NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2517 8.1727 122.0589 56.3156 34.1421 173.8647 2 V 4.7674 8.2405 126.7812 60.8402 32.6261 174.4096 3 F 4.5724 10.0965 129.2061 57.3281 40.3485 175.2359 4 E 4.1910 9.1792 122.1066 56.0327 30.6835 177.4191 5 R 3.2806 9.0001 121.9441 60.4407 30.0387 179.5986 6 C 4.3323 8.0809 115.2509 59.6677 37.5770 175.6916 7 E 3.8938 8.0970 120.7224 59.2262 29.2416 178.5162 8 L 4.1649 8.0652 121.0666 57.4948 42.1091 178.5683 9 A 3.9579 7.7894 120.6723 55.3833 18.1974 179.9068 10 R 3.8957 7.9737 116.5870 59.3888 30.1938 179.3609 11 T 3.8544 7.8921 109.6552 65.0166 68.6958 176.6123 12 L 3.8915 8.1403 122.5770 56.9230 41.5397 179.4974 13 K 3.9066 8.0079 119.7721 59.4778 31.9626 178.8714 14 R 3.9410 8.0551 118.1711 59.0813 29.9993 177.4607 15 L 4.4135 7.6869 116.2870 54.0234 41.6950 176.9381 16 G 3.8721 7.7502 106.6713 46.8871 0.0000 175.3726 17 M 3.7795 8.0481 122.2280 56.9052 32.2620 176.0006 18 D 4.6271 7.9890 118.3789 55.9612 41.3393 175.9545 19 G 3.9961 9.3625 116.1150 45.1918 0.0000 171.7176 20 Y 4.2354 8.2033 122.2542 58.6036 39.0449 175.9808 21 R 3.5969 8.8323 124.5150 57.0371 27.7927 176.6396 22 G 3.7972 8.1664 103.6005 46.1577 0.0000 173.8576 23 I 4.1489 8.0100 121.9233 59.0581 38.1995 176.0716 24 S 4.8256 8.3259 120.8081 57.8847 65.1255 174.7164 25 L 4.2474 8.8366 124.2320 58.3438 41.6565 179.1522 26 A 4.1650 8.1462 120.2319 55.4694 18.3392 179.1111 27 N 4.4208 7.8557 113.4868 56.4574 38.5878 177.7261 28 W 4.1515 7.9372 119.8364 59.9488 29.1062 178.5740 29 M 4.1743 8.4188 118.8104 58.5155 31.4554 177.9601 30 C 3.5810 8.4863 118.8959 59.1857 44.9779 175.3588 31 L 3.9916 8.2786 121.8083 58.2845 41.7545 178.7341 32 A 3.9705 8.2769 120.7327 54.9531 18.2648 179.4431 33 K 2.9440 8.0201 117.9463 59.3920 32.0218 179.1714 34 W 4.0692 7.6115 116.9901 59.3776 29.0561 178.2721 35 E 4.3410 8.3280 118.5202 58.7718 29.0794 177.8687 36 S 4.4726 8.1414 109.0874 56.7257 65.3931 174.4848 37 G 3.1613 8.0636 109.0296 46.9233 0.0000 173.5699 38 Y 3.6364 7.6634 113.3499 58.4225 35.4048 168.3705 39 N 5.3238 7.6323 119.3329 51.8610 40.3063 175.9333 40 T 3.9133 9.1065 117.1865 64.3860 69.0712 175.8766 41 R 4.3290 8.4858 119.4667 56.0617 30.5193 176.3335 42 A 4.3610 7.6323 122.2274 52.4164 19.4893 177.0728 43 T 5.3535 8.0723 110.0455 60.8214 71.8150 172.7928 44 N 5.0550 8.3194 119.9933 51.9843 43.8428 172.5968 45 Y 4.4649 8.6316 123.3200 57.1286 40.6515 173.4246 46 N 4.6838 8.3261 126.2607 51.7632 39.9226 174.8217 47 A 3.9318 8.7842 130.1888 55.3793 18.7045 178.5967 48 G 3.8501 8.1054 103.2039 48.9983 0.0000 174.7242 49 D 4.3887 8.1808 117.8299 54.3857 41.2350 176.2414 50 R 4.2260 7.6427 114.4430 55.1032 28.9829 175.1714 51 S 4.6954 6.9988 109.8652 59.4326 66.4930 173.7456 52 T 4.8012 8.3950 116.1375 62.8695 70.2013 173.8273 53 D 5.2354 8.7457 125.4502 53.0339 43.5045 174.8842 54 Y 4.5612 9.2314 121.1140 57.0911 40.3838 176.5847 55 G 4.0134 9.0383 114.0644 45.5531 0.0000 174.0878 56 I 3.5958 8.4680 118.0428 63.0774 37.8558 177.5672 57 F 4.8358 7.9870 114.8174 56.6493 39.8672 175.1774 58 Q 3.6060 7.8495 119.1434 57.0598 26.7647 174.1817 59 I 4.3520 8.0097 118.7193 61.1830 38.9015 177.1229 60 N 5.4400 9.0687 123.9198 52.7096 38.8459 175.6637 61 S 4.6467 8.7041 114.7731 59.5570 63.4529 175.4008 62 R 3.8609 8.2587 121.1406 59.0996 30.1392 176.4562 63 Y 4.5845 8.7400 114.1768 57.9817 40.4739 177.6053 64 W 4.7071 8.1734 119.2997 57.7891 30.1670 173.5396 65 C 5.6717 7.9412 110.1798 53.4925 46.0484 173.2767 66 N 4.7442 8.9634 119.7584 52.8703 39.8408 173.0620 67 H 4.7480 8.8648 127.0102 54.8446 31.1918 174.8293 68 G 3.6975 8.6957 115.4751 47.5390 0.0000 172.8089 69 K 3.7674 8.1716 112.0333 57.4523 31.7656 175.3368 70 T 4.0408 8.1506 115.6529 63.9749 68.8912 173.3261 71 P 4.3215 0.0000 0.0000 65.4184 32.0087 177.6312 72 