NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3861 0.0000 0.0000 62.3710 32.8640 177.4267 2 M 3.9404 8.3562 121.4977 56.3505 32.1016 176.4461 3 T 5.1142 8.5130 107.4094 62.0251 70.0858 175.2752 4 K 4.1433 7.8130 122.5590 58.6501 32.3292 177.9065 5 V 4.2736 7.7336 116.3284 62.8137 33.8376 175.2187 6 L 4.9191 7.9953 118.4836 52.1446 44.7042 175.8756 7 K 4.4480 8.4221 120.6415 55.9993 33.8431 178.0505 8 A 4.0490 8.7542 125.7024 55.8465 18.2724 179.8614 9 D 4.3945 8.0857 116.5362 57.4267 40.9780 178.5826 10 D 4.3634 8.0895 119.2013 57.2502 40.8681 178.5853 11 I 3.8146 7.8541 120.4223 64.6446 37.1589 178.3152 12 N 4.4661 8.2467 117.1344 55.8759 38.3759 177.4955 13 K 3.8939 8.3398 121.2378 59.5203 31.8487 178.8157 14 A 4.0959 8.1557 121.0520 55.1874 18.0631 179.6695 15 I 3.9017 7.9064 117.6931 64.5502 37.3548 178.2913 16 S 4.2165 8.2153 113.8749 61.3650 62.0408 176.0295 17 A 3.8014 7.6333 122.0594 53.8851 17.6639 177.8759 18 F 5.1488 7.7757 115.1466 56.2288 39.8077 178.0714 19 K 4.1844 7.9275 122.4416 59.0173 33.0673 176.6912 20 D 4.9514 7.4205 116.7403 51.3414 42.5182 174.1609 21 P 4.3800 0.0000 0.0000 64.3197 31.7412 176.8396 22 G 4.0041 9.3856 109.5391 45.6415 0.0000 173.8518 23 T 4.3950 7.5488 108.4689 61.7054 69.6732 174.7323 24 F 3.6693 8.6926 126.0111 58.0837 39.9972 174.4003 25 D 4.4287 6.7328 125.3573 51.6930 44.0480 175.6916 26 Y 3.3423 8.3544 126.4007 59.7211 38.1135 178.4430 27 K 3.6123 6.8841 119.7303 59.1228 32.1380 179.1395 28 R 3.8560 8.1452 119.0481 59.1777 29.9228 178.1313 29 F 4.2183 7.9472 120.6165 61.5947 39.3645 177.2625 30 F 4.3054 7.9621 117.0049 60.4480 38.4666 177.6658 31 H 4.0965 8.1049 115.7505 58.9400 28.3527 177.8458 32 L 3.9870 8.0029 119.9404 57.5864 41.5335 178.8616 33 V 3.6113 7.5687 116.4585 62.3507 31.6480 176.8927 34 G 3.8465 7.8046 109.0255 46.0767 0.0000 174.4269 35 L 4.1719 7.8487 123.3406 56.3984 42.4684 177.2097 36 K 3.9927 7.7521 118.2223 57.6956 32.3900 176.9169 37 G 3.8597 8.9201 110.7454 45.7489 0.0000 173.1164 38 K 4.5285 7.1483 116.9088 54.3993 34.1292 177.0306 39 T 4.1579 8.6440 112.2749 61.4614 70.7736 175.1041 40 D 4.2698 8.5798 120.0190 57.5357 41.1466 178.1269 41 A 4.0783 7.9249 120.7362 54.9366 18.5688 179.5224 42 Q 3.9819 8.2643 116.9984 59.0531 28.7902 178.8453 43 V 3.7440 8.0627 119.4732 66.0302 31.4942 178.2369 44 K 4.1803 8.3573 118.0185 58.8262 31.7449 179.0161 45 E 3.9209 7.9899 119.8838 59.2762 29.6854 178.9880 46 V 3.5502 7.8059 118.0139 65.8041 31.5865 177.6068 47 F 3.3817 8.3397 120.4452 61.3008 38.9521 176.9566 48 E 3.8617 8.2893 116.9681 59.4800 29.2703 179.1857 49 I 3.7496 7.2239 118.8715 64.2133 37.1837 178.1913 50 L 4.0731 7.2779 118.7633 56.4647 42.8043 178.0927 51 D 4.5446 7.2908 119.4626 52.6143 38.4094 176.3305 52 K 3.8113 7.9782 123.0508 58.9120 32.5593 177.8007 53 D 4.5720 8.1880 114.8710 52.7509 39.5357 176.1357 54 Q 3.6496 7.9468 117.4541 57.2302 26.6638 175.0642 55 S 4.2019 8.3650 114.0563 59.9223 63.2176 175.1917 56 G 3.8636 9.5364 109.7159 44.8089 0.0000 173.0234 57 F 5.2889 7.6080 116.6124 55.8940 43.5750 174.9059 58 I 4.8154 9.0983 122.9956 59.4851 37.8526 175.6787 59 E 4.4954 8.7588 127.2011 55.3933 30.9406 177.8281 60 E 3.8633 8.8882 120.6547 59.6231 29.2458 178.3076 61 E 3.9108 8.0395 117.9374 59.4291 30.2058 178.2485 62 E 4.1070 8.0816 117.9211 58.9875 29.7374 178.9801 63 L 3.9923 8.0600 119.5267 57.5590 41.5630 179.3130 64 K 4.0103 8.2711 119.7948 58.5960 31.7197 177.9823 65 G 4.2624 7.5313 104.4623 44.4518 0.0000 175.7633 66 V 3.6963 7.4510 123.9528 64.8109 31.2350 178.2918 67 L 4.1164 7.6431 119.1910 57.2477 39.9925 179.3058 68 K 4.5592 8.0183 118.0475 58.7808 31.7201 179.4738 69 G 3.7522 7.8622 105.1598 47.0480 0.0000 175.0557 70 F 4.5006 8.2612 118.8323 58.2713 40.2502 176.3741 71 S 4.5862 7.4415 110.7878 56.7779 65.4922 174.8619 72 A 4.1246 8.5853 129.9497 54.8687 18.3009 177.9090 73 H 4.5716 8.0068 111.8864 56.7444 29.0891 175.8692 74 