NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 M 4.2934 8.4045 118.7933 54.0488 33.5435 175.8530 *2 W 4.3547 8.2369 120.2069 56.1121 30.2921 174.0277 *3 H 4.6036 8.6058 117.6671 55.1713 30.3226 173.0337 *4 Y 4.4236 8.1392 120.7052 57.5197 38.6823 175.6964 *5 T 4.2236 8.1692 114.8575 61.3324 70.5521 174.5435 *6 S 4.3436 8.3292 120.6326 58.5729 64.2955 174.3239 *7 I 4.0436 8.0192 120.9963 60.3694 37.1943 175.8094 *8 N 4.6136 8.4192 120.2689 52.7820 39.4152 174.6094 *9 N 4.6136 8.4192 118.1425 52.8101 39.6777 174.5930 *10 D 4.5136 8.3592 119.9075 53.9424 41.8832 176.0964 *11 T 4.2236 8.1692 114.1853 61.2772 70.4469 174.5765 *12 R 4.2136 8.2492 122.6063 56.6979 31.4076 176.3721 *13 V 3.9708 7.9476 115.2731 60.5230 33.6039 175.1736 *14 A 4.1825 8.2592 125.5250 52.5898 19.9957 177.4508 *15 L 4.1483 8.1792 120.3049 54.7799 42.9660 177.0951 *16 D 4.5136 8.3592 120.3334 53.1630 41.7289 174.2159 *17 P 4.2936 0.0000 0.0000 62.4016 32.7452 177.1101 *18 K 4.1936 8.3092 122.5504 54.5250 33.6004 174.5159 *19 P 4.2936 0.0000 0.0000 62.5384 32.6631 176.7094 *20 N 4.6136 8.4192 118.1997 52.8117 39.4972 174.8786 *21 Q 4.2136 8.3392 119.4716 55.4790 30.1874 175.7239 *22 I 4.0436 8.0192 118.6293 60.3590 37.4905 176.2765 *23 R 4.2136 8.2492 121.5521 56.9414 31.2127 176.0964 *24 T 4.2236 8.1692 112.9677 61.2752 70.4426 174.4239 *25 I 4.0436 8.0192 122.0830 60.6121 37.4766 176.1964 *26 T 4.2236 8.1692 115.3974 61.3324 70.2750 174.5435 *48 S 4.3436 8.3292 120.6326 58.8432 64.2955 173.9800 *49 H 4.6036 8.4392 119.8207 55.2620 29.6950 173.8964 *50 T 4.2236 8.1692 114.4708 61.1898 70.2767 174.3508 *51 L 4.2136 8.1792 124.2999 54.7415 42.9168 177.4765 *52 R 4.2136 8.2492 119.8517 56.6009 31.3211 175.9508 *53 L 4.2136 8.1792 120.8159 54.6540 42.8896 177.2508 *54 L 4.2413 8.1259 119.2395 54.0091 42.8302 176.8616 *55 G 3.7995 8.3492 110.5152 45.5330 0.0000 172.8159 *56 P 4.2019 0.0000 0.0000 62.4973 32.7618 176.9388 *57 F 4.4936 8.3192 119.4177 57.1878 39.8942 175.4786 *58 Q 4.2136 8.3392 121.8553 55.6434 29.8936 175.2690 *59 Y 4.4236 8.1392 119.2323 57.2359 38.8894 175.5724 *60 F 4.4936 8.3192 120.9470 57.1581 40.0894 175.2094 *61 N 4.6136 8.4192 120.5262 52.7409 39.3839 174.8724 *62 F 4.4936 8.3192 119.3605 57.2029 40.0748 175.6435 *63 S 4.3436 8.3292 119.8357 58.5522 64.0693 174.1087 *64 E 4.2236 8.4392 119.2002 56.6378 31.4453 176.3964 *65 T 4.2236 8.1692 113.8736 61.3157 70.5088 174.0930 *66 D 4.5136 8.3592 123.0880 53.6893 41.8155 176.1765 *67 R 4.2413 8.1959 118.0341 55.9559 31.3846 175.5616 *68 G 3.7995 8.3492 109.7858 46.3276 0.0000 174.2800 *69 H 4.5119 8.4392 119.1749 54.4826 29.9709 171.9824 *70 P 4.2936 0.0000 0.0000 62.4406 32.5750 176.9508 *71 L 4.2136 8.1792 121.1765 54.7107 42.8039 177.2724 *72 F 4.4936 8.3192 119.7865 57.1477 39.9206 175.6765 *73 R 4.2136 8.2492 121.8094 56.6009 31.1814 175.9508 *74 L 4.2136 8.1792 120.8159 54.2152 42.8896 175.5159 *75 P 4.2936 0.0000 0.0000 62.4406 32.6816 176.9508 *76 L 4.2136 8.1792 121.1765 54.6150 42.8039 177.4101 *77 K 4.1936 8.3092 122.9193 55.2136 33.6267 175.8690 *78 Y 4.4236 8.1392 120.1681 56.7403 38.7705 173.8159 *79 P 4.2936 0.0000 0.0000 62.5832 32.8504 177.1435 *80 S 4.3436 8.3292 117.5092 58.4485 64.1826 174.4101 *81 K 4.1708 8.2076 121.9024 54.3143 33.4310 175.4736 *82 A 4.1825 8.2592 124.5975 52.6752 20.0735 177.5239 *83 I 3.9783 8.0192 118.0879 59.8327 37.5258 174.4180 *84 P 4.2708 0.0000 0.0000 61.7911 32.5733 176.1736 *85 A 4.1825 8.2592 123.9921 52.7157 20.0656 177.1930 *86 D 4.4483 8.3592 119.0930 53.6665 41.8647 175.9108 *87 E 4.2236 8.4392 118.0205 56.2973 31.7046 176.2508 *88 L 4.2136 8.1792 121.7219 54.7394 42.9557 177.3239 *89 I 4.0436 8.0192 119.3284 60.3974 37.3901 175.7930 *90 D 4.5136 8.3592 122.0338 53.6996 41.6206 175.7094 *91 N 4.6136 8.4192 119.0567 52.6842 39.5871 174.8508 *92 L 4.2136 8.1792 121.1194 55.0098 42.9845 176.9800 *93 H 4.6036 8.4392 118.1529 55.0640 29.8907 173.9435 *94 S 4.3436 8.3292 118.6517 58.3175 64.1023 174.2994 *95 W 4.5336 8.2692 