NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 Q 4.3309 8.2027 118.8291 55.7945 29.7398 176.7474 10 L 3.7881 9.2919 119.0554 57.5659 42.7093 174.5897 11 N 4.3189 8.7286 117.8763 56.5350 38.8936 176.4477 12 A 4.1354 7.9183 121.2845 54.4487 18.8534 179.0398 13 L 3.8861 7.9216 119.0064 58.4314 42.2541 179.1971 14 L 4.0031 8.2329 118.9265 58.1531 41.5681 179.8143 15 S 4.4804 8.3645 114.9669 61.7208 62.7024 176.6604 16 S 4.1082 8.2773 115.8625 61.6778 62.1884 176.2071 17 M 3.9046 7.9530 121.3530 58.3992 31.6638 178.7903 18 F 4.5802 8.3491 118.5410 59.7329 38.9555 177.8810 19 A 4.0890 8.3296 121.3669 55.1168 18.2827 178.5250 20 S 4.2286 8.2662 108.0793 58.6399 63.3400 175.0580 21 G 3.9502 8.1590 109.0969 46.3146 0.0000 174.9449 22 L 4.0438 7.7157 121.8689 56.6164 41.7449 177.7454 23 V 4.5693 7.2964 110.5262 59.3564 35.0940 174.9699 24 D 5.2508 8.3395 123.2032 51.8041 41.6335 176.3177 25 E 4.0576 8.9739 116.1518 60.2217 29.0296 178.6113 26 Q 4.0243 8.4468 120.3026 59.1838 29.2330 177.9907 27 F 4.0643 8.2185 121.4782 61.4384 39.2777 176.6310 28 Q 4.1470 8.1458 117.8865 59.5656 28.5848 178.4802 29 Q 3.9702 7.7409 118.9802 59.0471 29.2112 177.8877 30 L 4.0696 7.5424 119.5738 57.8755 41.7880 179.0227 31 Q 3.8638 7.5420 118.7623 58.6279 28.7297 177.4193 32 M 4.0359 7.7922 118.8368 58.4666 32.2552 177.8846 33 L 4.1231 7.5708 119.3921 57.8815 41.6223 179.2743 34 Q 4.0049 7.8521 117.7318 59.0404 29.2014 177.2967 35 E 4.1883 8.0825 117.9597 56.6085 30.0317 176.2012 36 D 4.8500 7.4667 120.3093 51.3371 41.3396 177.5934 37 G 3.9658 8.8210 112.8537 48.8336 0.0000 174.8619 38 G 4.0440 7.8955 106.6015 45.4331 0.0000 174.2972 39 T 4.6552 7.5405 115.2884 61.2529 68.8849 172.1628 40 P 4.3598 0.0000 0.0000 63.8174 32.7241 177.8173 41 G 3.9723 8.9801 109.7534 45.9703 0.0000 174.9941 42 F 4.1638 7.9995 122.2271 61.1687 39.3543 176.7301 43 V 3.4012 8.0366 117.0868 66.2485 31.2360 177.7419 44 A 3.9172 7.9278 119.5459 55.1228 18.1839 179.0635 45 E 3.8306 8.2948 117.9170 59.2848 29.7282 179.2414 46 V 3.3842 7.5910 118.3805 65.8460 31.5637 178.2105 47 V 3.4057 7.7568 118.0547 66.2369 31.3441 178.0473 48 T 3.8818 7.9047 115.4577 66.6634 68.2911 176.2777 49 L 4.0271 8.1432 122.3381 57.9912 41.9650 178.8979 50 F 4.3054 8.1536 121.8993 61.0906 39.5290 176.7908 51 C 4.0872 8.3340 116.3476 63.0736 27.9737 176.0854 52 D 4.3291 8.5837 120.6591 57.2990 40.4551 178.4926 53 D 4.1995 8.6331 119.3981 57.3669 40.8201 178.4869 54 A 3.5621 8.0873 121.4925 55.1739 18.2172 179.1888 55 D 4.0686 7.4073 115.7218 57.3963 41.2461 178.5035 56 R 3.8518 7.7857 119.1313 59.3367 30.1310 178.4847 57 I 3.6044 7.9957 120.0889 64.2257 37.0268 178.4029 58 I 3.5459 7.7022 120.8394 64.4289 37.0259 178.6346 59 S 4.0546 7.7793 115.4216 61.6346 62.6367 176.5724 60 E 3.7486 8.2011 121.5342 59.3491 29.0395 179.3496 61 L 3.8644 8.1508 118.9799 57.6799 41.4010 179.5271 62 A 3.9240 7.8325 119.4945 55.0753 18.7342 179.2772 63 A 4.0414 7.7972 118.9945 55.2510 18.3376 179.8148 64 L 3.9138 8.1936 117.9361 57.8870 41.5526 179.2510 65 L 4.2297 7.9191 115.8347 55.8278 41.5656 177.5077 66 D 4.7978 7.5836 117.0609 53.2195 41.7170 175.6281 67 Q 4.3873 7.0153 117.0075 54.5233 30.0035 174.2166 68 P 4.3145 0.0000 0.0000 65.4343 31.4434 176.7580 69 I 4.3118 7.4455 117.8145 59.3129 38.4185 175.4505 70 V 3.5768 8.1198 125.9169 62.0340 32.0423 176.0175 71 D 4.5595 8.2674 126.6571 53.7324 40.5945 176.2974 72 F 4.3627 8.5675 126.1559 59.9000 39.1609 177.1472 73 D 4.3921 8.1806 118.5889 57.2123 40.6457 178.3710 74 K 3.8602 7.9411 119.3556 59.3448 32.1969 178.8899 75 V 3.6451 7.8465 118.5540 66.0353 31.4280 177.3015 76 D 4.2885 8.2628 117.3886 57.5399 41.1149 178.0913 77 A 3.9834 8.3786 121.4467 55.4374 18.2445 179.2364 78 Y 4.0755 8.1654 115.4835 61.1209 