G 3.9120 7.9596 109.3146 45.1624 0.0000 172.6768 75 R 4.6117 8.0501 115.5353 53.9741 31.9176 175.3012 76 D 4.7644 8.1848 117.7283 53.9061 41.7525 176.6274 77 L 4.4128 8.2967 121.5070 54.5948 42.8975 176.7536 78 N 4.7095 9.0616 120.2343 51.9468 39.5028 175.7831 79 D 4.3583 8.6236 117.6472 57.6520 40.7593 179.0902 80 T 3.8885 7.9340 116.0695 66.6183 68.6223 176.4557 81 E 4.0643 8.7370 120.7184 59.5504 29.5778 179.5675 82 T 3.8386 8.0479 115.8991 66.5735 68.4920 176.9465 83 K 3.9809 8.3674 120.4688 59.4308 32.0618 179.2711 84 A 4.0832 8.1636 121.0661 55.0809 18.2724 179.7070 85 L 3.9390 7.8927 117.1663 57.9159 41.6212 179.7364 86 L 4.0195 7.9485 118.4765 57.6112 41.3156 179.2308 87 A 3.9744 8.2558 120.1561 55.1581 18.3799 179.0829 88 A 4.3191 8.0645 117.9758 53.6342 18.9270 178.4079 89 G 3.9104 7.9087 104.1408 45.8684 0.0000 173.6648 90 D 4.7688 8.0545 121.2524 52.7297 39.6213 176.4335 91 S 4.0441 8.4175 119.5282 60.8583 63.2604 175.2137 92 D 4.5955 8.1106 115.9689 52.5743 39.3383 175.7198 93 H 4.2527 7.6584 115.1204 57.3248 26.7211 174.9705 94 D 4.5067 8.1135 115.6110 53.3119 39.7187 177.1389 95 G 3.9340 9.8742 108.9461 45.2443 0.0000 172.8627 96 K 4.7092 7.9411 117.0424 55.4968 36.5593 175.4870 97 I 4.6600 8.9730 122.1523 59.8921 38.8948 176.4801 98 G 4.2925 9.6022 115.4573 45.1569 0.0000 174.3185 99 A 2.6453 7.9610 120.8280 54.8908 18.1783 179.6136 100 D 4.3159 7.8034 116.4019 56.9189 41.0256 178.7305 101 E 3.9999 8.1058 119.2171 59.1863 29.5355 178.8111 102 F 4.1871 8.5973 120.7826 61.3312 39.5452 177.0307 103 A 3.9139 8.2318 120.4587 54.9133 18.0816 179.5538 104 K 3.8684 8.0586 118.1925 59.8901 32.0764 178.9255 105 M 4.1320 7.7738 117.7914 58.5292 31.9953 178.6181 106 V 3.3010 7.4021 118.0505 65.7424 31.3514 177.9553 107 A 3.9824 7.7857 119.9564 54.7050 18.3394 178.7639 108 Q 4.2590 8.1386 113.3023 57.0188 29.2854 176.4612 109 A 4.2335 7.6653 128.0577 52.6614 18.5940 176.8833 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 P 0.00 4.39 0.00 2.18 2.02 0.00 3.54 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.09 0.00 2 M 8.36 3.94 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.26 0.00 3 T 8.51 5.11 4.26 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 1.25 0.00 0.00 4 K 7.81 4.14 0.00 1.72 1.92 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.46 7.81 5 V 7.73 4.27 2.13 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 0.89 0.00 0.00 0.96 0.00 0.00 6 L 8.00 4.92 0.00 1.81 1.60 1.23 1.18 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 7 K 8.42 4.45 0.00 1.97 1.75 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.52 7.81 8 A 8.75 4.05 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 9 D 8.09 4.39 0.00 2.72 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 10 D 8.09 4.36 0.00 2.87 2.94 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 11 I 7.85 3.81 2.17 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.94 1.17 0.00 0.00 12 N 8.25 4.47 0.00 2.81 2.91 0.00 0.00 6.70 7.00 0.00 0.00 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 K 8.34 3.89 0.00 1.93 1.97 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.43 7.81 14 A 8.16 4.10 1.44 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 0.00 0.00 15 I 7.91 3.90 2.12 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.00 1.02 0.00 0.00 16 S 8.22 4.22 0.00 3.99 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 17 A 7.63 3.80 0.66 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 18 F 7.78 5.15 0.00 3.29 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 19 K 7.93 4.18 0.00 1.86 1.98 0.00 1.59 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.55 1.43 7.81 20 D 7.42 4.95 0.00 2.80 2.63 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 21 P 0.00 4.38 0.00 2.19 2.07 0.00 3.78 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 2.01 1.98 0.00 22 G 9.39 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 