123.7763 56.9069 30.0084 175.6705 *96 M 4.3536 8.2992 119.3409 54.9952 32.7916 176.1765 *97 R 4.2136 8.2492 119.9554 56.7434 31.5576 176.1435 *98 S 4.3436 8.3292 117.1486 58.5846 64.2683 174.6721 *99 V 3.9936 8.0492 120.3550 61.5282 33.3488 175.6800 *100 H 4.6036 8.4392 119.3169 54.9214 29.7945 173.7508 *101 L 4.2136 8.1792 122.3190 54.6540 42.7236 177.2508 *102 L 4.2136 8.1792 121.5453 55.0098 42.8302 176.9800 *103 H 4.6036 8.4392 118.1529 55.0185 29.8907 174.1721 *104 V 3.9936 8.0492 119.4609 61.2599 33.4379 176.1765 *105 R 4.2136 8.2492 121.0158 56.7434 31.2248 176.1435 *106 S 4.3436 8.3292 117.1486 58.5522 64.2683 174.1087 *107 E 4.2236 8.4392 119.2002 56.4232 31.4453 175.9930 *108 D 4.5136 8.3592 120.5100 53.6996 41.8544 175.7094 *109 N 4.6136 8.4192 119.0567 53.0247 39.5871 174.9964 *110 T 4.2236 8.1692 113.2711 61.1898 70.5375 174.3508 *111 L 4.2136 8.1792 124.2999 54.7415 42.9168 177.4765 *112 R 4.2136 8.2492 119.8517 56.8507 31.3211 175.5690 *113 Y 4.4236 8.1392 119.2021 57.2770 38.8482 175.3094 *114 N 4.6136 8.4192 119.7289 52.5142 39.6923 174.8994 *115 W 4.5336 8.2692 121.6825 56.9069 30.3584 175.6705 *116 M 4.3536 8.2992 119.3409 54.9078 32.7916 175.9508 *117 L 4.2413 8.1259 119.3431 54.0091 43.0668 176.8616 *118 G 3.7995 8.3492 110.5152 46.0690 0.0000 174.9720 *119 V 3.9019 8.0492 119.7093 61.4223 33.6247 175.5354 *120 Y 4.4008 8.0376 118.4108 56.5297 38.6927 174.7736 *121 A 4.1825 8.2592 125.5214 52.6772 20.2608 177.6765 *122 R 4.1483 8.2492 118.6113 56.7434 31.4568 176.2456 *123 S 4.3436 8.3292 117.1486 58.8280 64.2683 174.3964 *124 T 4.2236 8.1692 115.3649 61.2876 70.1876 174.1094 *125 N 4.6136 8.4192 121.3231 52.9340 39.6100 174.4690 *126 Y 4.4236 8.1392 119.5055 57.5197 38.9431 175.6964 *127 T 4.2236 8.1692 114.8575 61.5303 70.5521 174.4964 *128 T 4.2236 8.1692 116.4517 60.7510 70.4698 172.6159 *129 P 4.2936 0.0000 0.0000 62.5377 32.7681 177.3721 *130 V 4.0213 7.9959 116.0125 60.5276 33.5182 175.5616 *131 G 3.7995 8.3492 111.6793 46.0994 0.0000 174.5786 *132 Q 4.1219 8.3392 120.9197 55.3936 30.1134 175.6173 *133 L 4.2136 8.1792 120.8462 54.7511 42.9307 177.6721 *134 V 3.9936 8.0492 118.6872 61.2696 33.5446 176.3721 *135 V 3.9936 8.0492 119.8512 61.2703 33.4484 175.7094 *136 N 4.5908 8.3176 117.0478 52.0347 39.4273 174.0736 *137 A 4.1825 8.2592 123.9349 52.1509 20.2462 175.7159 *138 P 4.2054 0.0000 0.0000 61.7911 32.8174 176.2757 *139 A 4.1825 8.2592 123.9921 52.6752 20.0656 177.5239 *140 I 3.9783 8.0192 118.0879 60.2715 37.5258 176.1529 *141 L 4.2136 8.1792 123.2457 54.7518 42.7219 177.0094 *142 N 4.6136 8.4192 118.5685 52.9340 39.5235 174.4690 *143 Y 4.4236 8.1392 119.5055 57.3218 38.9431 175.7435 *144 S 4.3436 8.3292 119.0385 58.5853 64.3778 174.0094 *145 N 4.6136 8.4192 120.2363 52.2453 39.3278 173.1159 *146 P 4.2936 0.0000 0.0000 62.5681 32.8358 176.9786 *147 Q 4.2136 8.3392 119.5288 55.5195 30.0069 175.3930 *148 D 4.4908 8.2576 116.9496 52.9523 41.8294 175.1736 *149 A 4.1825 8.2592 124.8491 52.6465 20.1555 177.4724 *150 F 4.4283 8.3192 118.5460 57.1581 40.0563 175.3115 *151 N 4.6136 8.4192 120.5262 52.8268 39.3839 175.0435 *152 S 4.3436 8.3292 117.4521 58.5846 64.3632 174.6721 *153 V 3.9936 8.0492 120.3550 61.2292 33.3488 175.9724 *154 F 4.4936 8.3192 120.9506 57.1574 39.8243 175.8721 *155 V 3.9708 7.9476 117.9602 60.5230 33.4049 175.1736 *156 A 4.1825 8.2592 125.5250 52.5898 19.9957 177.4508 *157 L 4.1760 8.1259 117.9990 54.0091 42.9660 176.9637 *158 G 3.7995 8.3492 110.5152 46.0573 0.0000 174.6239 *159 I 3.9519 8.0192 120.3505 60.3974 37.4702 175.7595 *160 D 4.5136 8.3592 122.0338 53.8517 41.6206 175.5690 *161 Y 4.4236 8.1392 120.4197 57.2646 38.8525 175.6239 *162 I 4.0436 8.0192 120.4889 60.3974 37.5589 175.7930 *163 D 4.5136 8.3592 122.0338 53.6872 41.6206 176.0239 *164 I 4.0436 8.0192 119.8166 59.8327 37.4536 174.3159 *165 P 4.2936 0.0000 0.0000 62.5260 32.5733 177.0239 *166 I 4.0436 8.0192 118.9596 60.6121 37.3637 176.1964 *167 T 4.2236 8.1692 115.3974 61.2876 70.2750 174.1094 *168 N 