NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.2956 8.1749 110.9369 61.3136 70.1159 173.0004 4 K 4.5835 8.3159 124.2599 53.6555 34.8797 173.8051 5 T 4.3029 8.6598 117.7562 61.5276 68.8638 175.7142 *7 K 4.2725 9.1341 120.6678 56.3616 33.9975 176.7172 8 E 4.0164 8.0628 118.2332 59.3278 29.2541 179.5217 9 K 3.9699 8.2980 118.5327 59.3945 32.0161 179.2674 10 A 4.2329 8.0001 120.6225 55.0748 18.4287 179.5854 11 V 3.5908 8.1049 116.8459 66.2874 31.3978 177.9913 12 E 3.9771 7.8829 116.7043 59.3882 29.6641 178.8031 13 L 4.1678 8.1389 120.1924 58.1286 42.1954 178.7899 14 L 3.4335 8.2700 120.3570 58.2150 41.8061 178.8446 15 Q 4.1905 7.9501 116.4822 58.6188 28.6771 178.5473 16 K 4.2516 7.7318 117.5179 56.3690 32.7585 176.3331 17 C 4.6027 7.7609 117.9330 58.4258 29.4202 173.4500 18 E 4.4718 8.6367 122.2263 56.2471 30.2555 175.3945 19 V 4.8025 7.4624 118.1154 61.0790 34.5781 174.6180 20 V 4.7397 8.2978 118.2646 60.0327 36.7375 174.0034 21 T 4.8536 8.9396 118.7160 61.8548 70.9342 173.3730 22 L 5.1146 9.1891 128.6135 53.1308 45.0888 174.6836 23 A 5.8831 9.7686 127.9043 49.4724 22.0386 175.4925 24 S 5.1320 8.5357 115.3127 56.5131 66.8812 172.4905 25 V 4.8367 8.0007 119.5675 61.0005 33.2381 175.2566 26 N 5.0976 9.3524 125.7525 50.9012 38.4934 176.0450 27 K 3.9880 8.4651 116.8873 59.5589 32.5420 177.5205 28 E 4.2349 8.4732 117.5325 56.5176 29.5968 177.1637 29 G 3.8387 8.3891 107.8662 45.0691 0.0000 172.9354 30 Y 4.4853 7.9153 118.2666 56.3703 39.3166 173.1918 31 P 4.9081 0.0000 0.0000 62.8988 33.0179 176.5597 32 R 4.6486 9.0462 121.3950 53.6444 32.0032 171.7323 33 P 5.1151 0.0000 0.0000 62.3065 32.7242 176.3020 34 V 4.6744 9.0263 122.8719 59.2362 35.0495 173.1541 35 P 5.2501 0.0000 0.0000 62.2451 32.5749 175.5057 *37 S 4.2406 8.3083 114.9292 58.2184 63.7566 173.8866 38 K 4.3510 8.7977 127.0465 55.5840 31.7761 176.4385 39 I 4.1781 8.8344 121.4901 63.4053 38.5265 175.7171 40 A 4.7864 7.7951 119.3467 51.1963 22.3627 175.0149 41 A 5.1453 8.5714 119.6442 50.7505 22.9426 176.0476 42 E 4.3955 9.4821 121.2956 54.1034 31.1104 176.8053 43 G 3.7916 8.8064 117.8949 47.1200 0.0000 173.0580 44 I 4.4371 8.4078 117.2303 60.5718 38.3418 176.7910 45 S 4.3639 8.0577 119.0228 61.4671 63.2059 174.1197 46 T 5.1641 8.0663 115.9264 61.7486 72.4429 173.4608 47 I 5.0035 8.8091 126.1413 59.4457 41.2117 174.7501 48 W 5.5920 9.6701 126.4594 54.2130 32.2691 175.1196 *50 S 4.8079 8.3487 115.3824 59.3125 64.0455 172.2446 51 T 4.5512 8.4674 113.9941 61.2192 71.5034 172.5732 52 G 4.2885 8.7452 111.1150 45.8040 0.0000 175.0009 53 A 4.1877 9.0003 125.6625 54.2106 18.5711 178.2603 54 D 4.9007 7.9650 113.4006 53.9331 41.7483 176.7319 55 S 4.4333 7.8635 113.4920 57.8238 64.9395 174.8457 56 L 3.9629 8.4895 123.0761 57.9603 41.3470 179.9077 57 K 3.7144 8.0449 117.7593 59.8464 32.0900 179.1169 58 T 4.0377 8.1523 115.8670 66.8249 67.9089 176.6263 59 I 3.6985 7.9021 121.4949 64.4648 37.0229 178.0435 60 D 4.1685 8.2062 119.9036 57.6862 40.4754 179.1805 61 F 5.2010 7.8154 117.5364 59.7492 38.9522 177.5701 62 L 4.2137 8.0535 118.4907 56.8035 41.4192 177.8941 63 S 4.5741 7.5658 111.1533 58.1677 64.9914 173.6602 64 N 4.7950 8.5572 120.0262 51.2966 40.3061 172.4573 65 P 4.7306 0.0000 0.0000 64.3826 32.7356 176.3429 66 K 4.6638 8.2849 121.2941 56.6234 32.3368 176.2651 67 A 5.3046 9.3248 126.1855 50.4490 22.9903 175.2772 68 G 4.4045 9.0487 104.8781 44.6005 0.0000 171.6888 69 L 5.2784 8.9377 124.6408 53.2267 45.6248 174.8079 70 C 5.5298 9.1696 120.2986 56.7685 33.6474 172.5852 71 F 5.4291 8.4109 113.4297 56.1582 41.2361 173.2806 72 Q 4.8644 8.6225 117.0104 54.9763 31.2473 174.0562 73 E 4.2868 8.8655 122.4067 55.8159 32.5818 174.8650 74 K 3.5903 9.2860 127.5467 57.2642 28.4875 177.6734 75 G 3.6501 7.8487 105.3162 45.5123 0.0000 171.8340 76 D 4.6659 7.3341 120.3193 52.8407 