NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2767 8.3144 120.1350 55.9159 33.2326 175.1111 2 E 3.9389 8.4203 123.7833 54.0929 30.4555 174.9605 3 T 4.0359 8.7042 118.0048 61.4146 71.9261 174.8604 4 A 3.9608 8.5303 123.7608 55.4154 18.4494 180.0414 5 A 4.1226 7.9702 118.5452 55.2928 18.5176 179.6022 6 A 4.2823 8.1069 120.7162 54.5533 18.3495 179.7534 7 K 4.1084 8.3149 119.7797 59.0579 32.2718 178.7640 8 F 4.0420 8.3606 120.9252 61.2541 38.7694 176.8865 9 E 4.0460 8.3853 118.1811 59.5318 29.1168 179.3577 10 R 3.9073 7.8572 117.1711 59.6797 30.2528 178.2981 11 Q 3.9395 8.0799 116.8749 58.1153 28.9727 176.3362 12 H 4.7641 7.8863 113.4779 53.9337 31.3141 173.0630 13 M 4.7991 8.0273 119.0025 53.7667 33.7555 176.2531 14 D 4.7244 9.1436 123.1546 52.9434 41.8526 175.5440 15 S 4.5293 8.5240 115.7570 58.7667 63.5794 175.2606 16 S 4.4651 7.9538 115.2564 59.3030 63.4639 174.2112 17 T 4.7635 7.4735 110.1677 59.6635 71.5304 174.0681 18 S 4.1954 8.6394 116.8713 60.6959 63.6901 173.9125 19 A 3.8140 7.0800 119.8456 50.6844 21.2456 175.5058 20 A 3.4738 8.5294 124.2963 52.5578 18.5176 178.2957 21 S 4.5353 8.5062 116.9592 58.5798 64.3864 173.6536 22 S 4.6263 7.3923 114.9092 57.0897 65.3012 175.3103 23 S 4.2461 8.6171 115.1931 60.9463 62.9736 174.7925 24 N 4.6967 8.1298 117.3990 53.6061 39.0644 176.0098 25 Y 4.0007 8.1632 120.7637 61.2273 38.7015 177.6803 26 C 4.1872 8.3372 116.9386 59.9344 37.4609 175.6558 27 N 4.3950 8.2503 117.6187 56.5794 38.1822 177.3154 28 Q 3.9093 7.8255 118.9175 59.3493 28.8289 178.7557 29 M 3.7905 7.6477 121.2727 57.8071 31.7280 178.7500 30 M 3.9952 8.1607 119.3750 58.0065 31.9767 178.8113 31 K 4.0144 7.9307 121.1235 59.1437 32.0382 179.2518 32 S 4.1262 8.0456 113.8043 61.0879 63.1984 175.5600 33 R 4.3415 8.0734 118.1806 55.6619 29.6387 175.7936 34 N 4.2094 7.7154 114.0802 54.7513 36.4875 174.8077 35 L 4.5708 8.1733 115.9897 54.9652 41.8876 177.9418 36 T 5.1017 7.5072 107.1683 60.1163 69.6661 175.7307 37 K 4.0408 8.5262 123.7661 59.8799 32.2713 177.3400 38 D 4.7458 8.1455 114.4481 53.5051 43.1374 175.9046 39 R 3.8601 7.1723 113.6139 54.7520 32.0423 174.3884 40 C 4.8912 8.5478 116.6279 55.7689 40.5960 173.9100 41 K 4.1956 8.5690 127.3823 55.9630 32.5105 174.8634 42 P 4.7558 0.0000 0.0000 64.6796 32.4295 176.5687 43 V 5.0378 7.5258 116.8244 61.3761 34.8760 174.2494 44 N 4.6336 9.1208 123.8759 52.9398 42.9538 172.8705 45 T 4.7515 7.9932 122.2432 61.7973 71.1731 173.1613 46 F 4.8966 8.9174 124.8116 55.7149 41.9189 174.6721 47 V 4.5687 8.8148 123.3080 61.1282 33.2440 175.8505 48 H 5.6462 8.8765 128.7115 53.9894 26.2454 173.1187 49 E 4.8026 7.6677 117.7587 53.3504 34.6341 176.4910 50 S 4.3726 8.3502 114.6880 58.1748 64.9746 174.8492 51 L 3.9747 7.9076 121.8422 58.4692 41.8532 179.3149 52 A 4.1719 8.0287 120.0764 55.4932 18.1193 179.2273 53 D 4.3403 8.0705 116.2926 57.3742 41.1486 178.9073 54 V 3.8017 7.8697 118.7930 66.0162 31.6280 178.0257 55 Q 3.8854 8.5593 118.0757 58.9835 28.5715 178.8236 56 A 4.0220 8.1598 121.3889 54.7076 18.2243 179.6718 57 V 3.4547 7.5726 117.1142 66.1285 31.2959 176.9694 58 C 3.7618 7.7840 114.6095 57.9182 39.8572 174.1540 59 S 4.6825 7.5471 114.4598 57.9557 63.8038 174.7926 60 Q 4.0371 7.5527 122.7246 56.1374 27.3438 177.0250 61 K 4.3588 8.2594 129.6409 56.8825 33.1560 175.4651 62 N 4.3751 8.7974 127.3102 53.4453 39.3087 174.3687 63 V 4.5930 8.3307 118.4055 59.0065 36.5759 175.0894 64 A 4.2688 8.4942 125.2542 52.5985 18.9982 178.5361 65 C 4.7222 8.6978 118.9104 55.9886 41.2861 175.2075 66 K 3.7147 8.8066 121.8951 59.7602 31.6442 178.0598 67 N 