NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 V 3.9334 8.1545 117.9084 60.5813 33.7973 175.8530 *2 N 4.4347 8.3869 117.7273 51.3882 39.4451 172.3956 *3 P 4.2936 0.0000 0.0000 62.4973 33.7667 176.6371 *4 F 4.4936 8.3192 119.4177 57.1457 39.8942 175.5239 *5 I 4.0436 8.0192 121.2861 60.2325 37.2504 176.2101 *6 K 4.1936 8.3092 124.6196 55.0285 33.5184 176.1087 *7 E 4.2008 8.3376 115.0843 55.6478 31.6226 175.4736 *8 A 4.1825 8.2592 124.5374 52.5508 20.2174 177.6101 *9 K 4.1283 8.3092 121.6788 55.0285 33.7625 176.2108 *10 E 4.2236 8.4392 117.7690 56.2583 31.6226 176.4101 *11 K 4.1936 8.3092 123.0958 55.2573 33.7522 176.1705 *12 M 4.3536 8.2992 119.8088 54.8688 33.2722 176.1101 *13 K 4.1936 8.3092 123.0229 55.0512 33.8632 176.4765 *14 R 4.2136 8.2492 120.0884 56.9414 31.3026 176.0964 *15 T 4.2236 8.1692 112.9677 61.1898 70.4426 174.3508 *16 L 4.2136 8.1792 124.2999 54.7188 42.9168 177.1087 *17 E 4.2236 8.4392 117.5323 56.2583 31.6411 176.4101 *18 K 4.1936 8.3092 123.0958 55.0492 33.7522 176.3239 *19 I 4.0436 8.0192 119.5651 60.3363 37.3716 175.9087 *20 E 4.2236 8.4392 119.2327 56.4232 31.5327 175.9930 *21 D 4.5136 8.3592 120.5100 53.6665 41.8544 175.8087 *22 E 4.2236 8.4392 118.0205 56.2973 31.7046 176.2508 *23 L 4.2136 8.1792 121.7219 54.7415 42.9557 177.4765 *24 R 4.2136 8.2492 119.8517 56.5619 31.3211 176.1101 *25 K 4.1936 8.3092 122.1899 55.2573 33.6860 176.1705 *26 M 4.3536 8.2992 119.8088 54.9952 33.2722 176.1765 *27 R 4.2136 8.2492 119.9554 56.9414 31.5576 176.0964 *28 T 4.2513 8.1159 110.6618 60.5449 70.4426 173.9616 *29 G 3.7995 8.3492 113.2698 45.9329 0.0000 174.7101 *30 K 4.1019 8.3092 123.9413 54.5250 33.7069 174.4824 *31 P 4.2936 0.0000 0.0000 62.5832 32.6631 177.1435 *32 S 4.3436 8.3292 117.5092 58.0486 64.1826 172.5159 *33 P 4.2708 0.0000 0.0000 61.7911 32.4859 176.1736 *34 A 4.1825 8.2592 123.9921 52.6752 20.0656 177.5239 *35 I 3.9783 8.0192 118.0879 60.2715 37.5258 176.1529 *36 L 4.2136 8.1792 123.2457 54.7188 42.7219 177.1087 *37 E 4.2236 8.4392 117.5323 56.3620 31.6411 176.1087 *38 E 4.2236 8.4392 117.7088 56.3827 31.7665 176.3239 *39 I 4.0436 8.0192 119.5050 60.2325 37.5155 176.2101 *40 K 4.1936 8.3092 124.6196 55.0609 33.5184 176.6721 *41 V 3.9936 8.0492 118.9238 61.2984 33.5261 175.6930 *42 D 4.5136 8.3592 121.4975 53.8517 41.6327 175.5690 *43 Y 4.4236 8.1392 120.4197 57.4290 38.8525 175.1690 *44 Y 4.4513 8.0859 118.7861 56.5343 38.9577 175.1616 *45 G 3.7995 8.3492 111.6757 46.0690 0.0000 174.9720 *46 V 3.9019 8.0492 119.7093 60.7337 33.6247 174.1824 *47 P 4.2936 0.0000 0.0000 62.7811 32.5854 177.0964 *48 T 4.2236 8.1692 113.3282 60.7510 70.3570 172.6159 *49 P 4.2936 0.0000 0.0000 62.5377 32.7681 177.3721 *50 V 3.9936 8.0492 118.3184 61.2703 33.5182 175.7094 *51 N 4.6136 8.4192 119.7325 52.8117 39.4273 174.8786 *52 Q 4.2136 8.3392 119.4716 55.3936 30.1874 175.6508 *53 L 4.1908 8.0776 118.1615 54.0045 42.9307 176.4736 *54 A 4.1825 8.2592 124.3609 52.9303 20.0919 177.5964 *55 T 4.1583 8.1692 112.4566 61.2752 70.5191 174.5260 *56 I 4.0436 8.0192 122.0830 60.4141 37.4766 176.2435 *57 S 4.3436 8.3292 119.5784 58.5729 64.1006 174.3239 *58 I 4.0436 8.0192 120.9963 60.4141 37.1943 176.2435 *59 S 4.3436 8.3292 119.5784 58.5522 64.1006 174.1087 *60 E 4.2236 8.4392 119.2002 56.3620 31.4453 176.1087 *61 E 4.2236 8.4392 117.7088 56.3847 31.7665 176.4765 *62 R 4.2136 8.2492 120.0283 56.9414 31.4465 176.0964 *63 T 4.2236 8.1692 112.9677 61.1898 70.4426 174.3508 *64 L 4.2136 8.1792 124.2999 54.7511 42.9168 177.6721 *65 V 3.9936 8.0492 118.6872 61.2579 33.5446 176.0239 *66 I 4.0436 8.0192 120.4925 60.2325 37.2938 176.2101 *67 K 4.1936 8.3092 124.6196 54.5250 33.5184 174.5159 *68 P 4.2936 0.0000 0.0000 62.2706 32.6631 176.9994 *69 W 4.5336 8.2692 121.7396 56.7394 