NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5856 8.1476 120.3457 55.5482 33.4787 175.1509 2 T 3.9995 8.5123 117.2812 60.8405 71.1117 174.2436 3 M 4.0896 8.7025 121.3602 58.6090 32.4715 179.7668 4 E 3.9417 8.2018 118.8126 59.5517 29.8254 178.7927 5 Q 4.0212 8.1804 118.0269 58.7223 28.5985 178.4635 6 F 4.1178 8.5375 121.9432 61.3443 39.2508 177.1048 7 L 3.7468 7.9521 117.2345 58.2184 41.6150 179.4766 8 T 3.9711 7.7557 115.3168 66.4486 68.2533 176.8815 9 S 4.0322 8.0491 116.3616 61.2059 62.8069 176.4624 10 L 3.6945 7.2178 122.6370 57.9321 41.3572 179.3230 11 D 4.3678 7.7207 118.6406 57.5553 40.4802 178.8130 12 M 4.0781 7.7302 117.9916 58.2546 32.3578 178.4331 13 I 3.8000 8.0305 120.3912 64.3283 37.2895 178.1961 14 R 4.1077 7.9784 119.8231 59.7764 29.6488 178.6193 15 S 4.4615 8.0555 112.6410 60.9751 62.9545 175.8682 16 G 3.9003 7.8324 107.0958 45.6406 0.0000 173.8048 17 C 5.0187 7.9158 116.8114 58.3232 42.0956 175.5384 18 A 4.2345 8.7790 122.6396 55.1108 17.7441 177.8304 19 P 4.3811 0.0000 0.0000 64.8354 31.5037 178.1861 20 K 4.0072 7.9329 116.2523 56.7427 32.1842 176.1047 21 F 5.0097 7.6197 116.5241 55.4847 42.7416 174.4308 22 K 4.4948 9.2788 121.9047 55.0778 31.9899 176.3925 23 L 4.8365 8.1531 123.0291 52.1652 45.6300 176.8857 24 K 4.4336 8.2135 120.6758 55.3832 34.2938 178.1337 25 T 3.8186 8.4124 120.7399 66.8105 68.5735 176.2221 26 E 3.8515 8.1115 120.5830 59.3391 29.5832 178.5996 27 D 3.9588 7.7221 118.3718 57.1897 41.0058 178.4684 28 L 3.9878 7.6884 119.0822 57.8625 41.0794 179.2345 29 D 4.3679 8.3927 119.1678 57.4980 40.6801 179.2025 30 R 3.9593 7.7952 118.1405 59.3318 30.0050 179.1469 31 L 3.7403 8.0484 118.7566 57.7007 41.6576 179.4954 32 R 4.8238 8.3126 120.0952 58.3101 29.6538 177.9675 33 V 4.2592 7.3422 108.7606 60.8833 31.6720 176.2313 34 G 4.3285 8.5230 107.2398 46.6098 0.0000 174.3840 35 D 4.8092 8.4193 120.9197 53.0209 39.8661 175.3842 36 F 4.4836 8.7900 122.5906 57.2172 39.7044 177.0352 37 N 4.8612 8.4415 119.5211 51.4283 37.4399 174.7699 38 F 4.9172 6.9437 110.7328 55.0272 40.9332 172.6620 39 P 4.2441 0.0000 0.0000 61.8012 31.7229 174.6018 40 P 4.3806 0.0000 0.0000 61.6770 32.6684 176.5798 41 S 4.3662 8.1129 115.4272 57.7762 65.3107 175.0459 42 Q 3.8647 8.4364 122.6595 59.4313 28.6531 178.0466 43 D 4.3783 8.0388 119.3759 57.3565 40.9339 178.4218 44 L 3.8620 7.9129 120.6764 58.3514 42.1751 178.9290 45 M 4.0346 7.8385 118.6133 58.6858 31.7974 178.2061 46 C 4.3461 8.3532 116.8496 59.7417 41.1945 175.4427 47 Y 3.5196 7.4864 121.9360 60.7237 37.7829 178.3395 48 T 4.1811 7.9069 110.6811 64.6482 68.6583 176.4389 49 K 4.0189 7.8985 122.0460 59.4091 32.3619 177.7945 50 C 4.2575 8.4768 119.1125 59.9160 37.8408 175.8353 51 V 3.4201 7.7549 119.5699 66.1679 31.2055 178.2460 52 S 4.3151 8.3965 114.8917 61.4028 62.4281 176.6403 53 L 4.0551 8.1451 121.6204 57.9792 41.4282 178.8195 54 M 4.1448 7.8487 116.8620 58.5442 32.2474 177.8522 55 A 4.2003 7.7244 119.5012 52.9387 18.5927 178.4986 56 G 3.8695 7.7530 104.6666 46.1777 0.0000 174.4580 57 T 4.2199 7.7707 109.4940 62.1371 69.6691 174.5751 58 V 5.2681 7.6379 113.5623 58.5620 35.7982 174.2910 59 N 4.8449 8.2355 119.0663 51.2296 39.2638 175.8473 60 K 4.1800 8.4388 116.4685 58.7371 31.8006 178.2137 61 K 4.2060 8.2706 117.4970 56.1752 32.3281 177.9089 62 G 3.9749 8.4966 107.5464 45.8942 0.0000 173.4469 63 E 4.0787 8.6234 120.7612 55.2975 29.9330 176.0372 64 F 4.7259 8.2989 126.6919 57.9026 40.2881 175.0743 65 N 4.5414 8.0404 126.6854 51.2563 38.6805 175.0079 66 A 3.6844 7.8926 128.5701 54.3964 18.8036 176.9829 67 P 4.1437 0.0000 0.0000 65.7548 31.4201 178.7749 