4.5196 8.0556 112.8351 52.9413 37.5089 175.8667 68 G 3.9193 8.2245 107.9774 45.5818 0.0000 174.1416 69 Q 4.2287 8.3933 119.3654 56.1875 29.2889 176.5067 70 T 4.6797 8.3592 108.2807 61.6232 69.1606 174.0828 71 N 5.0903 7.9151 118.7028 53.4821 38.6015 174.6867 72 C 5.2992 7.4738 116.3813 56.8121 44.2240 172.5429 73 Y 5.0653 8.8994 118.7281 56.3275 42.0422 173.8868 74 Q 5.1494 9.0864 125.5837 53.9284 31.2544 174.9262 75 S 4.3598 8.8563 122.2960 58.8170 63.0681 174.4605 76 Y 4.5298 9.1641 121.5144 60.5322 37.9341 176.5444 77 S 5.0560 7.8324 112.8489 56.5467 65.3146 174.5973 78 T 4.1550 8.2980 111.3703 62.2203 69.6329 173.3398 79 M 5.0605 8.9027 121.8401 53.3523 36.9724 174.6913 80 S 4.7738 9.2547 117.4862 58.4716 63.5149 173.1068 81 I 5.2404 9.1239 120.3055 59.5451 41.7079 174.2108 82 T 4.9749 8.8939 119.4016 61.9060 71.8859 172.6529 83 D 4.9061 9.1299 127.0923 53.6006 43.1148 174.2312 84 C 5.6269 9.1128 122.8919 55.3664 42.4506 173.2490 85 R 5.3956 8.9455 121.8698 54.1644 34.1065 174.7451 86 E 4.2034 9.1309 122.9621 56.9139 30.9348 176.9551 87 T 4.2862 8.3752 114.1414 60.0230 71.2007 175.9496 88 G 3.6423 8.6187 109.7646 48.4141 0.0000 174.8947 89 S 4.2770 7.4750 113.0181 59.5153 63.1110 174.2836 90 S 4.1299 7.6664 116.7789 57.5993 62.7373 173.6263 91 K 4.2446 8.7475 129.1810 55.3337 33.6136 174.1551 92 Y 4.3121 8.7447 128.3093 57.8057 38.9986 174.6615 93 P 3.4775 0.0000 0.0000 62.7135 32.0412 176.7213 94 N 4.7649 8.0612 119.2431 51.8970 37.4221 173.6160 95 C 4.6326 7.8897 117.0767 57.0093 42.8017 173.4098 96 A 4.9783 8.3361 123.3564 50.9040 22.3462 174.8727 97 Y 5.1811 9.1514 119.8099 55.8801 41.9020 175.3479 98 K 4.3479 9.2097 125.0071 56.4370 33.8753 175.4754 99 T 5.0436 8.5797 123.5332 62.3092 70.4446 173.9480 100 T 4.5283 8.8903 123.4713 61.6918 71.5319 173.0650 101 Q 4.7471 8.7303 128.0288 55.7063 30.2722 174.4408 102 A 4.6443 8.9082 126.0347 51.2428 23.7011 174.6439 103 N 5.4361 8.6391 116.0727 51.7892 40.7935 174.5285 104 K 4.7328 9.0246 122.4956 54.8654 37.4771 175.7521 105 H 4.8973 9.1875 120.0632 56.1050 29.9385 174.6633 106 I 4.7715 8.7067 115.2113 59.3070 40.6961 174.4052 107 I 4.9154 8.1806 124.5114 59.7159 40.0172 175.0080 108 V 4.7868 8.5954 119.6667 59.3096 35.7158 174.5931 109 A 4.9848 8.6757 125.4145 51.2974 20.3866 175.7478 110 C 5.1298 8.7528 119.0024 55.3112 38.0090 173.4464 111 E 4.7046 8.6575 119.8317 56.3194 34.3642 174.9095 112 G 4.1013 9.5056 107.5760 44.7599 0.0000 171.8703 113 N 5.0292 8.1778 116.1231 50.5928 40.2454 172.1181 114 P 4.3371 0.0000 0.0000 62.8168 32.0209 175.8461 115 Y 4.9001 8.2109 121.2479 56.3593 38.6815 174.5480 116 V 4.4296 8.0067 119.0585 58.3199 36.6375 173.4906 117 P 4.4359 0.0000 0.0000 62.8824 31.0218 176.9385 118 V 4.4308 8.7160 115.3974 61.2445 34.0565 175.4343 119 H 5.2091 7.8788 116.3078 54.2422 33.6152 172.2731 120 F 4.7312 8.9660 124.1398 57.3544 39.2782 174.7209 121 D 4.5662 8.5689 127.3145 56.4582 41.8157 175.7698 122 A 4.5810 6.5590 117.3903 51.6000 22.3268 174.8445 123 S 5.2376 8.8917 113.1741 56.7461 66.3937 174.7564 124 V 4.1589 8.7916 113.6368 61.7200 32.5317 175.5605 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 8.31 4.28 0.00 1.77 1.82 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.44 7.81 2 E 8.42 3.94 0.00 2.09 1.82 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 2.39 2.37 0.00 3 T 8.70 4.04 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 1.22 0.00 0.00 4 A 8.53 3.96 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 5 A 7.97 4.12 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 6 