30.1778 175.4930 *70 D 4.5136 8.3592 120.1022 53.5628 41.2299 176.1101 *71 K 4.1936 8.3092 123.4075 55.1064 33.6903 176.4435 *72 S 4.3436 8.3292 118.1147 58.5846 64.1905 174.6721 *73 V 3.9936 8.0492 120.3550 61.1725 33.3488 175.9508 *74 L 4.2136 8.1792 122.7094 54.7966 42.7340 177.4435 *75 S 4.3436 8.3292 117.8780 58.4875 64.2089 174.2508 *76 L 4.2136 8.1792 123.2132 54.7394 42.6345 177.3239 *77 I 4.0436 8.0192 119.3284 60.3363 37.3901 175.9087 *78 E 4.2236 8.4392 119.2327 56.2583 31.5327 176.4101 *79 K 4.1708 8.2076 120.4111 54.3143 33.7522 175.4736 *80 A 4.1825 8.2592 124.5975 52.6752 20.0735 177.5239 *81 I 3.9783 8.0192 118.0879 60.3694 37.5258 175.9115 *82 N 4.5908 8.3176 117.5842 52.0347 39.4152 174.0736 *83 A 4.1825 8.2592 123.9349 52.7324 20.2462 177.6435 *84 S 4.2783 8.3292 116.6376 58.6134 64.3447 174.0951 *85 D 4.5136 8.3592 122.0013 53.6018 41.5332 175.9508 *86 L 4.2413 8.1259 119.7277 54.0091 42.8938 176.8616 *87 G 3.7995 8.3492 110.5152 45.9719 0.0000 174.5508 *88 L 4.1219 8.1792 122.5674 54.7518 42.9104 176.9758 *89 N 4.6136 8.4192 118.5685 52.2453 39.5235 173.1159 *90 P 4.2936 0.0000 0.0000 62.5260 32.8358 177.0239 *91 I 4.0436 8.0192 118.9596 60.3694 37.3637 175.8094 *92 N 4.6136 8.4192 120.2689 52.8101 39.4152 174.5930 *93 D 4.5413 8.3059 117.6016 52.9569 41.8832 175.5616 *94 G 3.7995 8.3492 111.0034 46.0697 0.0000 174.3094 *95 N 4.5219 8.4192 119.5906 52.7813 39.6037 175.2385 *96 V 3.9936 8.0492 118.2612 61.2579 33.6988 176.0239 *97 I 4.0436 8.0192 120.4925 60.3590 37.2938 176.2765 *98 R 4.2136 8.2492 121.5521 56.6009 31.2127 175.9508 *99 L 4.2136 8.1792 120.8159 54.7511 42.8896 177.6721 *100 V 3.9936 8.0492 118.6872 61.2292 33.5446 175.9724 *101 F 4.4936 8.3192 120.9506 56.6214 39.8243 173.7159 *102 P 4.2936 0.0000 0.0000 62.5832 32.5420 177.1435 *103 S 4.3436 8.3292 117.5092 58.0486 64.1826 172.5159 *104 P 4.2936 0.0000 0.0000 62.7811 32.4859 177.0964 *105 T 4.2236 8.1692 113.3282 61.5303 70.3570 174.4964 *106 T 4.2236 8.1692 116.4517 61.2545 70.4698 174.2087 *107 E 4.2236 8.4392 120.2869 56.4248 31.7276 176.2786 *108 Q 4.2136 8.3392 120.0741 55.4810 30.1587 175.8765 *109 R 4.2136 8.2492 119.1526 56.6656 31.4216 175.8087 *110 E 4.2236 8.4392 116.8029 56.2583 31.7004 176.4101 *111 K 4.1936 8.3092 123.0958 54.7938 33.7522 176.2994 *112 W 4.5336 8.2692 122.3451 56.7105 30.1857 176.1721 *113 V 3.9936 8.0492 118.4559 61.1335 33.0455 176.1101 *114 K 4.1936 8.3092 124.0833 54.9248 33.5305 176.4101 *115 K 4.1708 8.2076 120.4712 54.3143 33.6082 175.4736 *116 A 4.1825 8.2592 124.5975 52.5508 20.0735 177.6101 *117 K 4.1283 8.3092 121.6788 55.0285 33.7625 176.2108 *118 E 4.2236 8.4392 117.7690 56.3827 31.6226 176.3239 *119 I 4.0436 8.0192 119.5050 60.3686 37.5155 176.4720 *120 V 3.9936 8.0492 120.3876 61.2372 33.4362 175.8087 *121 E 4.2236 8.4392 118.6964 56.3620 31.5448 176.1087 *122 E 4.2513 8.3859 115.4030 55.6523 31.7665 175.8616 *123 G 3.7995 8.3492 110.6917 45.9329 0.0000 174.7101 *124 K 4.1019 8.3092 123.9413 55.0492 33.7069 176.2904 *125 I 4.0208 7.9176 116.8804 59.6220 37.3716 175.2736 *126 A 4.1825 8.2592 126.0613 52.6752 19.9836 177.5239 *127 I 3.9783 8.0192 118.0879 60.3590 37.5258 176.3786 *128 R 4.2136 8.2492 121.5521 56.6987 31.2127 175.7094 *129 N 4.6136 8.4192 117.8391 52.7696 39.5828 174.9239 *130 I 4.0436 8.0192 118.9024 60.3590 37.5443 176.2765 *131 R 4.2136 8.2492 121.5521 56.6883 31.2127 176.1765 *132 R 4.2136 8.2492 119.1224 56.6656 31.3804 175.8087 *133 E 4.2236 8.4392 116.8029 56.3827 31.7004 176.3239 *134 I 4.0436 8.0192 119.5050 60.2715 37.5155 176.0508 *135 L 4.2136 8.1792 123.2457 54.6150 42.7219 177.4101 *136 K 4.1936 8.3092 122.9193 54.9248 33.6267 176.4101 *137 K 4.1936 8.3092 123.1559 55.0492 33.6082 176.3239 *138 I 4.0436 8.0192 