G 3.8843 7.8270 106.8361 44.7468 0.0000 173.0758 73 A 4.7094 7.3468 120.2127 49.9927 21.7258 177.7350 74 V 3.5192 8.5531 122.1279 65.7710 32.4770 176.0547 75 N 4.1291 8.2708 115.8300 54.1688 36.8974 174.2754 76 A 3.9952 8.3550 122.1233 55.4025 19.0523 178.2921 77 C 4.5960 8.7796 111.1279 56.8581 41.2258 172.8865 78 H 4.0442 8.3567 119.6287 56.5938 28.2988 173.5267 79 L 4.7279 8.4793 119.1440 53.0463 46.7218 176.4626 80 S 4.6826 8.3811 115.7427 58.0030 64.2746 175.9664 81 C 3.9658 8.7882 121.4421 60.2251 40.0524 176.8257 82 S 4.0451 8.0195 115.1305 61.3358 62.3556 176.2479 83 A 4.0236 7.7821 123.1854 54.3723 18.1293 178.5170 84 L 4.4780 7.4770 115.0620 55.0307 41.9290 177.1244 85 L 5.3717 7.6119 117.3934 53.7673 42.3112 176.5591 86 Q 4.3772 7.7760 118.1850 55.5348 29.5006 175.7775 87 D 4.4683 8.5050 118.6451 56.4619 41.2416 176.5647 88 N 4.6815 8.0661 117.9705 52.7136 39.0770 174.4832 89 I 4.2609 8.3699 119.2679 61.0264 37.9270 176.9134 90 A 3.9489 8.4296 125.0626 55.9166 18.1521 180.1035 91 D 4.2619 8.0939 116.3921 57.5559 40.9519 178.7156 92 A 4.1074 8.0172 120.7383 55.1918 18.4126 179.7488 93 V 3.3141 8.0788 116.6000 65.9240 31.4790 178.0795 94 A 3.8368 8.0941 120.7540 55.3574 18.2206 178.8530 95 C 4.1973 8.3768 116.7458 59.6435 40.7907 175.6584 96 A 3.8986 8.1028 122.5839 54.8055 17.5795 179.7280 97 K 3.6925 7.5511 116.5225 59.4586 32.1745 179.1567 98 R 4.0364 7.5127 119.0816 59.3135 29.8883 178.5891 99 V 2.6078 7.2874 117.9219 65.9343 31.5378 178.3936 100 V 4.0137 7.9457 111.2069 63.7506 31.1972 178.3573 101 R 4.1914 7.7197 117.3145 57.2051 30.3365 176.4516 102 D 4.7607 7.4551 119.3124 51.3111 40.6086 175.2887 103 P 4.2506 0.0000 0.0000 65.8345 30.8729 177.3981 104 Q 4.1361 8.3272 116.5120 56.1679 30.2758 177.0781 105 G 4.1287 7.9797 108.1310 47.3396 0.0000 176.7242 106 I 3.6502 7.9237 121.3647 63.5194 37.9289 177.9292 107 R 4.3111 7.4013 118.1001 58.2165 29.9559 177.5682 108 A 4.5295 7.5483 119.6118 53.2582 18.6523 177.2229 109 W 4.6872 8.2085 116.4951 55.0527 29.8002 177.0307 110 V 3.7050 8.7436 124.0479 66.1419 30.8812 177.5265 111 A 3.9991 8.2797 119.9186 54.8373 18.1383 179.3415 112 W 3.8797 8.2333 126.3933 60.7646 30.6441 178.4746 113 R 3.5773 8.2409 116.1650 59.2244 29.5891 178.3798 114 N 4.3565 8.2402 115.6863 55.4602 38.8041 176.8440 115 R 3.9973 8.0660 116.0755 55.8934 31.2563 176.0621 116 C 4.6020 7.1595 113.6194 57.6811 43.0226 174.7070 117 Q 3.2266 6.5658 120.0484 57.1890 29.0578 175.9720 118 N 4.1126 8.6324 122.0037 53.5923 35.6382 172.5393 119 R 4.4614 7.1122 114.2433 55.5395 34.5137 176.6027 120 D 4.6504 8.2988 119.3160 54.7038 38.7118 177.3332 121 V 4.2135 7.9787 116.9161 62.8522 31.7562 177.2359 122 R 3.9366 8.1473 119.0344 59.7182 29.1803 178.0202 123 Q 3.9441 7.8099 116.4364 59.2791 28.2124 178.0469 124 Y 4.4577 7.4672 118.1021 60.1353 38.3366 176.7393 125 V 4.2792 7.4610 110.8915 60.7797 32.2360 175.6794 126 Q 4.1344 7.4808 119.6190 57.4587 28.8018 177.0844 127 G 3.9609 8.8297 109.1506 46.3773 0.0000 175.0569 128 C 4.3513 8.1715 117.2471 57.5106 40.4406 174.0382 129 G 3.8402 7.9976 106.7084 46.7187 0.0000 173.9361 130 V 3.9465 7.9159 117.8949 61.0978 31.8003 176.2440 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 K 8.17 4.25 0.00 1.84 1.95 0.00 1.31 0.00 0.00 1.58 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.13 1.40 7.81 2 V 8.24 4.77 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 0.93 0.00 0.00 0.96 0.00 0.00 3 F 10.10 4.57 0.00 2.77 2.84 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 0.00 0.00 0.00 4 E 9.18 4.19 0.00 1.94 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 0.00 2.33 2.26 0.00 5 R 9.00 3.28 0.00 1.93 1.94 0.00 3.44 0.00 0.00 3.55 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.77 0.00 6 C 8.08 4.33 0.00 3.00 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 