42.4563 175.9510 77 S 4.9408 8.9214 117.2942 56.5846 67.3486 173.0566 78 V 4.7165 8.2760 119.9394 61.0396 35.0069 173.8230 79 A 5.0327 9.0207 129.2259 50.4314 21.8070 174.9069 80 L 5.1591 8.4988 124.8555 52.4516 45.5802 174.5661 *82 G 3.8291 8.2375 105.1741 46.2960 0.0000 171.6485 83 E 5.1829 8.1034 119.3409 54.4506 33.9295 175.1179 84 V 4.5206 8.2464 122.4788 61.1647 33.3896 174.6368 85 E 4.5496 8.4874 127.3054 54.6868 31.6684 175.2372 86 V 4.2991 8.3698 124.6538 62.5575 32.5291 175.2862 87 V 4.6428 9.2875 122.0650 59.7500 34.1633 176.4456 88 T 4.3120 8.4545 112.5940 60.5021 69.7152 173.2794 89 D 4.2485 8.1179 122.1309 55.1570 41.8297 176.1258 90 E 3.8324 8.9100 127.5677 59.7616 29.4944 179.4302 91 K 3.9276 8.5778 119.5650 59.3677 32.1566 178.9690 92 L 3.8651 7.8646 118.8051 57.4356 41.5002 178.9649 93 K 3.8039 7.8008 119.0811 59.0393 32.4362 178.8605 94 Q 4.2790 8.1210 117.7671 58.7451 28.5654 178.3520 95 E 4.0936 8.1520 118.9005 58.5659 29.5648 178.3027 96 L 4.4276 7.8530 116.3938 53.0545 42.5558 176.6624 97 W 3.9552 7.4119 129.2191 57.4963 31.4298 175.0450 98 Q 4.1798 5.7400 122.8759 53.2502 31.3864 176.1603 99 D 4.3450 8.3760 120.6731 57.3144 40.5506 178.9544 100 W 4.4246 7.7441 115.3406 58.3008 28.3829 177.9015 101 F 3.3923 6.9353 119.1991 59.7977 37.6496 177.3292 102 I 3.9479 7.4715 120.0945 64.5461 36.7323 177.9471 103 E 3.7603 7.4936 117.8770 59.2001 29.2536 178.2534 104 H 4.6338 7.1586 114.0256 55.1987 31.3642 174.6373 105 F 5.0958 8.0537 119.9595 54.5897 39.0066 173.7289 106 P 4.5248 0.0000 0.0000 64.2948 31.5355 177.6380 107 G 3.7295 8.9155 106.8787 45.4209 0.0000 175.0220 108 G 3.3017 8.2149 109.6304 43.6448 0.0000 172.2693 109 P 4.3610 0.0000 0.0000 64.5845 31.0019 176.4233 110 T 4.2847 7.3208 111.9960 61.6264 68.5975 173.6083 111 D 4.4227 8.3355 121.7420 55.0325 41.4476 175.6167 112 P 4.3616 0.0000 0.0000 64.9684 31.7466 177.5254 113 G 3.7693 9.1607 106.8845 46.6244 0.0000 171.9523 114 Y 3.9369 7.7282 123.0703 55.7295 40.2699 174.5290 115 V 4.2733 8.2169 125.7070 61.0255 35.5027 174.0894 116 L 5.1948 8.5570 125.7575 53.2389 44.5639 175.4044 117 L 5.0064 8.6251 121.4244 53.0251 44.5842 175.2899 118 K 3.6948 8.7016 126.8698 54.5833 33.5344 174.7129 119 F 4.8912 8.8292 131.6637 57.1776 41.1024 174.3493 120 T 4.7690 8.1220 123.0186 61.5414 70.7941 173.4374 121 A 4.2941 8.4038 128.8249 51.6219 19.0703 176.5491 122 N 4.8462 8.7318 116.7791 54.3031 41.9408 174.3644 123 H 5.1179 8.0577 116.9761 54.6177 33.6298 172.1451 124 A 4.9308 9.1339 126.8133 50.3039 22.6041 175.1392 125 T 4.7856 8.7212 116.8088 62.0995 71.7199 172.6560 126 Y 4.9016 9.3639 125.2543 56.2532 40.5539 175.0797 127 W 5.2224 9.3980 134.6634 55.2223 31.2393 173.3292 128 I 4.8954 8.1351 123.8964 58.0043 40.9160 174.9809 129 E 3.5637 9.2068 123.1618 58.9841 26.8456 174.6683 130 G 4.2144 7.5563 98.9807 46.5698 0.0000 172.9124 131 T 4.5988 7.6462 114.9606 61.2254 71.2984 173.0603 132 F 5.4998 8.7980 124.9822 56.6961 40.4008 175.3920 133 I 4.7156 9.1119 123.7470 59.9713 41.5370 174.1051 134 H 5.3106 9.1219 122.9731 54.1614 30.9286 172.7443 135 K 4.7221 8.8525 123.1695 53.8266 35.3775 176.0822 136 K 4.2900 8.6702 124.9295 56.5534 33.1603 176.5828 137 L 4.4417 9.1013 126.4406 54.8853 41.4321 176.3762 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 3 T 8.17 4.30 4.22 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 1.20 0.00 0.00 4 K 8.32 4.58 0.00 1.79 1.74 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.54 7.81 5 T 8.66 4.30 4.16 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 1.18 0.00 0.00 *7 K 9.13 4.27 0.00 1.91 1.88 0.00 1.82 0.00 0.00 1.96 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.46 1.59 7.81 8 E 8.06 4.02 0.00 2.25 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 2.34 2.35 0.00 9 K 8.30 3.97 0.00 