A 8.11 4.28 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 7 K 8.31 4.11 0.00 2.00 2.01 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.31 7.81 8 F 8.36 4.04 0.00 3.19 3.26 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 9 E 8.39 4.05 0.00 2.33 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 2.46 2.63 0.00 10 R 7.86 3.91 0.00 1.80 2.07 0.00 3.37 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 8.08 3.94 0.00 1.57 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.47 0.00 0.00 0.00 0.00 0.00 2.23 2.45 0.00 12 H 7.89 4.76 0.00 1.93 2.67 0.00 5.60 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.03 4.80 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.69 0.00 14 D 9.14 4.72 0.00 2.61 2.42 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 15 S 8.52 4.53 0.00 3.93 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 0.00 16 S 7.95 4.47 0.00 3.93 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 17 T 7.47 4.76 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 1.26 0.00 0.00 18 S 8.64 4.20 0.00 3.96 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 19 A 7.08 3.81 1.06 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 0.00 0.00 20 A 8.53 3.47 0.83 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 21 S 8.51 4.54 0.00 3.97 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 22 S 7.39 4.63 0.00 4.00 3.99 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 23 S 8.62 4.25 0.00 4.04 4.08 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 24 N 8.13 4.70 0.00 2.84 2.89 0.00 0.00 6.43 7.30 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 25 Y 8.16 4.00 0.00 3.14 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.34 4.19 0.00 3.17 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 N 8.25 4.39 0.00 2.90 2.92 0.00 0.00 7.14 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 28 Q 7.83 3.91 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 29 M 7.65 3.79 0.00 0.78 1.25 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 1.00 1.45 0.00 30 M 8.16 4.00 0.00 1.66 1.78 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.36 0.00 31 K 7.93 4.01 0.00 1.90 1.89 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.31 7.81 32 S 8.05 4.13 0.00 3.98 4.02 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.07 4.34 0.00 1.99 2.14 0.00 3.61 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 34 N 7.72 4.21 0.00 2.89 2.91 0.00 0.00 6.82 7.98 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 35 L 8.17 4.57 0.00 1.77 1.64 0.81 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.51 5.10 4.41 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 1.40 0.00 0.00 37 K 8.53 4.04 0.00 1.78 1.91 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.51 7.81 38 D 8.15 4.75 0.00 2.59 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 0.00 0.00 0.00 0.00 39 R 7.17 3.86 0.00 1.77 1.70 0.00 2.89 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 40 C 8.55 4.89 0.00 3.10 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 41 K 8.57 4.20 0.00 1.86 1.78 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.59 1.42 7.81 42 P 0.00 4.76 0.00 2.15 2.10 0.00 3.90 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 2.13 1.94 0.00 43 V 7.53 5.04 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 0.79 0.00 0.00 0.97 0.00 0.00 44 N 9.12 4.63 0.00 2.65 2.28 0.00 0.00 6.90 7.85 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 45 T 7.99 4.75 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 0.84 0.00 0.00 46 F 8.92 4.90 