119.5651 60.2325 37.3716 176.2101 *139 K 4.1936 8.3092 124.6196 55.0285 33.5184 176.1087 *140 E 4.2236 8.4392 117.7690 56.4232 31.6226 175.9930 *141 D 4.5136 8.3592 120.5100 53.7294 41.8544 175.9786 *142 Q 4.2136 8.3392 120.3858 55.3546 30.0968 175.8101 *143 K 4.1936 8.3092 122.2201 55.0285 33.7272 176.1087 *144 E 4.2513 8.3859 115.4631 55.6523 31.6226 175.8616 *145 G 3.7995 8.3492 110.6917 45.9719 0.0000 174.5508 *146 L 4.1219 8.1792 122.5674 54.7394 42.9104 177.2904 *147 I 4.0436 8.0192 119.3284 59.8327 37.3901 174.3159 *148 P 4.2936 0.0000 0.0000 62.5053 32.5733 176.8087 *149 E 4.2236 8.4392 117.1635 56.4232 31.6147 175.9930 *150 D 4.5136 8.3592 120.5100 53.7277 41.8544 175.6930 *151 D 4.4908 8.2576 118.1370 52.9523 41.7925 175.1736 *152 A 4.1825 8.2592 124.8491 52.5508 20.1555 177.6101 *153 K 4.1283 8.3092 121.6788 55.0512 33.7625 176.5786 *154 R 4.2136 8.2492 120.0884 56.6009 31.3026 175.9508 *155 L 4.2136 8.1792 120.8159 54.7188 42.8896 177.1087 *156 E 4.2236 8.4392 117.5323 56.3951 31.6411 176.0094 *157 N 4.6136 8.4192 118.7450 52.7489 39.6490 174.7087 *158 E 4.2236 8.4392 117.1063 56.3827 31.7953 176.3239 *159 I 4.0436 8.0192 119.5050 60.3991 37.5155 176.0786 *160 Q 4.2136 8.3392 121.5980 55.3546 29.9249 175.8101 *161 K 4.1936 8.3092 122.2201 54.9638 33.7272 176.2508 *162 L 4.2136 8.1792 121.7820 54.9946 42.8118 177.3964 *163 T 4.2236 8.1692 113.6971 61.3157 70.3833 174.0930 *164 D 4.5136 8.3592 123.0880 53.6665 41.8155 175.8087 *165 E 4.2236 8.4392 118.0205 56.3540 31.7046 176.2724 *166 F 4.4936 8.3192 119.9631 57.1457 40.0460 175.5239 *167 I 4.0436 8.0192 121.2861 60.3363 37.2504 175.9087 *168 E 4.2236 8.4392 119.2327 56.2583 31.5327 176.4101 *169 K 4.1936 8.3092 123.0958 54.9638 33.7522 176.2508 *170 L 4.2136 8.1792 121.7820 54.7799 42.8118 176.9930 *171 D 4.5136 8.3592 120.3334 53.6665 41.7289 175.8087 *172 E 4.2236 8.4392 118.0205 56.3944 31.7046 176.6721 *173 V 3.9936 8.0492 118.8637 61.2292 33.6700 175.9724 *174 F 4.4936 8.3192 120.9506 57.1250 39.8243 175.3087 *175 E 4.2236 8.4392 119.4900 56.3827 31.5014 176.3239 *176 I 4.0436 8.0192 119.5050 60.2325 37.5155 176.2101 *177 K 4.1936 8.3092 124.6196 54.9248 33.5184 176.4101 *178 K 4.1936 8.3092 123.1559 55.0285 33.6082 176.1087 *179 E 4.2236 8.4392 117.7690 56.3620 31.6226 176.1087 *180 E 4.2236 8.4392 117.7088 56.3827 31.7665 176.3239 *181 I 4.0436 8.0192 119.5050 60.5650 37.5155 175.9705 *182 M 4.3536 8.2992 121.2725 54.9725 33.1824 175.8087 *183 E 4.2236 8.4392 117.6359 56.3540 31.8776 176.2724 *184 F 4.4936 8.3192 119.9631 56.9887 38.7647 174.6053 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 V 8.15 3.93 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 0.90 0.00 0.00 0.93 0.00 0.00 *2 N 8.39 4.43 0.00 2.56 2.66 0.00 0.00 6.76 6.86 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 *3 P 0.00 4.29 0.00 1.83 1.89 0.00 3.62 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 1.84 2.08 0.00 *4 F 8.32 4.49 0.00 2.04 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 0.00 0.00 0.00 *5 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *6 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *7 E 8.34 4.20 0.00 1.73 1.79 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 2.13 2.38 0.00 *8 A 8.26 4.18 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 *9 K 8.31 4.13 0.00 1.54 1.64 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *10 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *11 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *12 M 8.30 4.35 0.00 1.78 1.91 0.00 0.00 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 *13 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *14 R 8.25 4.21 0.00 1.57 1.77 0.00 3.20 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 *15 T 8.17 4.22 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 1.21 0.00 0.00 *16 L 8.18 4.21 0.00 1.40 1.51 0.92 0.84 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 *17 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *18 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *19 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *20 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *21 D 8.36 4.51 0.00 2.44 2.51 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 *22 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *23 L 8.18 4.21 0.00 1.40 1.51 0.92 0.84 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 *24 R 8.25 4.21 0.00 1.57 1.77 0.00 3.20 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 *25 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *26 M 8.30 4.35 0.00 1.78 1.91 0.00 0.00 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 *27 R 8.25 4.21 0.00 1.57 1.77 0.00 3.20 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 *28 T 8.12 4.25 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 1.21 0.00 0.00 *29 G 8.35 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 *30 K 8.31 4.10 0.00 1.54 1.64 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *31 P 0.00 4.29 0.00 1.83 1.89 0.00 3.62 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 1.84 2.08 0.00 *32 S 8.33 4.34 0.00 3.59 3.71 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 *33 P 0.00 4.27 0.00 1.83 1.89 0.00 3.62 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 1.84 2.09 0.00 *34 A 8.26 4.18 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 *35 I 8.02 3.98 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.60 0.91 0.00 0.00 *36 L 8.18 4.21 0.00 1.40 1.51 0.92 0.84 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 *37 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *38 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *39 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *40 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 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1.26 1.50 7.81 *115 K 8.21 4.17 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.51 7.81 *116 A 8.26 4.18 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 *117 K 8.31 4.13 0.00 1.54 1.64 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *118 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *119 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *120 V 8.05 3.99 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 0.82 0.00 0.00 0.93 0.00 0.00 *121 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *122 E 8.39 4.25 0.00 1.73 1.79 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 2.13 2.38 0.00 *123 G 8.35 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 *124 K 8.31 4.10 0.00 1.54 1.64 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *125 I 7.92 4.02 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.97 0.91 0.00 0.00 *126 A 8.26 4.18 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 *127 I 8.02 3.98 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.60 0.91 0.00 0.00 *128 R 8.25 4.21 0.00 1.57 1.77 0.00 3.20 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 *129 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.72 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 *130 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *131 R 8.25 4.21 0.00 1.57 1.77 0.00 3.20 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 *132 R 8.25 4.21 0.00 1.57 1.77 0.00 3.20 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 *133 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *134 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *135 L 8.18 4.21 0.00 1.40 1.51 0.92 0.77 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 *136 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *137 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *138 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *139 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *140 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *141 D 8.36 4.51 0.00 2.44 2.51 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 *142 Q 8.34 4.21 0.00 1.81 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.62 0.00 0.00 0.00 0.00 0.00 2.18 2.42 0.00 *143 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *144 E 8.39 4.25 0.00 1.73 1.79 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 2.13 2.38 0.00 *145 G 8.35 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 *146 L 8.18 4.12 0.00 1.42 1.50 0.92 0.86 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 *147 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *148 P 0.00 4.29 0.00 1.83 1.89 0.00 3.62 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 1.84 2.08 0.00 *149 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *150 D 8.36 4.51 0.00 2.44 2.51 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 *151 D 8.26 4.49 0.00 2.44 2.51 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 *152 A 8.26 4.18 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 *153 K 8.31 4.13 0.00 1.54 1.64 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *154 R 8.25 4.21 0.00 1.57 1.77 0.00 3.20 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 *155 L 8.18 4.21 0.00 1.40 1.51 0.92 0.84 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 *156 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *157 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 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 *158 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *159 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *160 Q 8.34 4.21 0.00 1.81 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.62 0.00 0.00 0.00 0.00 0.00 2.18 2.42 0.00 *161 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *162 L 8.18 4.21 0.00 1.40 1.51 0.92 0.86 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 *163 T 8.17 4.22 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 1.21 0.00 0.00 *164 D 8.36 4.51 0.00 2.44 2.51 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 *165 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *166 F 8.32 4.49 0.00 2.04 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 0.00 0.00 0.00 *167 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *168 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *169 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *170 L 8.18 4.21 0.00 1.40 1.51 0.92 0.98 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 *171 D 8.36 4.51 0.00 2.44 2.51 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 *172 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *173 V 8.05 3.99 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 0.82 0.00 0.00 0.93 0.00 0.00 *174 F 8.32 4.49 0.00 2.04 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 0.00 0.00 0.00 *175 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *176 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *177 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *178 K 8.31 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 *179 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *180 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *181 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *182 M 8.30 4.35 0.00 1.78 1.91 0.00 0.00 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 *183 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 *184 F 8.32 4.49 0.00 2.04 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.