23 T 7.55 4.39 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 1.33 0.00 0.00 24 F 8.69 3.67 0.00 2.83 2.85 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 25 D 6.73 4.43 0.00 2.59 2.30 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 26 Y 8.35 3.34 0.00 2.88 3.09 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 27 K 6.88 3.61 0.00 1.64 1.67 0.00 1.45 0.00 0.00 1.58 0.00 0.00 2.74 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.75 0.34 7.81 28 R 8.15 3.86 0.00 1.88 1.97 0.00 3.13 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.79 0.00 29 F 7.95 4.22 0.00 2.23 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 F 7.96 4.31 0.00 3.05 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 31 H 8.10 4.10 0.00 3.32 3.32 0.00 5.62 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 32 L 8.00 3.99 0.00 1.70 1.69 0.86 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.57 3.61 1.22 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 0.49 0.00 0.00 0.79 0.00 0.00 34 G 7.80 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 35 L 7.85 4.17 0.00 1.84 1.65 1.01 0.72 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 36 K 7.75 3.99 0.00 1.69 1.65 0.00 1.74 0.00 0.00 1.47 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.23 7.81 37 G 8.92 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 0.00 0.00 0.00 38 K 7.15 4.53 0.00 1.89 1.85 0.00 1.89 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.52 7.81 39 T 8.64 4.16 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 1.25 0.00 0.00 40 D 8.58 4.27 0.00 2.79 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 41 A 7.92 4.08 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 42 Q 8.26 3.98 0.00 2.30 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 43 V 8.06 3.74 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 1.14 0.00 0.00 0.95 0.00 0.00 44 K 8.36 4.18 0.00 1.95 1.84 0.00 1.82 0.00 0.00 1.54 0.00 0.00 2.81 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.42 1.58 7.81 45 E 7.99 3.92 0.00 2.23 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 0.00 2.32 2.36 0.00 46 V 7.81 3.55 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 1.17 0.00 0.00 1.04 0.00 0.00 47 F 8.34 3.38 0.00 2.92 3.15 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 0.00 48 E 8.29 3.86 0.00 2.11 1.97 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 2.43 2.68 0.00 49 I 7.22 3.75 1.81 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.50 0.75 0.00 0.00 50 L 7.28 4.07 0.00 1.32 1.50 0.98 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 51 D 7.29 4.54 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 7.98 3.81 0.00 1.84 1.81 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.54 7.81 53 D 8.19 4.57 0.00 2.77 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 54 Q 7.95 3.65 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.02 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 55 S 8.36 4.20 0.00 4.16 4.14 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.54 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 0.00 0.00 0.00 57 F 7.61 5.29 0.00 3.13 2.98 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 58 I 9.10 4.82 1.97 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 1.49 0.88 0.00 0.00 59 E 8.76 4.50 0.00 1.97 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 0.00 2.40 2.37 0.00 60 E 8.89 3.86 0.00 2.02 1.94 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 2.36 2.37 0.00 61 E 8.04 3.91 0.00 1.98 1.94 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 2.27 2.38 0.00 62 E 8.08 4.11 0.00 2.12 2.03 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 2.34 2.36 0.00 63 L 8.06 3.99 0.00 1.86 1.67 0.94 0.52 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 64 K 8.27 4.01 0.00 1.88 1.99 0.00 1.58 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.60 7.81 65 G 7.53 4.26 