 179.4686 90 K 3.9330 7.9764 118.3407 59.1337 31.8495 179.1586 91 K 3.8469 7.9033 119.9218 59.5478 32.0451 178.3353 92 Q 3.9992 8.3489 122.2917 60.1035 28.9823 179.2879 93 R 3.9361 8.1523 121.5049 61.7045 29.3674 180.3586 94 M 4.2553 8.1909 119.4150 58.3683 31.9725 178.5565 95 D 4.3310 8.2590 119.0601 57.5561 41.0051 178.4885 96 E 3.9633 8.3767 119.1637 59.9492 29.5111 179.5438 97 M 4.0584 8.1060 118.3231 58.5010 31.9467 178.9231 98 I 3.7172 7.8222 119.9314 64.2455 37.1678 178.1732 99 Q 3.9387 8.6398 120.7098 59.7017 28.6842 178.5802 100 T 3.7117 8.0062 115.6008 66.6238 68.6210 176.4574 101 I 3.8637 7.7886 121.6311 64.4871 37.3027 178.1012 102 D 4.3549 8.2876 119.9505 57.3983 40.5354 178.5715 103 R 4.1442 8.5531 117.0551 58.2652 29.8142 177.2101 104 T 4.5230 8.0077 114.0756 64.6453 70.2516 175.3790 105 L 4.4081 7.4527 117.9081 54.9539 42.9222 178.2667 106 L 4.3761 7.2600 120.1455 52.2173 39.6189 177.2183 107 S 4.3424 7.6463 116.1251 58.9778 62.2562 177.4135 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 M 8.30 4.30 0.00 2.12 2.27 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.65 0.00 2 K 7.81 4.76 0.00 1.63 1.72 0.00 1.58 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.64 7.81 3 Y 9.18 4.97 0.00 2.99 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 4 Q 8.50 5.15 0.00 2.20 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.70 0.00 0.00 0.00 0.00 0.00 2.41 2.27 0.00 5 V 8.67 3.52 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 0.88 0.00 0.00 0.92 0.00 0.00 6 K 8.20 3.80 0.00 1.85 1.86 0.00 1.60 0.00 0.00 1.81 0.00 0.00 3.10 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.65 7.81 7 Q 8.16 4.04 0.00 2.46 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.48 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 8 V 7.87 3.40 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 0.70 0.00 0.00 0.45 0.00 0.00 9 A 8.27 3.84 1.35 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 0.00 0.00 0.00 0.00 0.00 10 E 7.92 3.82 0.00 2.00 2.25 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 2.31 2.34 0.00 11 I 7.99 3.92 1.84 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.70 0.77 0.00 0.00 12 S 8.13 4.54 0.00 3.91 3.82 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 0.00 0.00 0.00 0.00 13 G 8.38 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 0.00 0.00 0.00 14 V 6.63 3.92 1.88 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 0.63 0.00 0.00 0.72 0.00 0.00 15 S 7.98 4.50 0.00 3.93 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 16 I 8.21 3.53 1.79 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 1.45 0.81 0.73 0.00 0.00 17 R 7.95 3.87 0.00 1.89 1.89 0.00 3.28 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 18 T 7.55 3.60 4.06 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 0.00 0.00 0.25 0.00 0.00 19 L 7.10 3.83 0.00 1.68 1.71 0.66 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 20 H 8.10 4.42 0.00 3.38 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 H 8.40 4.03 0.00 3.32 3.59 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 8.75 4.32 0.00 3.14 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 23 D 8.63 4.91 0.00 3.02 2.88 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 24 N 8.14 4.36 0.00 2.77 2.85 0.00 0.00 6.92 7.45 0.00 0.00 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 I 7.86 3.81 1.98 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.47 0.89 0.00 0.00 26 E 7.86 3.81 0.00 2.10 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 0.00 2.17 2.37 0.00 27 L 8.05 4.00 0.00 1.47 1.70 0.74 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.33 4.61 0.00 1.81 1.70 1.02 0.65 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 29 N 8.49 5.45 0.00 2.75 2.72 0.00 0.00 7.28 8.02 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 30 P 0.00 3.85 0.00 1.76 1.20 0.00 3.63 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.57 0.00 31 S 8.77 4.20 0.00 3.98 4.17 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 32 A 7.89 4.68 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 33 L 8.16 5.08 0.00 1.58 1.54 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.46 4.37 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 35 D 8.74 4.20 0.00 2.62 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 36 A 7.74 4.18 1.06 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 0.00 0.00 0.00 0.00 0.00 37 G 8.72 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 0.00 0.00 0.00 38 Y 8.16 4.39 0.00 2.87 2.93 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 39 R 8.71 4.72 0.00 1.58 1.97 0.00 3.05 0.00 0.00 3.33 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 40 L 8.83 5.31 0.00 1.50 1.60 0.92 0.88 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 41 Y 9.52 5.16 0.00 3.04 2.93 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 42 S 9.79 5.01 0.00 4.03 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 43 D 8.84 4.44 0.00 2.79 2.82 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 0.00 0.00 0.00 0.00 44 A 8.03 4.01 1.35 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 0.00 0.00 0.00 0.00 0.00 45 D 8.04 4.42 0.00 3.11 3.02 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 0.00 0.00 0.00 46 L 7.95 3.95 0.00 1.84 1.56 0.31 0.44 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 47 E 8.06 3.88 0.00 2.01 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 0.00 2.24 2.19 0.00 48 R 8.00 4.03 0.00 1.92 2.19 0.00 3.08 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 49 L 8.00 3.93 0.00 1.80 1.73 