37.9444 178.8656 79 V 3.3431 8.2760 119.5206 66.1679 31.5965 177.2965 80 H 4.0785 8.5615 118.3669 59.6314 29.6090 177.0819 81 Q 3.9662 8.1790 119.5796 58.9030 28.4746 178.6234 82 L 3.9625 8.0570 121.5105 57.6796 42.0911 178.8065 83 K 3.9924 8.6549 120.2217 59.6333 32.1639 178.9680 84 G 3.6821 8.0651 105.8502 47.8518 0.0000 175.5581 85 S 4.2262 8.2531 115.7257 61.2071 62.3712 176.4177 86 S 4.2084 8.5647 117.0054 61.2564 62.9323 176.3177 87 A 3.9991 8.6663 125.0845 54.8425 17.8665 179.6073 88 S 4.1974 8.1682 112.1615 60.8284 62.8619 175.7621 89 V 4.2547 6.8706 113.1547 60.3489 31.8394 175.7001 90 G 3.9804 8.1509 107.5284 46.9061 0.0000 174.9022 91 A 4.9284 7.7344 124.0205 50.6158 14.8466 178.2605 92 Q 3.9598 7.9808 125.1119 58.4218 29.6274 177.6212 93 K 4.0694 7.9718 119.2770 59.1677 32.2243 179.1865 94 V 3.6794 7.8634 118.1050 65.9854 31.5515 177.6647 95 K 3.9350 8.4071 119.5243 59.6013 31.8092 178.3384 96 F 4.0664 8.2627 119.5089 61.6298 39.6221 176.5733 97 T 4.0517 8.3733 115.5065 67.2059 68.4446 176.0488 98 C 4.3098 8.3599 118.2926 63.3258 27.7879 176.1542 99 M 4.1890 8.0228 119.6019 57.7086 30.8552 177.8327 100 Q 4.0160 7.7913 117.0661 56.7186 29.0533 177.4848 101 F 4.1367 8.2464 119.4100 59.5556 38.9173 177.8555 102 R 3.9571 7.5549 118.2221 59.4144 29.8616 178.7346 103 Q 4.0280 8.0040 118.7907 58.9901 29.0752 177.9989 104 L 3.9160 7.3150 120.6254 58.0114 41.6002 179.3180 105 C 4.1882 8.9358 117.1711 62.5660 27.8542 175.5752 106 Q 3.9010 8.1952 120.8420 59.5011 28.7086 178.0962 107 D 4.3837 8.0867 116.3632 53.6664 41.6247 176.1794 108 K 2.0000 7.2502 118.1868 56.7702 30.1027 177.0440 109 N 4.6593 7.5513 117.9817 51.8128 38.3573 173.3459 110 R 4.1120 8.4843 126.6355 59.2094 30.4076 177.2357 111 D 4.4977 8.3155 118.2381 57.6213 40.8822 179.1029 112 G 3.5727 8.8451 106.3970 47.8451 0.0000 175.6304 113 C 4.0557 8.2946 119.0413 62.6608 28.1484 176.2643 114 I 3.8454 7.9881 121.5660 64.3851 36.6782 178.4866 115 M 4.0234 8.0804 119.4479 58.4318 31.8327 178.7343 116 A 3.9282 8.2340 121.3298 54.7594 18.3541 179.2692 117 L 4.0818 8.5967 119.2068 58.5479 42.1652 179.2030 118 A 4.0476 8.1639 120.5751 54.9456 18.2486 179.7999 119 V 3.5577 7.9541 117.1469 66.1460 31.6126 178.6745 120 V 3.7086 8.2586 119.3997 64.7158 31.0924 178.1679 121 R 3.5762 8.3705 119.7761 59.2270 29.8611 178.2452 122 N 4.2966 8.0592 116.0402 56.4814 38.5561 177.3701 123 E 4.0126 8.2542 120.0046 59.0604 29.4301 179.1252 124 F 4.2581 8.8952 121.1192 61.6883 39.5752 176.6098 125 Y 3.9551 7.9943 116.6150 61.1790 37.7008 178.4567 126 D 4.2150 8.0648 118.7385 57.2416 41.2792 178.1547 127 L 3.6013 7.7516 120.8161 57.7796 42.0568 178.3889 128 R 3.9211 8.2275 119.5975 59.8810 29.8927 178.0073 129 N 4.2597 7.9293 115.7611 56.1820 38.4200 177.5275 130 K 3.8816 7.7042 119.2655 59.6318 32.1669 179.4693 131 F 4.5387 8.1563 118.1492 60.5392 38.7146 177.9403 132 Q 4.0415 8.3089 118.2130 59.1731 28.5571 178.5936 133 T 3.8816 7.7800 110.3905 64.8001 68.6569 175.7003 134 M 3.9828 8.4301 121.5385 58.9915 32.3354 178.4445 135 L 4.1263 8.0772 118.5143 57.4633 41.5236 179.6966 136 Q 3.9529 7.8345 117.5669 58.9154 28.8554 177.8015 137 L 4.1406 7.8961 118.9365 58.2595 41.8188 179.2150 138 E 4.1192 7.9055 116.5325 59.4333 29.5212 177.5307 139 Q 4.2708 7.8221 122.3336 56.5597 29.2645 175.8100 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 Q 8.20 4.33 0.00 2.27 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 10 L 9.29 3.79 0.00 1.90 1.74 1.02 0.32 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 11 N 8.73 4.32 0.00 2.84 2.92 0.00 0.00 7.00 7.15 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 12 A 7.92 4.14 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.92 3.89 0.00 1.80 1.91 0.89 0.77 