1.68 1.83 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.51 7.81 10 A 8.00 4.23 1.75 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 11 V 8.10 3.59 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 1.06 0.00 0.00 1.04 0.00 0.00 12 E 7.88 3.98 0.00 2.25 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 2.36 2.47 0.00 13 L 8.14 4.17 0.00 2.17 2.13 1.02 0.49 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 14 L 8.27 3.43 0.00 1.53 1.64 -0.17 0.85 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 15 Q 7.95 4.19 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.67 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 16 K 7.73 4.25 0.00 1.95 2.09 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.65 7.81 17 C 7.76 4.60 0.00 2.88 3.03 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 0.00 0.00 0.00 18 E 8.64 4.47 0.00 1.94 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 2.30 2.19 0.00 19 V 7.46 4.80 2.07 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 0.82 0.00 0.00 0.88 0.00 0.00 20 V 8.30 4.74 2.22 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 0.79 0.00 0.00 0.92 0.00 0.00 21 T 8.94 4.85 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 1.24 0.00 0.00 22 L 9.19 5.11 0.00 1.72 1.57 1.01 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 23 A 9.77 5.88 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 24 S 8.54 5.13 0.00 3.18 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 25 V 8.00 4.84 2.08 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 0.85 0.00 0.00 0.95 0.00 0.00 26 N 9.35 5.10 0.00 2.97 2.95 0.00 0.00 6.60 7.24 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 27 K 8.47 3.99 0.00 1.89 2.00 0.00 1.57 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.49 7.81 28 E 8.47 4.23 0.00 2.31 2.33 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 2.41 2.31 0.00 29 G 8.39 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 30 Y 7.92 4.49 0.00 3.05 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 31 P 0.00 4.91 0.00 2.10 2.06 0.00 3.83 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 32 R 9.05 4.65 0.00 1.68 1.84 0.00 3.09 0.00 0.00 3.40 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 33 P 0.00 5.12 0.00 2.09 2.07 0.00 3.74 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 34 V 9.03 4.67 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 0.92 0.00 0.00 0.96 0.00 0.00 35 P 0.00 5.25 0.00 2.10 2.13 0.00 3.42 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.84 0.00 *37 S 8.31 4.24 0.00 4.29 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 38 K 8.80 4.35 0.00 1.68 1.86 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.38 7.81 39 I 8.83 4.18 2.07 0.00 0.00 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 1.63 0.90 1.38 0.00 0.00 40 A 7.80 4.79 1.31 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 0.00 0.00 41 A 8.57 5.15 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 42 E 9.48 4.40 0.00 1.99 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 2.35 2.44 0.00 43 G 8.81 3.79 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 0.00 0.00 0.00 44 I 8.41 4.44 2.08 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.87 1.13 0.00 0.00 45 S 8.06 4.36 0.00 4.08 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 46 T 8.07 5.16 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 0.83 0.00 0.00 47 I 8.81 5.00 1.90 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 1.23 0.81 0.90 0.00 0.00 48 W 9.67 5.59 0.00 3.45 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 *50 S 8.35 4.81 0.00 3.87 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 51 T 8.47 4.55 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 1.33 0.00 0.00 52 G 8.75 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 