68 K 3.8906 8.3128 118.0394 59.2279 32.1791 178.6320 69 A 3.9701 8.1942 121.5383 55.2516 18.0792 179.5791 70 L 3.9366 7.9801 116.2698 57.9875 41.7721 179.4503 71 A 4.1343 7.8409 119.6254 54.9046 18.6091 179.2149 72 Q 4.1354 8.2250 116.2949 57.9180 28.7895 178.1400 73 L 3.9325 7.7408 120.6082 57.7671 41.5299 177.8136 74 P 4.2295 0.0000 0.0000 65.0940 31.2618 177.2139 75 H 4.7682 8.4035 113.0988 55.4996 29.0300 175.1245 76 L 4.6960 7.6793 120.3619 55.3624 44.0978 176.9355 77 V 4.2934 7.8680 109.4987 58.3425 35.4442 173.5822 78 P 4.6845 0.0000 0.0000 61.0362 32.4100 175.3625 79 P 4.1483 0.0000 0.0000 66.2186 30.8861 178.7039 80 E 4.0437 8.1606 115.4883 58.6374 29.6884 177.9783 81 M 4.4490 7.8563 117.0320 55.0535 32.7343 177.5884 82 M 3.9677 7.7426 120.7182 58.4366 32.1543 178.1362 83 E 3.8842 8.0379 118.7860 59.4641 29.9141 178.1911 84 M 3.9782 7.9803 117.7238 58.7935 32.2794 178.2281 85 S 4.0138 8.0723 115.1576 61.6460 63.0287 176.8450 86 R 3.9165 8.4434 121.0942 59.0782 29.7899 179.0186 87 K 3.9195 8.2128 119.4865 59.7143 32.1931 179.1098 88 S 4.0759 8.1329 115.4525 61.2441 62.5327 176.5942 89 V 3.6451 8.0208 121.4875 66.2101 31.0633 177.6626 90 E 3.9760 8.0133 117.1285 59.3925 29.5911 178.4433 91 A 4.2084 8.1196 119.3038 54.0681 18.6744 177.3211 92 C 4.8584 8.0080 113.3322 56.5184 41.2155 176.0475 93 R 4.1409 7.8912 118.2429 58.7264 29.2595 177.1906 94 D 4.8207 7.9561 116.1462 54.2650 42.0070 177.8790 95 T 3.9155 7.8716 117.9068 67.0504 68.4700 175.8361 96 H 4.4221 8.3368 116.1611 58.5000 28.1963 177.4513 97 K 4.0406 7.6132 120.2940 58.7822 31.8913 178.3001 98 Q 3.9663 7.8055 116.6048 55.8542 29.0632 175.5887 99 F 4.9458 7.3195 117.3337 55.6499 42.8819 174.5821 100 K 4.3926 8.7372 121.2398 57.6227 33.6824 177.5176 101 E 4.3574 7.9972 119.3142 55.1246 31.6860 177.0086 102 S 4.3741 8.5400 122.8486 61.4290 63.0789 177.5054 103 C 4.3053 8.4969 119.9963 59.4855 39.8395 175.5258 104 E 3.7329 8.6108 120.9343 59.1704 29.3063 178.8062 105 R 3.9071 8.1359 118.2728 59.4325 30.1284 179.2390 106 V 3.4948 7.6543 117.3294 66.0648 31.5518 177.1497 107 Y 3.9002 7.9362 120.8231 60.2642 38.4766 178.4367 108 Q 3.6188 8.0859 118.8660 58.8285 28.6079 178.8960 109 T 3.3195 7.3674 116.1796 66.2471 68.4122 176.4900 110 A 3.0615 7.3660 122.8810 54.5533 18.2140 179.4622 111 K 2.4800 7.0008 118.3145 59.2276 32.0484 177.9762 112 C 3.9316 7.6204 118.7036 59.6642 41.2484 175.4450 113 F 4.0913 7.4272 119.4527 60.6767 38.2110 177.8952 114 S 3.2849 6.8098 112.3532 60.9865 62.7362 175.8973 115 E 4.0979 7.5094 121.1072 58.4095 29.4952 177.9861 116 N 4.5661 8.1656 115.0440 53.1817 39.0443 175.4767 117 A 3.9420 7.1810 124.2797 52.8018 18.6465 176.6888 118 D 4.8030 8.7571 122.0653 53.0310 39.9727 176.3692 119 G 4.0915 7.3523 107.4370 45.2655 0.0000 172.4539 120 Q 4.2268 8.6937 118.5913 55.9293 29.2865 175.2986 121 F 5.1811 8.8217 124.0321 56.7123 42.0771 174.1180 122 M 5.3839 7.8552 123.6009 52.1499 35.4167 174.3619 123 W 4.6636 8.6558 132.5257 54.4750 34.0139 173.8270 124 P 4.2915 0.0000 0.0000 63.0475 30.7178 176.1672 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 8.15 4.59 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.61 0.00 2 T 8.51 4.00 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 1.22 0.00 0.00 3 M 8.70 4.09 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 4 E 8.20 3.94 0.00 2.05 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 2.39 2.42 0.00 5 Q 8.18 4.02 0.00 2.33 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 6 F 8.54 4.12 0.00 3.08 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 7 L 7.95 3.75 