4.6136 8.4192 121.3231 52.8268 39.6100 175.0435 *169 S 4.3436 8.3292 117.4521 58.5853 64.3632 174.0094 *170 N 4.6136 8.4192 120.2363 52.7696 39.3278 174.9239 *171 I 4.0436 8.0192 118.9024 60.3283 37.5443 176.0724 *172 F 4.4936 8.3192 121.4869 57.1862 39.8122 175.1930 *173 D 4.5136 8.3592 122.2911 53.7277 41.5893 175.6930 *174 D 4.5136 8.3592 120.8217 53.7444 41.7925 176.1435 *175 S 4.3436 8.3292 118.3663 58.6301 64.2725 174.4435 *176 S 4.3436 8.3292 119.5459 58.8280 64.0132 174.3964 *177 T 4.2236 8.1692 115.3649 60.7510 70.1876 172.6159 *178 P 4.2936 0.0000 0.0000 62.6904 32.7681 176.5690 *179 Y 4.4236 8.1392 119.5626 57.2770 38.7626 175.3094 *180 N 4.6136 8.4192 119.7289 52.7813 39.6923 175.2720 *181 V 3.9936 8.0492 118.2612 61.2599 33.6988 176.1765 *182 R 4.2136 8.2492 121.0158 56.6862 31.2248 176.0239 *183 I 4.0436 8.0192 118.5990 60.1016 37.4494 176.0994 *184 W 4.5336 8.2692 123.8088 56.9692 30.0958 175.4800 *185 H 4.5808 8.3376 115.2369 54.2719 29.3917 172.9736 *186 A 4.1825 8.2592 125.1346 52.1509 19.9853 175.7159 *187 P 4.2283 0.0000 0.0000 62.7811 32.8174 177.1985 *188 T 4.2236 8.1692 113.3282 61.4833 70.3570 174.2705 *189 M 4.3536 8.2992 122.3267 55.2483 33.3772 176.0964 *190 T 4.2236 8.1692 113.8007 61.2545 70.6198 174.2087 *191 E 4.2236 8.4392 120.2869 56.3944 31.7276 176.6721 *192 V 3.9936 8.0492 118.8637 61.2703 33.6700 175.7094 *193 N 4.6136 8.4192 119.7325 53.0399 39.4273 174.5800 *194 H 4.6036 8.4392 117.7269 55.0068 30.0449 173.8239 *195 I 4.0436 8.0192 120.1021 60.2715 37.2834 176.0508 *196 L 4.1908 8.0776 120.5610 54.0045 42.7219 176.4736 *197 A 4.1825 8.2592 124.3609 52.5898 20.0919 177.4508 *198 L 4.1483 8.1792 120.3049 54.9475 42.9660 177.2726 *199 M 4.3536 8.2992 119.5721 54.9952 33.2907 176.1765 *200 R 4.2136 8.2492 119.9554 56.5619 31.5576 176.1101 *201 K 4.1936 8.3092 122.1899 55.1064 33.6860 176.4435 *202 S 4.3436 8.3292 118.1147 58.8280 64.1905 174.3964 *203 T 4.2236 8.1692 115.3649 61.1898 70.1876 174.3508 *204 L 4.2136 8.1792 124.2999 54.7511 42.9168 177.6721 *205 V 3.9936 8.0492 118.6872 61.3151 33.5446 176.1435 *206 S 4.3436 8.3292 119.0421 58.8280 64.1127 174.3964 *207 T 4.2236 8.1692 115.3649 61.5455 70.1876 174.0800 *208 H 4.6036 8.4392 120.9074 55.0640 29.9773 173.9435 *209 S 4.3436 8.3292 118.6517 58.6301 64.1023 174.4435 *210 S 4.3436 8.3292 119.5459 58.3175 64.0132 174.2994 *211 W 4.5336 8.2692 123.7763 56.9692 30.0084 175.4800 *212 H 4.6036 8.4392 117.9216 54.7515 29.3917 173.7994 *213 W 4.5336 8.2692 122.8822 56.7394 30.0975 175.4930 *214 D 4.5136 8.3592 120.1022 53.6989 41.2299 176.3721 *215 V 3.9936 8.0492 119.1754 61.1725 33.6081 175.9508 *216 L 4.2136 8.1792 122.7094 55.0098 42.7340 176.9800 *217 H 4.6036 8.4392 118.1529 55.2620 29.8907 173.8964 *218 T 4.2236 8.1692 114.4708 61.2465 70.2767 174.3724 *219 F 4.4936 8.3192 122.5411 57.4160 40.0071 175.1800 *220 H 4.6036 8.4392 120.1105 55.1713 29.7511 173.3690 *221 Y 4.4236 8.1392 120.7052 57.2666 38.6823 175.7765 *222 R 4.2136 8.2492 121.0122 56.7434 31.4899 176.1435 *223 S 4.3436 8.3292 117.1486 58.5522 64.2683 174.1087 *224 E 4.2236 8.4392 119.2002 56.4398 31.4453 176.4435 *225 S 4.3436 8.3292 118.0546 58.6134 64.3344 173.9930 *226 D 4.5136 8.3592 122.0013 53.8953 41.5332 175.8705 *227 M 4.3536 8.2992 120.0603 54.9932 33.3543 176.0239 *228 I 4.0436 8.0192 119.4321 60.3974 37.6266 175.7930 *229 D 4.5136 8.3592 122.0338 53.9576 41.6206 175.6800 *230 H 4.6036 8.4392 118.6411 54.9781 29.9543 173.7724 *231 F 4.4708 8.2176 117.8755 56.4108 39.8139 174.6736 *232 A 4.1597 8.1576 123.6339 51.9403 19.9523 176.6736 *233 A 4.1172 8.2592 123.1204 52.5508 20.2277 177.7122 *234 K 4.1283 8.3092 121.6788 55.0492 33.7625 176.4260 *235 I 4.0436 8.0192 119.5651 60.2715 37.3716 176.0508 *236 L 4.2136 8.1792 123.2457 54.7188 42.7219 177.1087 *237 E 4.2236 8.4392 117.5323 56.4232 31.6411 175.9930 *238 D 4.5136 8.3592 120.5100 53.4318 41.8544 175.9994 *239 W 4.5336 8.2692 122.5967 56.7009 30.2677 175.9765 *240 R 4.2136 8.2492 119.6205 56.7284 