53 A 9.00 4.19 1.31 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 0.00 0.00 54 D 7.97 4.90 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 55 S 7.86 4.43 0.00 4.17 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 56 L 8.49 3.96 0.00 1.69 1.74 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.04 3.71 0.00 1.85 2.05 0.00 1.96 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.54 1.58 7.81 58 T 8.15 4.04 4.44 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 1.34 0.00 0.00 59 I 7.90 3.70 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.96 0.91 0.00 0.00 60 D 8.21 4.17 0.00 2.31 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.82 5.20 0.00 3.07 3.01 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 62 L 8.05 4.21 0.00 1.84 1.77 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 63 S 7.57 4.57 0.00 3.81 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 64 N 8.56 4.79 0.00 2.68 2.70 0.00 0.00 6.78 8.45 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 65 P 0.00 4.73 0.00 2.14 2.29 0.00 3.79 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 2.08 2.01 0.00 66 K 8.28 4.66 0.00 1.89 1.85 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.42 7.81 67 A 9.32 5.30 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 9.05 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 0.00 0.00 0.00 0.00 69 L 8.94 5.28 0.00 0.57 0.69 0.35 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 70 C 9.17 5.53 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 71 F 8.41 5.43 0.00 3.09 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 72 Q 8.62 4.86 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 73 E 8.87 4.29 0.00 1.96 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 2.22 2.30 0.00 74 K 9.29 3.59 0.00 1.97 1.78 0.00 1.77 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.40 7.81 75 G 7.85 3.65 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 0.00 76 D 7.33 4.67 0.00 2.72 2.48 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 77 S 8.92 4.94 0.00 3.93 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 78 V 8.28 4.72 0.67 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 0.73 0.00 0.00 0.87 0.00 0.00 79 A 9.02 5.03 1.17 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 0.00 0.00 80 L 8.50 5.16 0.00 1.85 1.93 0.93 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 *82 G 8.24 3.83 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 0.00 0.00 0.00 83 E 8.10 5.18 0.00 1.72 1.64 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 2.14 2.30 0.00 84 V 8.25 4.52 0.67 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 0.09 0.00 0.00 0.58 0.00 0.00 85 E 8.49 4.55 0.00 1.84 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.10 0.00 86 V 8.37 4.30 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 0.81 0.00 0.00 1.03 0.00 0.00 87 V 9.29 4.64 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 0.94 0.00 0.00 1.09 0.00 0.00 88 T 8.45 4.31 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 1.17 0.00 0.00 89 D 8.12 4.25 0.00 2.73 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 90 E 8.91 3.83 0.00 2.00 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 2.35 2.35 0.00 91 K 8.58 3.93 0.00 1.77 1.92 0.00 1.60 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.44 7.81 92 L 7.86 3.87 0.00 1.73 1.38 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 93 K 7.80 3.80 0.00 1.74 1.87 0.00 1.37 0.00 0.00 1.40 0.00 0.00 3.01 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.50 1.15 7.81 94 Q 8.12 4.28 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 95 E 8.15 4.09 0.00 1.95 1.93 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 2.31 2.37 0.00 96 L 7.85 4.43 0.00 1.73 1.74 0.00 0.95 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 