0.00 1.64 1.69 0.97 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 8 T 7.76 3.97 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 1.18 0.00 0.00 9 S 8.05 4.03 0.00 3.95 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 10 L 7.22 3.69 0.00 1.57 1.59 0.68 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 11 D 7.72 4.37 0.00 2.73 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 12 M 7.73 4.08 0.00 1.96 2.19 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 13 I 8.03 3.80 1.87 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.83 0.75 0.00 0.00 14 R 7.98 4.11 0.00 2.25 2.16 0.00 3.13 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.87 0.00 15 S 8.06 4.46 0.00 4.10 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 16 G 7.83 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 17 C 7.92 5.02 0.00 3.08 3.31 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.78 4.23 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.38 0.00 2.04 2.14 0.00 3.70 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.21 0.00 20 K 7.93 4.01 0.00 1.00 1.07 0.00 1.61 0.00 0.00 1.57 0.00 0.00 3.24 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.40 7.81 21 F 7.62 5.01 0.00 3.08 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 22 K 9.28 4.49 0.00 1.77 1.80 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.42 7.81 23 L 8.15 4.84 0.00 1.51 1.40 0.66 0.85 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 24 K 8.21 4.43 0.00 1.74 1.66 0.00 1.64 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 3.43 0.00 0.00 0.00 0.00 1.45 1.49 7.81 25 T 8.41 3.82 4.20 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 1.18 0.00 0.00 26 E 8.11 3.85 0.00 1.94 1.83 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 2.15 2.28 0.00 27 D 7.72 3.96 0.00 2.87 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 28 L 7.69 3.99 0.00 1.81 1.67 0.76 0.34 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 D 8.39 4.37 0.00 2.77 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 30 R 7.80 3.96 0.00 1.82 2.18 0.00 2.74 0.00 0.00 2.91 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 31 L 8.05 3.74 0.00 1.79 1.67 0.84 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 32 R 8.31 4.82 0.00 2.09 2.19 0.00 3.15 0.00 0.00 3.36 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 33 V 7.34 4.26 2.16 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 0.77 0.00 0.00 1.09 0.00 0.00 34 G 8.52 4.33 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 0.00 35 D 8.42 4.81 0.00 2.74 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 36 F 8.79 4.48 0.00 2.88 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 37 N 8.44 4.86 0.00 2.96 2.89 0.00 0.00 6.67 6.92 0.00 0.00 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 F 6.94 4.92 0.00 3.09 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 39 P 0.00 4.24 0.00 2.05 1.99 0.00 3.82 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.08 0.00 40 P 0.00 4.38 0.00 1.48 1.23 0.00 3.49 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.57 0.00 41 S 8.11 4.37 0.00 4.04 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 42 Q 8.44 3.86 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.93 0.00 0.00 0.00 0.00 0.00 2.44 2.52 0.00 43 D 8.04 4.38 0.00 2.82 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 L 7.91 3.86 0.00 1.70 1.63 0.88 0.85 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 45 M 7.84 4.03 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 1.64 0.00 46 C 8.35 4.35 0.00 2.78 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 