7 E 8.10 3.89 0.00 2.04 2.29 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 2.71 2.42 0.00 8 L 8.07 4.16 0.00 1.50 1.40 0.00 0.39 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 9 A 7.79 3.96 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 10 R 7.97 3.90 0.00 2.07 2.00 0.00 3.14 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 11 T 7.89 3.85 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 1.41 0.00 0.00 12 L 8.14 3.89 0.00 1.64 1.63 0.95 0.92 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 13 K 8.01 3.91 0.00 2.04 1.94 0.00 1.54 0.00 0.00 1.60 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.49 7.81 14 R 8.06 3.94 0.00 2.00 2.05 0.00 3.30 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 15 L 7.69 4.41 0.00 1.54 1.54 0.86 0.77 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 16 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 17 M 8.05 3.78 0.00 1.27 1.99 0.00 0.00 0.00 0.00 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.21 0.00 18 D 7.99 4.63 0.00 2.70 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 19 G 9.36 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 20 Y 8.20 4.24 0.00 3.32 3.06 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 21 R 8.83 3.60 0.00 2.01 1.90 0.00 3.40 0.00 0.00 3.00 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 1.60 0.00 22 G 8.17 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 0.00 0.00 0.00 23 I 8.01 4.15 1.85 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.45 -0.24 0.00 0.00 24 S 8.33 4.83 0.00 4.11 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 25 L 8.84 4.25 0.00 2.23 1.82 1.02 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.15 4.17 1.45 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 0.00 0.00 0.00 27 N 7.86 4.42 0.00 2.81 2.74 0.00 0.00 7.10 7.55 0.00 0.00 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 W 7.94 4.15 0.00 3.56 3.21 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 29 M 8.42 4.17 0.00 2.16 2.47 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.87 0.00 30 C 8.49 3.58 0.00 3.14 3.32 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 31 L 8.28 3.99 0.00 1.87 1.85 0.82 -0.26 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 32 A 8.28 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 33 K 8.02 2.94 0.00 1.53 1.47 0.00 1.18 0.00 0.00 1.28 0.00 0.00 2.87 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.46 0.69 7.81 34 W 7.61 4.07 0.00 3.33 3.32 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 35 E 8.33 4.34 0.00 2.01 2.12 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 2.62 2.58 0.00 36 S 8.14 4.47 0.00 4.03 4.11 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 37 G 8.06 3.16 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 38 Y 7.66 3.64 0.00 3.28 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 39 N 7.63 5.32 0.00 2.71 2.80 0.00 0.00 6.99 6.93 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 40 T 9.11 3.91 4.42 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 1.45 0.00 0.00 41 R 8.49 4.33 0.00 1.98 2.02 0.00 3.19 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 42 A 7.63 4.36 1.24 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 0.00 0.00 43 T 8.07 5.35 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 1.18 0.00 0.00 44 N 8.32 5.06 0.00 2.78 2.68 0.00 0.00 6.74 7.48 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 45 Y 8.63 4.46 0.00 3.12 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 46 N 8.33 4.68 0.00 2.77 2.46 0.00 0.00 6.66 7.63 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 47 A 8.78 3.93 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 48 G 8.11 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 49 D 8.18 4.39 0.00 2.67 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 