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 14 L 8.23 4.00 0.00 2.04 2.02 1.08 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.36 4.48 0.00 3.96 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 16 S 8.28 4.11 0.00 3.91 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 17 M 7.95 3.90 0.00 1.69 1.97 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.31 0.00 18 F 8.35 4.58 0.00 3.19 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 19 A 8.33 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 20 S 8.27 4.23 0.00 3.97 4.01 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 21 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 22 L 7.72 4.04 0.00 1.49 1.49 0.75 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.30 4.57 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 0.40 0.00 0.00 0.24 0.00 0.00 24 D 8.34 5.25 0.00 2.96 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 25 E 8.97 4.06 0.00 2.26 2.32 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 2.42 2.46 0.00 26 Q 8.45 4.02 0.00 2.26 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.77 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 27 F 8.22 4.06 0.00 3.33 3.27 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 28 Q 8.15 4.15 0.00 2.48 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 29 Q 7.74 3.97 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 30 L 7.54 4.07 0.00 1.47 1.27 0.93 0.74 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 31 Q 7.54 3.86 0.00 1.80 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.78 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 32 M 7.79 4.04 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.62 0.00 33 L 7.57 4.12 0.00 1.89 1.76 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.85 4.00 0.00 2.03 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.07 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 35 E 8.08 4.19 0.00 2.02 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 2.37 2.51 0.00 36 D 7.47 4.85 0.00 2.78 2.96 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 37 G 8.82 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 38 G 7.90 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 0.00 0.00 0.00 39 T 7.54 4.66 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 1.08 0.00 0.00 40 P 0.00 4.36 0.00 2.20 2.07 0.00 3.80 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 41 G 8.98 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 42 F 8.00 4.16 0.00 3.00 3.10 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 0.00 0.00 0.00 0.00 43 V 8.04 3.40 2.28 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 1.03 0.00 0.00 0.99 0.00 0.00 44 A 7.93 3.92 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 E 8.29 3.83 0.00 2.20 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 2.26 2.30 0.00 46 V 7.59 3.38 1.86 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 0.79 0.00 0.00 0.25 0.00 0.00 47 V 7.76 3.41 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 0.41 0.00 0.00 0.52 0.00 0.00 48 T 7.90 3.88 4.37 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 1.25 0.00 0.00 49 L 8.14 4.03 0.00 1.84 1.87 0.99 1.02 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 50 F 8.15 4.31 0.00 3.18 3.27 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 51 C 8.33 4.09 0.00 3.21 3.10 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 0.00 0.00 0.00 0.00 52 D 8.58 4.33 0.00 2.66 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.63 4.20 0.00 2.65 2.66 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 54 A 8.09 3.56 -0.04 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 0.00 0.00 55 D 7.41 4.07 0.00 3.03 2.79 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 56 R 