30.8220 175.9786 *241 Q 4.2136 8.3392 119.1682 55.3546 30.0926 175.8101 *242 K 4.1936 8.3092 122.2201 55.0285 33.7272 176.1087 *243 E 4.2236 8.4392 117.7690 56.2583 31.6226 176.4101 *244 K 4.1936 8.3092 123.0958 54.9638 33.7522 176.2508 *245 L 4.2136 8.1792 121.7820 54.7799 42.8118 176.9930 *246 D 4.5136 8.3592 120.3334 53.5628 41.7289 176.1101 *247 K 4.2213 8.2559 121.1016 54.3189 33.6903 175.8616 *248 G 3.7766 8.2476 108.0672 45.3224 0.0000 173.7736 *249 A 4.0908 8.2592 125.3830 52.5898 20.1721 177.4173 *250 L 4.1483 8.1792 120.3049 54.7511 42.9660 177.7742 *251 V 3.9936 8.0492 118.6872 61.2372 33.5446 175.8087 *252 E 4.2008 8.3376 116.0117 55.6478 31.5448 175.4736 *253 A 4.1825 8.2592 124.5374 52.7157 20.2174 177.1930 *254 D 4.4483 8.3592 119.0930 53.6893 41.8647 176.2786 *255 R 4.2136 8.2492 120.3400 56.6979 31.3846 176.3721 *256 V 3.9936 8.0492 117.9578 61.2696 33.6039 176.3721 *257 V 3.9936 8.0492 119.8512 61.3000 33.4484 175.9786 *258 Q 4.2136 8.3392 121.0617 55.4810 29.9370 175.8765 *259 R 4.2136 8.2492 119.1526 56.6009 31.4216 175.9508 *260 L 4.2136 8.1792 120.8159 54.7394 42.8896 177.3239 *261 I 4.0436 8.0192 119.3284 59.8327 37.3901 174.3159 *262 P 4.2936 0.0000 0.0000 62.4406 32.5733 176.9508 *263 L 4.2136 8.1792 121.1765 54.7966 42.8039 177.4435 *264 S 4.3436 8.3292 117.8780 58.6301 64.2089 174.4435 *265 S 4.3436 8.3292 119.5459 58.6301 64.0132 174.4435 *266 S 4.3436 8.3292 119.5459 58.8280 64.0132 174.3964 *267 T 4.2236 8.1692 115.3649 61.4396 70.1876 173.9690 *268 Y 4.4236 8.1392 122.6861 57.2763 38.8754 175.9720 *269 V 3.9936 8.0492 119.8476 61.3000 33.7134 175.9786 *270 Q 4.2136 8.3392 121.0617 55.4810 29.9370 175.8765 *271 R 4.2136 8.2492 119.1526 56.6009 31.4216 175.9508 *272 L 4.1908 8.0776 118.1313 54.0045 42.8896 176.4736 *273 A 4.1597 8.1576 121.6762 51.9403 20.0919 176.6736 *274 A 4.1172 8.2592 123.1204 52.6752 20.2277 177.6260 *275 I 3.9783 8.0192 118.0879 60.4141 37.5258 176.3456 *291 S 4.3436 8.3292 119.5784 58.5749 64.1006 174.4765 *292 R 4.2136 8.2492 121.5196 56.6009 31.1253 175.9508 *293 L 4.2136 8.1792 120.8159 54.7966 42.8896 177.4435 *294 S 4.3436 8.3292 117.8780 58.8280 64.2089 174.3964 *295 T 4.2008 8.0676 112.6802 60.5403 70.1876 173.5736 *296 A 4.1825 8.2592 127.1155 52.5898 20.1785 177.4508 *297 L 4.1483 8.1792 120.3049 54.6540 42.9660 177.3529 *298 L 4.2136 8.1792 121.5453 54.7816 42.8302 177.2786 *299 Q 4.2136 8.3392 119.8976 55.3936 30.0332 175.6508 *300 L 4.2136 8.1792 120.8462 54.7966 42.9307 177.4435 *301 S 4.3436 8.3292 117.8780 58.6134 64.2089 173.9930 *302 D 4.5136 8.3592 122.0013 53.9424 41.5332 176.0964 *303 T 4.2236 8.1692 114.1853 61.4396 70.4469 173.9690 *304 Y 4.4236 8.1392 122.6861 57.4290 38.8754 175.1690 *305 Y 4.4236 8.1392 121.0919 57.3067 38.9577 175.5786 *306 Q 4.2136 8.3392 121.0581 55.7493 30.2021 175.3800 *307 H 4.5808 8.3376 114.7690 54.2719 29.9912 172.9736 *308 A 4.1825 8.2592 125.1346 52.6876 19.9853 177.2094 *309 N 4.5483 8.4192 117.3280 52.8101 39.6593 174.6951 *310 D 4.5136 8.3592 119.9075 53.7294 41.8832 175.9786 *311 Q 4.2136 8.3392 120.3858 55.3936 30.0968 175.6508 *312 L 4.2136 8.1792 120.8462 54.7415 42.9307 177.4765 *313 R 4.2136 8.2492 119.8517 56.6883 31.3211 176.1765 *314 R 4.2136 8.2492 119.1224 56.6009 31.3804 175.9508 *315 L 4.2136 8.1792 120.8159 54.9039 42.8896 176.8690 *316 Y 4.4236 8.1392 119.9315 57.2666 38.7889 175.7765 *317 R 4.2136 8.2492 121.0122 56.6883 31.4899 176.1765 *318 R 4.2136 8.2492 119.1224 56.8943 31.3804 175.8705 *319 M 4.3536 8.2992 118.8427 55.1576 33.3500 175.5690 *320 Y 4.4236 8.1392 120.0351 57.2770 39.0254 175.3094 *321 N 4.6136 8.4192 119.7289 52.8101 39.6923 174.5930 *322 D 4.5136 8.3592 119.9075 53.7444 41.8832 176.1435 *323 S 4.3436 8.3292 118.3663 58.5749 64.2725 174.4765 *324 R 4.2136 8.2492 121.5196 56.9414 31.1253 176.0964 *325 T 4.2236 8.1692 112.9677 61.1898 70.4426 174.3508 *326 L 4.2136 8.1792 124.2999 54.9039 42.9168 176.8690 *327 Y 4.4236 8.1392 119.9315 57.4727 38.7889 175.4705 *328 M 4.3536 