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 0.00 66 V 7.45 3.70 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 0.30 0.00 0.00 1.07 0.00 0.00 67 L 7.64 4.12 0.00 1.82 1.79 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.02 4.56 0.00 1.92 1.87 0.00 1.79 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.46 7.81 69 G 7.86 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 F 8.26 4.50 0.00 3.33 3.30 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 71 S 7.44 4.59 0.00 3.99 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 72 A 8.59 4.12 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 73 H 8.01 4.57 0.00 3.22 3.37 0.00 5.68 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 74 G 7.96 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 0.00 0.00 0.00 75 R 8.05 4.61 0.00 1.91 1.95 0.00 3.05 0.00 0.00 3.41 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 76 D 8.18 4.76 0.00 2.56 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 77 L 8.30 4.41 0.00 1.36 1.41 0.34 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 78 N 9.06 4.71 0.00 2.82 2.96 0.00 0.00 7.14 8.88 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 79 D 8.62 4.36 0.00 2.78 2.75 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 0.00 0.00 0.00 0.00 80 T 7.93 3.89 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 1.23 0.00 0.00 81 E 8.74 4.06 0.00 2.11 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 2.40 2.51 0.00 82 T 8.05 3.84 4.35 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 1.18 0.00 0.00 83 K 8.37 3.98 0.00 1.99 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.61 7.81 84 A 8.16 4.08 1.44 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 0.00 0.00 85 L 7.89 3.94 0.00 1.91 1.74 0.85 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 86 L 7.95 4.02 0.00 1.90 1.73 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 87 A 8.26 3.97 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 88 A 8.06 4.32 1.23 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 0.00 0.00 89 G 7.91 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 0.00 0.00 0.00 90 D 8.05 4.77 0.00 2.79 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 91 S 8.42 4.04 0.00 4.00 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 92 D 8.11 4.60 0.00 2.79 2.75 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 0.00 0.00 0.00 0.00 93 H 7.66 4.25 0.00 3.27 3.38 0.00 5.64 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.11 4.51 0.00 2.72 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 95 G 9.87 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 96 K 7.94 4.71 0.00 1.94 1.71 0.00 0.91 0.00 0.00 1.49 0.00 0.00 2.45 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.24 1.10 7.81 97 I 8.97 4.66 2.10 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.00 1.24 0.00 0.00 98 G 9.60 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 0.00 0.00 0.00 0.00 99 A 7.96 2.65 0.65 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 0.00 0.00 100 D 7.80 4.32 0.00 2.65 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 0.00 101 E 8.11 4.00 0.00 2.34 2.24 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 2.42 2.40 0.00 102 F 8.60 4.19 0.00 3.41 3.24 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 0.00 103 A 8.23 3.91 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 0.00 104 K 8.06 3.87 0.00 1.98 1.95 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.48 7.81 105 M 7.77 4.13 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.35 0.00 106 V 7.40 3.30 1.85 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 0.70 0.00 0.00 -0.31 0.00 0.00 107 A 7.79 3.98 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 0.00 108 Q 8.14 4.26 0.00 2.30 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.91 0.00 0.00 0.00 0.00 0.00 2.74 2.64 0.00 109 A 7.67 4.23 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