7.79 3.85 0.00 1.89 1.89 0.00 3.14 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 57 I 8.00 3.60 1.77 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 1.60 0.43 0.86 0.00 0.00 58 I 7.70 3.55 1.76 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 1.36 0.49 0.82 0.00 0.00 59 S 7.78 4.05 0.00 3.82 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 60 E 8.20 3.75 0.00 1.30 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 2.10 2.27 0.00 61 L 8.15 3.86 0.00 1.65 1.65 0.69 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 62 A 7.83 3.92 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 63 A 7.80 4.04 1.28 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 0.00 0.00 64 L 8.19 3.91 0.00 1.74 1.66 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.92 4.23 0.00 1.61 1.72 1.06 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.58 4.80 0.00 2.77 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.02 4.39 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.59 6.67 0.00 0.00 0.00 0.00 0.00 2.63 2.43 0.00 68 P 0.00 4.31 0.00 2.03 2.12 0.00 3.63 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 69 I 7.45 4.31 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.84 0.93 0.00 0.00 70 V 8.12 3.58 1.16 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 -0.17 0.00 0.00 0.73 0.00 0.00 71 D 8.27 4.56 0.00 2.71 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.57 4.36 0.00 3.08 3.04 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 73 D 8.18 4.39 0.00 2.71 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 74 K 7.94 3.86 0.00 1.95 1.97 0.00 1.74 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.56 1.30 7.81 75 V 7.85 3.65 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 0.87 0.00 0.00 0.96 0.00 0.00 76 D 8.26 4.29 0.00 3.07 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 77 A 8.38 3.98 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 78 Y 8.17 4.08 0.00 3.04 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 79 V 8.28 3.34 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 0.60 0.00 0.00 -0.13 0.00 0.00 80 H 8.56 4.08 0.00 3.29 3.46 0.00 5.84 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 81 Q 8.18 3.97 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 82 L 8.06 3.96 0.00 1.67 1.76 0.81 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 83 K 8.65 3.99 0.00 1.89 1.98 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.48 7.81 84 G 8.07 3.68 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 0.00 0.00 0.00 85 S 8.25 4.23 0.00 4.08 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 0.00 86 S 8.56 4.21 0.00 4.24 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 A 8.67 4.00 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.17 4.20 0.00 4.04 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 0.00 89 V 6.87 4.25 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.27 0.00 0.00 90 G 8.15 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 0.00 0.00 0.00 91 A 7.73 4.93 1.18 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 0.00 0.00 0.00 0.00 0.00 92 Q 7.98 3.96 0.00 2.25 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.87 0.00 0.00 0.00 0.00 0.00 2.50 2.44 0.00 93 K 7.97 4.07 0.00 1.87 1.88 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.62 7.81 94 V 7.86 3.68 2.38 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 1.21 0.00 0.00 1.15 0.00 0.00 95 K 8.41 3.94 0.00 2.00 2.05 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.50 7.81 96 F 8.26 4.07 0.00 3.19 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 97 T 8.37 4.05 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 98 C 8.36 4.31 0.00 3.23 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 99 