8.2992 120.7326 55.2483 33.4595 176.0964 *329 T 4.2236 8.1692 113.8007 61.3173 70.6198 174.3786 *330 Q 4.2136 8.3392 122.6522 55.4810 30.1198 175.8765 *331 R 4.2136 8.2492 119.1526 56.9566 31.4216 175.6800 *332 H 4.6036 8.4392 117.4235 55.0490 29.9501 173.7786 *333 Q 4.2136 8.3392 120.6713 55.4583 29.9266 175.5087 *334 E 4.2236 8.4392 116.8332 56.2973 31.7416 176.2508 *335 L 4.2136 8.1792 121.7219 54.6540 42.9557 177.2508 *336 L 4.2136 8.1792 121.5453 54.6540 42.8302 177.2508 *337 L 4.1908 8.0776 118.8606 54.0045 42.8302 176.4736 *338 A 4.1825 8.2592 124.3609 52.7173 20.0919 177.4786 *339 Q 4.1483 8.3392 118.6571 55.4790 30.1690 175.8260 *340 I 4.0436 8.0192 118.6293 60.6121 37.4905 176.1964 *341 T 4.2008 8.0676 112.7127 60.5403 70.2750 173.5736 *342 A 4.1825 8.2592 127.1155 52.7157 20.1785 177.1930 *343 D 4.4483 8.3592 119.0930 53.1630 41.8647 174.3180 *344 P 4.2936 0.0000 0.0000 62.5384 32.7452 176.7094 *345 N 4.6136 8.4192 118.1997 52.7696 39.4972 174.9239 *346 I 4.0436 8.0192 118.9024 60.2715 37.5443 176.0508 *347 L 4.2136 8.1792 123.2457 54.6540 42.7219 177.2508 *348 L 4.2136 8.1792 121.5453 54.9039 42.8302 176.8690 *349 Y 4.4236 8.1392 119.9315 56.7403 38.7889 173.8159 *350 P 4.2936 0.0000 0.0000 62.6904 32.8504 176.5690 *351 Y 4.4236 8.1392 119.5626 57.5197 38.7626 175.6964 *352 T 4.2236 8.1692 114.8575 61.4396 70.5521 173.9690 *353 Y 4.4236 8.1392 122.6861 57.2646 38.8754 175.6239 *354 I 4.0436 8.0192 120.4889 60.3283 37.5589 176.0724 *355 F 4.4936 8.3192 121.4869 57.4008 39.8122 175.5964 *356 T 4.2236 8.1692 115.6547 61.5303 70.2437 174.4964 *357 T 4.2008 8.0676 113.7670 60.5403 70.4698 173.5736 *358 A 4.1825 8.2592 127.1155 52.8396 20.1785 177.0690 *359 Y 4.3583 8.1392 118.6910 57.5197 38.9247 175.7985 *360 T 4.2236 8.1692 114.8575 61.3324 70.5521 174.5435 *361 S 4.3436 8.3292 120.6326 58.7809 64.2955 174.1705 *362 M 4.3536 8.2992 121.2400 55.0056 33.0950 175.7094 *363 N 4.6136 8.4192 118.6721 52.9340 39.7600 174.4690 *364 Y 4.4236 8.1392 119.5055 57.2646 38.9431 175.6239 *365 I 4.0436 8.0192 120.4889 60.4141 37.5589 176.2435 *366 S 4.3436 8.3292 119.5784 58.5853 64.1006 174.0094 *367 N 4.6136 8.4192 120.2363 53.0247 39.3278 174.9964 *368 T 4.2513 8.1159 110.9652 60.5449 70.5375 173.9616 *369 G 3.7995 8.3492 113.2698 46.0994 0.0000 174.5786 *370 Q 4.1496 8.2859 118.6138 54.7487 30.1134 175.2281 *371 G 3.7995 8.3492 109.8161 46.0593 0.0000 174.7765 *372 R 4.1219 8.2492 120.8738 56.6862 31.4012 175.9904 *373 I 4.0436 8.0192 118.5990 60.2325 37.4494 176.2101 *374 K 4.1936 8.3092 124.6196 55.3195 33.5184 175.9800 *375 H 4.6036 8.4392 118.3895 55.0640 29.8723 173.9435 *376 S 4.3436 8.3292 118.6517 58.4875 64.1023 174.2508 *377 L 4.1908 8.0776 120.5285 54.0045 42.6345 176.4736 *378 A 4.1825 8.2592 124.3609 52.6869 20.0919 177.8721 *379 V 3.9283 8.0492 117.4467 61.5131 33.6804 176.1985 *380 T 4.2513 8.1159 112.5553 60.5449 70.2871 173.9616 *381 G 3.7995 8.3492 113.2698 46.3124 0.0000 174.6964 *382 T 4.1319 8.1692 114.7191 61.5303 70.4635 174.4628 *383 T 4.2236 8.1692 116.4517 61.2545 70.4698 174.2087 *384 E 4.2236 8.4392 120.2869 56.6530 31.7276 175.9800 *385 H 4.6036 8.4392 118.3294 55.2620 30.0162 173.8964 *386 T 4.2236 8.1692 114.4708 61.2752 70.2767 174.4239 *387 I 4.0208 7.9176 119.3983 59.6220 37.4766 175.2736 *388 A 4.1825 8.2592 126.0613 52.7157 19.9836 177.1930 *389 D 4.4483 8.3592 119.0930 53.6872 41.8647 176.1260 *390 I 4.0436 8.0192 119.8166 60.6121 37.4536 176.1964 *391 T 4.2236 8.1692 115.3974 61.1182 68.9936 173.5052 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 8.40 4.29 0.00 1.77 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 *2 W 8.24 4.35 0.00 2.34 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 *3 H 8.61 4.60 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *4 Y 8.14 4.42 0.00 2.07 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 0.00 0.00 0.00 0.00 *5 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 *6 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 *7 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 *8 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.99 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 *9 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 8.06 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 *10 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 *11 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 *12 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 *13 V 7.95 3.97 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 0.84 0.00 0.00 0.93 0.00 0.00 *14 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 *15 L 8.18 4.15 0.00 1.42 1.50 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 *16 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 *17 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 *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 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 *20 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.46 0.00 0.00 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 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 *22 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 *23 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 *24 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 *25 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 *26 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 *48 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 *49 H 8.44 4.60 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *50 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 *51 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 *52 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 *53 L 8.18 4.21 0.00 1.40 1.51 0.92 0.89 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 *54 L 8.13 4.24 0.00 1.40 1.51 0.92 0.82 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 *55 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 *56 P 0.00 4.20 0.00 1.85 1.87 0.00 3.65 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 *57 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 *58 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 *59 Y 8.14 4.42 0.00 2.07 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 0.00 0.00 0.00 0.00 *60 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 *61 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.43 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 *62 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 *63 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 *64 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 *65 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 *66 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 *67 R 8.20 4.24 0.00 1.57 1.77 0.00 3.20 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.70 0.00 *68 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 *69 H 8.44 4.51 0.00 2.69 2.89 0.00 5.87 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *70 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 *71 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 *72 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 *73 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 *74 L 8.18 4.21 0.00 1.40 1.51 0.92 0.87 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 *75 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 *76 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 *77 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 *78 Y 8.14 4.42 0.00 2.07 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 0.00 0.00 0.00 0.00 *79 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 *80 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 *81 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 *82 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 *83 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 *84 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 *85 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 *86 