50 R 7.64 4.23 0.00 2.09 2.12 0.00 3.10 0.00 0.00 3.14 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.47 0.00 51 S 7.00 4.70 0.00 3.91 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 52 T 8.39 4.80 4.27 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 0.68 0.00 0.00 53 D 8.75 5.24 0.00 2.61 2.64 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 54 Y 9.23 4.56 0.00 3.11 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 55 G 9.04 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 0.00 0.00 0.00 56 I 8.47 3.60 1.59 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.36 -0.21 0.00 0.00 57 F 7.99 4.84 0.00 3.26 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 58 Q 7.85 3.61 0.00 2.54 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.85 0.00 0.00 0.00 0.00 0.00 2.52 2.77 0.00 59 I 8.01 4.35 2.10 0.00 0.00 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 1.47 0.48 1.11 0.00 0.00 60 N 9.07 5.44 0.00 2.92 3.33 0.00 0.00 5.99 7.57 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 61 S 8.70 4.65 0.00 3.92 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 62 R 8.26 3.86 0.00 1.55 1.65 0.00 2.98 0.00 0.00 2.96 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.21 0.00 63 Y 8.74 4.58 0.00 2.03 1.80 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 64 W 8.17 4.71 0.00 3.59 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 65 C 7.94 5.67 0.00 3.10 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 66 N 8.96 4.74 0.00 2.77 2.71 0.00 0.00 7.01 8.75 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 67 H 8.86 4.75 0.00 3.04 3.21 0.00 6.10 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.70 3.70 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 0.00 0.00 0.00 69 K 8.17 3.77 0.00 1.94 1.91 0.00 1.46 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.48 7.81 70 T 8.15 4.04 4.23 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 1.20 0.00 0.00 71 P 0.00 4.32 0.00 2.03 2.11 0.00 3.66 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 72 G 7.83 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 0.00 0.00 0.00 73 A 7.35 4.71 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 74 V 8.55 3.52 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 0.76 0.00 0.00 0.96 0.00 0.00 75 N 8.27 4.13 0.00 2.94 2.75 0.00 0.00 7.00 8.40 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 76 A 8.35 4.00 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 77 C 8.78 4.60 0.00 3.29 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 78 H 8.36 4.04 0.00 3.20 3.31 0.00 5.73 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.48 4.73 0.00 1.68 1.48 0.92 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.38 4.68 0.00 3.96 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 81 C 8.79 3.97 0.00 2.54 1.61 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.02 4.05 0.00 4.07 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 83 A 7.78 4.02 1.45 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 0.00 0.00 0.00 84 L 7.48 4.48 0.00 1.92 1.84 1.06 0.78 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 85 L 7.61 5.37 0.00 1.81 1.73 1.10 1.38 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 86 Q 7.78 4.38 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.63 7.10 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 87 D 8.51 4.47 0.00 2.67 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 88 N 8.07 4.68 0.00 2.70 2.76 0.00 0.00 6.96 7.94 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 89 I 8.37 4.26 1.80 0.00 0.00 0.49 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 0.58 0.86 0.00 0.00 90 A 8.43 3.95 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 91 D 8.09 4.26 0.00 2.72 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 