0.00 2.93 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 47 V 8.81 4.57 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 1.22 0.00 0.00 1.09 0.00 0.00 48 H 8.88 5.65 0.00 3.09 3.39 0.00 5.61 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.67 4.80 0.00 1.95 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 2.27 2.28 0.00 50 S 8.35 4.37 0.00 4.07 4.02 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.91 3.97 0.00 1.90 1.75 1.01 1.31 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 52 A 8.03 4.17 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 53 D 8.07 4.34 0.00 2.85 2.78 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 0.00 0.00 0.00 54 V 7.87 3.80 2.20 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 1.26 0.00 0.00 1.11 0.00 0.00 55 Q 8.56 3.89 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 56 A 8.16 4.02 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 57 V 7.57 3.45 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 1.10 0.00 0.00 1.00 0.00 0.00 58 C 7.78 3.76 0.00 2.86 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 59 S 7.55 4.68 0.00 3.91 3.82 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 60 Q 7.55 4.04 0.00 1.75 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.92 0.00 0.00 0.00 0.00 0.00 1.66 2.13 0.00 61 K 8.26 4.36 0.00 2.09 1.88 0.00 1.63 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.51 1.46 7.81 62 N 8.80 4.38 0.00 2.70 2.63 0.00 0.00 7.00 7.71 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 63 V 8.33 4.59 2.01 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 0.73 0.00 0.00 0.82 0.00 0.00 64 A 8.49 4.27 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 65 C 8.70 4.72 0.00 3.13 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 66 K 8.81 3.71 0.00 1.74 1.88 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.53 7.81 67 N 8.06 4.52 0.00 2.81 2.90 0.00 0.00 6.16 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 68 G 8.22 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 0.00 0.00 0.00 0.00 69 Q 8.39 4.23 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 70 T 8.36 4.68 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 1.19 0.00 0.00 71 N 7.92 5.09 0.00 3.08 3.16 0.00 0.00 6.09 7.68 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 72 C 7.47 5.30 0.00 2.89 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 73 Y 8.90 5.07 0.00 2.84 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 74 Q 9.09 5.15 0.00 2.03 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.98 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 75 S 8.86 4.36 0.00 3.92 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 76 Y 9.16 4.53 0.00 3.02 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 77 S 7.83 5.06 0.00 3.90 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 0.00 78 T 8.30 4.16 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 1.03 0.00 0.00 79 M 8.90 5.06 0.00 1.97 2.00 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 2.55 2.50 0.00 80 S 9.25 4.77 0.00 3.90 3.94 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 81 I 9.12 5.24 1.90 0.00 0.00 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 1.43 0.61 1.02 0.00 0.00 82 T 8.89 4.97 4.34 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 1.29 0.00 0.00 83 D 9.13 4.91 0.00 2.81 2.56 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 84 C 9.11 5.63 0.00 2.94 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 85 R 8.95 5.40 0.00 1.82 1.81 0.00 3.17 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 