47 Y 7.49 3.52 0.00 2.58 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 48 T 7.91 4.18 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 1.30 0.00 0.00 49 K 7.90 4.02 0.00 1.92 2.08 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.51 1.51 7.81 50 C 8.48 4.26 0.00 3.33 3.35 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 51 V 7.75 3.42 2.27 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 0.37 0.00 0.00 0.47 0.00 0.00 52 S 8.40 4.32 0.00 4.21 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 53 L 8.15 4.06 0.00 1.82 1.77 0.98 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 54 M 7.85 4.14 0.00 2.16 2.09 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 2.60 2.54 0.00 55 A 7.72 4.20 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 G 7.75 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 57 T 7.77 4.22 4.48 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 1.33 0.00 0.00 58 V 7.64 5.27 2.17 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 1.27 0.00 0.00 1.02 0.00 0.00 59 N 8.24 4.84 0.00 2.95 2.97 0.00 0.00 5.97 7.20 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 60 K 8.44 4.18 0.00 1.79 1.94 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.49 7.81 61 K 8.27 4.21 0.00 2.00 1.86 0.00 1.76 0.00 0.00 1.85 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.45 7.81 62 G 8.50 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 63 E 8.62 4.08 0.00 2.13 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 0.00 2.40 2.28 0.00 64 F 8.30 4.73 0.00 2.90 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 65 N 8.04 4.54 0.00 2.62 2.45 0.00 0.00 6.76 9.18 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 66 A 7.89 3.68 1.40 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 0.00 0.00 0.00 67 P 0.00 4.14 0.00 2.12 2.10 0.00 3.73 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 2.09 2.14 0.00 68 K 8.31 3.89 0.00 1.77 1.81 0.00 1.60 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.41 7.81 69 A 8.19 3.97 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 70 L 7.98 3.94 0.00 1.77 1.74 0.93 0.99 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 71 A 7.84 4.13 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 72 Q 8.23 4.14 0.00 2.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.61 0.00 0.00 0.00 0.00 0.00 2.50 2.67 0.00 73 L 7.74 3.93 0.00 1.84 1.74 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.23 0.00 1.98 2.08 0.00 3.87 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 2.04 2.17 0.00 75 H 8.40 4.77 0.00 3.15 3.35 0.00 5.79 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.68 4.70 0.00 1.62 1.71 0.97 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 77 V 7.87 4.29 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 0.63 0.00 0.00 0.82 0.00 0.00 78 P 0.00 4.68 0.00 2.31 2.21 0.00 3.16 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.74 0.00 79 P 0.00 4.15 0.00 2.14 2.14 0.00 3.58 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 80 E 8.16 4.04 0.00 1.85 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 2.30 2.44 0.00 81 M 7.86 4.45 0.00 1.83 1.76 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 82 M 7.74 3.97 0.00 2.01 2.18 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 2.58 2.80 0.00 83 E 8.04 3.88 0.00 2.05 1.92 0.00 0.00 0.00 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 2.41 0.00 84 M 7.98 3.98 0.00 2.11 2.04 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 2.85 2.66 0.00 85 S 8.07 4.01 0.00 4.07 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 86 R 8.44 