D 8.36 4.45 0.00 2.46 2.49 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 *87 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 *88 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 *89 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 *90 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 *91 N 8.42 4.61 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0.00 1.83 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.60 0.00 0.00 0.00 0.00 0.00 2.18 2.42 0.00 *133 L 8.18 4.21 0.00 1.40 1.51 0.92 0.85 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 *134 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 *135 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 *136 N 8.32 4.59 0.00 2.48 2.66 0.00 0.00 6.84 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *137 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 *138 P 0.00 4.21 0.00 1.85 1.87 0.00 3.65 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 *139 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 *140 I 8.02 3.98 1.87 0.00 0.00 0.86 0.00 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0.00 *165 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 *166 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 *167 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 *168 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.64 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 *169 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 *170 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 *171 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 *172 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 *173 D 8.36 4.51 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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 *182 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 *183 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 *184 W 8.27 4.53 0.00 2.26 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 *185 H 8.34 4.58 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *186 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 *187 P 0.00 4.23 0.00 1.85 1.87 0.00 3.65 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 *188 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 *189 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 *190 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 *191 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 *192 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 *193 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.90 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 *194 H 8.44 4.60 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *195 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 *196 L 8.08 4.19 0.00 1.40 1.51 0.92 0.80 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 *197 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 *198 L 8.18 4.15 0.00 1.42 1.50 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 *199 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 *200 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 *201 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 *202 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 *203 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 *204 L 8.18 4.21 0.00 1.40 1.51 0.92 0.85 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 *205 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 *206 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 *207 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 *208 H 8.44 4.60 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *209 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 *210 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 *211 W 8.27 4.53 0.00 2.26 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 *212 H 8.44 4.60 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *213 W 8.27 4.53 0.00 2.26 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 *214 