0.94 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 7.83 3.59 0.00 2.07 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.48 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 51 Q 7.94 3.93 0.00 2.23 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.71 0.00 0.00 0.00 0.00 0.00 2.47 2.73 0.00 52 I 7.86 3.68 2.07 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 1.40 1.04 0.92 0.00 0.00 53 L 7.74 4.15 0.00 1.60 1.76 0.87 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 54 F 8.26 4.69 0.00 3.29 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 55 F 8.92 3.83 0.00 3.30 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.50 4.20 0.00 2.23 1.97 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.16 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.54 1.58 7.81 57 E 8.98 4.09 0.00 2.21 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 0.00 2.42 2.67 0.00 58 I 7.78 3.91 2.28 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 1.56 0.49 0.75 0.00 0.00 59 G 7.74 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 60 F 7.73 4.51 0.00 3.35 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 61 R 8.66 4.68 0.00 2.09 2.08 0.00 2.84 0.00 0.00 3.20 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.69 0.00 62 L 8.47 3.81 0.00 1.65 1.64 0.89 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.01 4.27 0.00 2.67 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 64 E 8.15 3.91 0.00 2.30 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 65 I 8.05 3.31 1.88 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.01 0.65 0.00 0.00 66 K 8.50 3.76 0.00 1.77 1.88 0.00 1.57 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.45 1.39 7.81 67 E 8.26 3.84 0.00 2.06 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 2.27 2.24 0.00 68 M 7.50 4.39 0.00 1.90 1.75 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.65 0.00 69 L 7.52 3.87 0.00 1.47 1.60 0.72 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 70 D 7.99 4.73 0.00 2.64 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 71 H 7.57 4.79 0.00 3.17 3.09 0.00 5.78 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 72 P 0.00 4.39 0.00 2.06 2.07 0.00 3.66 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 73 N 7.76 4.53 0.00 2.68 2.86 0.00 0.00 6.98 7.45 0.00 0.00 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 F 8.09 4.25 0.00 2.97 3.08 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 75 D 8.64 4.25 0.00 2.69 2.36 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 76 R 8.71 4.04 0.00 1.91 2.02 0.00 3.26 0.00 0.00 3.51 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.87 0.00 77 K 8.25 3.84 0.00 1.76 1.83 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.10 7.81 78 A 7.95 4.18 1.30 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 0.00 0.00 0.00 79 A 7.38 4.02 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.45 4.18 0.00 1.85 1.76 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 8.02 3.96 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.70 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 82 S 8.47 4.92 0.00 3.88 3.98 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 0.00 0.00 0.00 83 Q 8.30 3.80 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 1.17 2.02 0.00 84 K 7.77 3.85 0.00 2.00 1.92 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.45 7.81 85 E 8.72 3.93 0.00 2.16 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 0.00 2.32 2.56 0.00 86 I 8.00 3.70 1.96 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.30 0.87 0.00 0.00 87 L 8.04 3.99 0.00 1.85 1.67 0.90 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 88 M 8.11 3.99 0.00 2.04 2.26 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.56 0.00 89 K 8.11 3.88 0.00 1.93 1.86 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.60 7.81 90 K 7.98 3.93 0.00 2.02 1.84 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.62 7.81 91 K 7.90 3.85 0.00 1.96 2.02 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.44 7.81 92 Q 8.35 4.00 0.00 2.26 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.56 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 93 R 8.15 3.94 0.00 1.85 1.93 0.00 3.33 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 94 M 8.19 4.26 0.00 2.01 2.37 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 2.59 2.90 0.00 95 D 8.26 4.33 0.00 2.87 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 96 E 8.38 3.96 0.00 1.99 2.01 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 2.33 2.58 0.00 97 M 8.11 4.06 0.00 2.07 2.26 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 2.78 2.58 0.00 98 I 7.82 3.72 2.00 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 1.40 1.02 0.91 0.00 0.00 99 Q 8.64 3.94 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 100 T 8.01 3.71 4.39 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 1.21 0.00 0.00 101 I 7.79 3.86 2.01 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 1.52 0.99 0.91 0.00 0.00 102 D 8.29 4.35 0.00 2.84 2.72 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 0.00 103 R 8.55 4.14 0.00 1.86 2.16 0.00 3.21 0.00 0.00 3.22 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 104 T 8.01 4.52 4.39 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 1.21 0.00 0.00 105 L 7.45 4.41 0.00 1.78 1.71 0.92 0.85 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 0.00 106 L 7.26 4.38 0.00 1.68 1.64 0.92 0.78 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 0.00 107 S 7.65 4.34 0.00 3.91 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