92 A 8.02 4.11 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.08 3.31 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 0.66 0.00 0.00 0.96 0.00 0.00 94 A 8.09 3.84 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 95 C 8.38 4.20 0.00 3.10 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 96 A 8.10 3.90 0.81 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 0.00 0.00 97 K 7.55 3.69 0.00 1.69 1.50 0.00 1.28 0.00 0.00 0.95 0.00 0.00 2.13 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.30 0.85 7.81 98 R 7.51 4.04 0.00 1.84 2.03 0.00 3.35 0.00 0.00 3.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.76 0.00 99 V 7.29 2.61 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 -0.04 0.00 0.00 -0.31 0.00 0.00 100 V 7.95 4.01 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 1.27 0.00 0.00 1.43 0.00 0.00 101 R 7.72 4.19 0.00 1.97 2.05 0.00 3.24 0.00 0.00 3.48 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.14 0.00 102 D 7.46 4.76 0.00 2.92 2.97 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 0.00 103 P 0.00 4.25 0.00 2.19 2.26 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 1.98 0.00 104 Q 8.33 4.14 0.00 2.20 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.84 0.00 0.00 0.00 0.00 0.00 2.49 2.25 0.00 105 G 7.98 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 0.00 0.00 0.00 0.00 106 I 7.92 3.65 1.07 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.79 0.00 0.00 107 R 7.40 4.31 0.00 2.04 2.11 0.00 3.30 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.59 0.00 108 A 7.55 4.53 0.96 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 0.00 109 W 8.21 4.69 0.00 3.68 3.13 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 0.00 110 V 8.74 3.70 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 1.17 0.00 0.00 0.99 0.00 0.00 111 A 8.28 4.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.23 3.88 0.00 3.45 3.51 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 0.00 113 R 8.24 3.58 0.00 1.98 2.00 0.00 3.55 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.27 0.00 114 N 8.24 4.36 0.00 2.61 2.70 0.00 0.00 6.92 7.73 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 0.00 115 R 8.07 4.00 0.00 0.99 0.66 0.00 2.21 0.00 0.00 2.67 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.50 0.00 116 C 7.16 4.60 0.00 2.05 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 0.00 117 Q 6.57 3.23 0.00 0.93 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.80 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 118 N 8.63 4.11 0.00 2.79 2.80 0.00 0.00 6.91 7.66 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 0.00 119 R 7.11 4.46 0.00 1.80 1.77 0.00 3.09 0.00 0.00 3.10 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.53 0.00 120 D 8.30 4.65 0.00 2.61 2.57 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 0.00 121 V 7.98 4.21 2.54 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 1.01 0.00 0.00 1.05 0.00 0.00 122 R 8.15 3.94 0.00 1.88 1.93 0.00 3.18 0.00 0.00 3.38 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 123 Q 7.81 3.94 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.69 0.00 0.00 0.00 0.00 0.00 1.97 1.35 0.00 124 Y 7.47 4.46 0.00 3.22 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 0.00 125 V 7.46 4.28 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 1.02 0.00 0.00 1.03 0.00 0.00 126 Q 7.48 4.13 0.00 2.26 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.20 0.00 0.00 0.00 0.00 0.00 2.58 2.44 0.00 127 G 8.83 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 0.00 128 C 8.17 4.35 0.00 3.13 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 0.00 129 G 8.00 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.92 3.95 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 0.78 0.00 0.00 0.96 0.00 0.00