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 *215 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 *216 L 8.18 4.21 0.00 1.40 1.51 0.92 0.92 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 *217 H 8.44 4.60 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *218 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 *219 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 *220 H 8.44 4.60 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *221 Y 8.14 4.42 0.00 2.07 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 0.00 0.00 0.00 0.00 *222 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 *223 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 *224 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 *225 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 *226 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 *227 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 *228 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 *229 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 *230 H 8.44 4.60 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *231 F 8.22 4.47 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 *232 A 8.16 4.16 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 *233 A 8.26 4.12 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 *234 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 *235 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 *236 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 *237 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 *238 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 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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 *361 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 *362 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 *363 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 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 *364 Y 8.14 4.42 0.00 2.07 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 0.00 0.00 0.00 0.00 *365 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 *366 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 *367 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 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 *368 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 *369 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 *370 Q 8.29 4.15 0.00 1.83 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.60 0.00 0.00 0.00 0.00 0.00 2.18 2.43 0.00 *371 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 *372 R 8.25 4.12 0.00 1.59 1.76 0.00 3.23 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 *373 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 *374 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 *375 H 8.44 4.60 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *376 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 *377 L 8.08 4.19 0.00 1.40 1.51 0.92 0.80 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 *378 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 *379 V 8.05 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 0.70 0.00 0.00 0.93 0.00 0.00 *380 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 *381 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 *382 T 8.17 4.13 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 *383 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 *384 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 *385 H 8.44 4.60 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *386 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 *387 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 *388 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 *389 D 8.36 4.45 0.00 2.46 2.49 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 *390 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 *391 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 * Residues marked with a * may have inaccurate shift predictions.