97 W 7.41 3.96 0.00 3.77 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 98 Q 5.74 4.18 0.00 0.93 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.63 0.00 0.00 0.00 0.00 0.00 1.31 1.99 0.00 99 D 8.38 4.35 0.00 2.68 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 0.00 100 W 7.74 4.42 0.00 3.57 3.28 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 0.00 101 F 6.94 3.39 0.00 1.51 1.72 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 0.00 102 I 7.47 3.95 1.96 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 1.92 1.24 1.02 0.00 0.00 103 E 7.49 3.76 0.00 1.96 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 2.35 2.52 0.00 104 H 7.16 4.63 0.00 1.91 2.23 0.00 5.79 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 F 8.05 5.10 0.00 3.29 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 0.00 106 P 0.00 4.52 0.00 2.11 2.17 0.00 3.94 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 107 G 8.92 3.73 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 0.00 0.00 0.00 108 G 8.21 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 0.00 0.00 0.00 109 P 0.00 4.36 0.00 2.09 1.76 0.00 3.05 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.25 0.00 110 T 7.32 4.28 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 1.16 0.00 0.00 111 D 8.34 4.42 0.00 2.98 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 0.00 112 P 0.00 4.36 0.00 2.10 2.10 0.00 3.78 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 113 G 9.16 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 0.00 0.00 0.00 114 Y 7.73 3.94 0.00 1.85 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 0.00 115 V 8.22 4.27 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 0.96 0.00 0.00 0.88 0.00 0.00 116 L 8.56 5.19 0.00 1.82 1.92 0.87 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 117 L 8.63 5.01 0.00 1.63 1.51 1.13 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.70 3.69 0.00 1.01 1.30 0.00 1.23 0.00 0.00 1.62 0.00 0.00 2.57 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.76 0.21 7.81 119 F 8.83 4.89 0.00 3.02 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 0.00 120 T 8.12 4.77 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 1.06 0.00 0.00 121 A 8.40 4.29 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 0.00 122 N 8.73 4.85 0.00 2.65 2.83 0.00 0.00 6.44 8.16 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 0.00 123 H 8.06 5.12 0.00 3.22 3.09 0.00 5.80 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 0.00 124 A 9.13 4.93 0.62 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 0.00 0.00 125 T 8.72 4.79 4.22 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 1.28 0.00 0.00 126 Y 9.36 4.90 0.00 2.89 2.87 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 0.00 127 W 9.40 5.22 0.00 3.39 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 0.00 128 I 8.14 4.90 1.83 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.58 0.82 0.00 0.00 129 E 9.21 3.56 0.00 2.00 1.91 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 2.13 2.20 0.00 130 G 7.56 4.21 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 0.00 131 T 7.65 4.60 4.36 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 1.25 0.00 0.00 132 F 8.80 5.50 0.00 3.00 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 0.00 133 I 9.11 4.72 2.01 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.00 1.11 0.00 0.00 134 H 9.12 5.31 0.00 3.02 3.32 0.00 5.84 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 K 8.85 4.72 0.00 1.86 1.75 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.42 1.48 7.81 136 K 8.67 4.29 0.00 1.81 1.73 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.61 1.45 7.81 137 L 9.10 4.44 0.00 1.54 1.58 0.99 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.