3.92 0.00 1.92 1.97 0.00 3.12 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 87 K 8.21 3.92 0.00 1.79 2.02 0.00 1.62 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.47 7.81 88 S 8.13 4.08 0.00 3.75 3.62 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 89 V 8.02 3.65 2.27 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 1.22 0.00 0.00 1.05 0.00 0.00 90 E 8.01 3.98 0.00 2.02 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 0.00 2.34 2.39 0.00 91 A 8.12 4.21 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 92 C 8.01 4.86 0.00 3.26 2.86 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 93 R 7.89 4.14 0.00 2.15 2.53 0.00 3.12 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.71 0.00 94 D 7.96 4.82 0.00 2.72 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 95 T 7.87 3.92 4.13 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 0.00 0.00 0.00 1.25 0.00 0.00 96 H 8.34 4.42 0.00 3.50 3.64 0.00 5.66 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.61 4.04 0.00 1.87 1.85 0.00 1.64 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.39 1.17 7.81 98 Q 7.81 3.97 0.00 1.63 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.68 0.00 0.00 0.00 0.00 0.00 2.19 2.26 0.00 99 F 7.32 4.95 0.00 3.00 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 0.00 100 K 8.74 4.39 0.00 1.77 1.88 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.42 7.81 101 E 8.00 4.36 0.00 2.04 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 2.39 2.32 0.00 102 S 8.54 4.37 0.00 4.15 4.18 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 0.00 103 C 8.50 4.31 0.00 3.22 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 0.00 104 E 8.61 3.73 0.00 1.96 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 1.74 2.00 0.00 105 R 8.14 3.91 0.00 2.14 2.18 0.00 3.35 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 2.02 1.93 0.00 106 V 7.65 3.49 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 1.19 0.00 0.00 1.09 0.00 0.00 107 Y 7.94 3.90 0.00 3.00 2.80 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 0.00 108 Q 8.09 3.62 0.00 1.63 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.08 1.16 0.00 109 T 7.37 3.32 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 110 A 7.37 3.06 0.34 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 0.00 111 K 7.00 2.48 0.00 0.94 1.34 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.15 1.23 7.81 112 C 7.62 3.93 0.00 2.83 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 0.00 113 F 7.43 4.09 0.00 2.48 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 0.00 114 S 6.81 3.28 0.00 4.13 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 0.00 115 E 7.51 4.10 0.00 1.82 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 2.25 2.31 0.00 116 N 8.17 4.57 0.00 2.72 2.81 0.00 0.00 6.96 6.95 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 0.00 117 A 7.18 3.94 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 0.00 118 D 8.76 4.80 0.00 2.79 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 0.00 119 G 7.35 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 0.00 120 Q 8.69 4.23 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.64 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 121 F 8.82 5.18 0.00 3.06 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 0.00 122 M 7.86 5.38 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.41 0.00 123 W 8.66 4.66 0.00 3.68 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 0.00 124 P 0.00 4.29 0.00 1.75 1.88 0.00 2.20 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.69 0.00