86 E 9.13 4.20 0.00 1.83 1.68 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 1.63 2.05 0.00 87 T 8.38 4.29 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 1.21 0.00 0.00 88 G 8.62 3.64 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 0.00 0.00 0.00 89 S 7.47 4.28 0.00 3.90 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 90 S 7.67 4.13 0.00 3.86 3.74 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 91 K 8.75 4.24 0.00 1.79 1.61 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 1.39 7.81 92 Y 8.74 4.31 0.00 3.09 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 93 P 0.00 3.48 0.00 1.80 1.21 0.00 3.64 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 94 N 8.06 4.76 0.00 2.82 2.74 0.00 0.00 7.01 7.65 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 95 C 7.89 4.63 0.00 3.12 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 4.98 1.14 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 0.00 0.00 97 Y 9.15 5.18 0.00 2.97 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 98 K 9.21 4.35 0.00 1.87 1.74 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.46 7.81 99 T 8.58 5.04 4.32 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 1.32 0.00 0.00 100 T 8.89 4.53 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 1.23 0.00 0.00 101 Q 8.73 4.75 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.74 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 102 A 8.91 4.64 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 0.00 103 N 8.64 5.44 0.00 2.56 2.74 0.00 0.00 6.69 7.61 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 0.00 104 K 9.02 4.73 0.00 1.68 1.72 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.61 7.81 105 H 9.19 4.90 0.00 3.19 3.25 0.00 5.58 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.71 4.77 1.92 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.24 1.15 0.00 0.00 107 I 8.18 4.92 1.76 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.68 0.80 0.00 0.00 108 V 8.60 4.79 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 0.79 0.00 0.00 0.83 0.00 0.00 109 A 8.68 4.98 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 0.00 110 C 8.75 5.13 0.00 2.01 1.70 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 0.00 111 E 8.66 4.70 0.00 1.80 1.77 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 2.26 2.23 0.00 112 G 9.51 4.10 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 0.00 0.00 0.00 113 N 8.18 5.03 0.00 2.66 2.71 0.00 0.00 6.93 7.69 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 0.00 114 P 0.00 4.34 0.00 2.22 2.04 0.00 3.81 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 115 Y 8.21 4.90 0.00 2.82 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 0.00 116 V 8.01 4.43 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 0.69 0.00 0.00 0.91 0.00 0.00 117 P 0.00 4.44 0.00 0.49 1.00 0.00 3.31 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 118 V 8.72 4.43 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 0.56 0.00 0.00 0.80 0.00 0.00 119 H 7.88 5.21 0.00 3.14 3.19 0.00 5.80 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.97 4.73 0.00 2.69 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 0.00 121 D 8.57 4.57 0.00 2.61 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 0.00 122 A 6.56 4.58 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 0.00 123 S 8.89 5.24 0.00 4.09 4.08 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 V 8.79 4.16 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 0.67 0.00 0.00 0.96 0.00 0.00