M 8.02 4.19 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 100 Q 7.79 4.02 0.00 1.90 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 101 F 8.25 4.14 0.00 3.33 3.10 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 0.00 0.00 0.00 0.00 102 R 7.55 3.96 0.00 1.89 1.98 0.00 3.39 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 103 Q 8.00 4.03 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.91 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 104 L 7.32 3.92 0.00 2.04 1.66 0.61 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 0.00 105 C 8.94 4.19 0.00 3.10 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 0.00 106 Q 8.20 3.90 0.00 2.01 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 107 D 8.09 4.38 0.00 2.57 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.25 2.00 0.00 1.52 1.23 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.73 1.05 7.81 109 N 7.55 4.66 0.00 2.68 2.78 0.00 0.00 6.90 7.25 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 0.00 110 R 8.48 4.11 0.00 2.16 2.03 0.00 3.31 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 111 D 8.32 4.50 0.00 2.95 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 0.00 112 G 8.85 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 C 8.29 4.06 0.00 3.27 3.25 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 0.00 114 I 7.99 3.85 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.11 0.92 0.00 0.00 115 M 8.08 4.02 0.00 2.05 2.16 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 2.84 2.54 0.00 116 A 8.23 3.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 L 8.60 4.08 0.00 2.07 1.93 0.93 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 118 A 8.16 4.05 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 0.00 119 V 7.95 3.56 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 1.09 0.00 0.00 0.98 0.00 0.00 120 V 8.26 3.71 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 0.88 0.00 0.00 1.03 0.00 0.00 121 R 8.37 3.58 0.00 1.84 1.95 0.00 3.04 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 1.01 0.00 122 N 8.06 4.30 0.00 2.91 2.86 0.00 0.00 7.10 7.18 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 0.00 123 E 8.25 4.01 0.00 2.23 2.06 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 2.35 2.42 0.00 124 F 8.90 4.26 0.00 3.16 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 0.00 125 Y 7.99 3.96 0.00 2.90 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 0.00 126 D 8.06 4.21 0.00 2.85 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 0.00 127 L 7.75 3.60 0.00 1.79 1.67 0.80 -0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 128 R 8.23 3.92 0.00 1.07 1.70 0.00 3.17 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 129 N 7.93 4.26 0.00 2.70 2.79 0.00 0.00 7.11 7.07 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 0.00 130 K 7.70 3.88 0.00 1.59 1.65 0.00 1.57 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.42 7.81 131 F 8.16 4.54 0.00 3.21 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 0.00 132 Q 8.31 4.04 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 133 T 7.78 3.88 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 1.27 0.00 0.00 134 M 8.43 3.98 0.00 2.39 2.39 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.73 0.00 135 L 8.08 4.13 0.00 1.78 1.72 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 136 Q 7.83 3.95 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.84 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 137 L 7.90 4.14 0.00 1.78 1.79 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 138 E 7.91 4.12 0.00 2.14 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 2.38 2.37 0.00 139 Q 7.82 4.27 0.00 2.24 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00