NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 M 4.2934 8.4045 118.7933 54.2835 33.5435 175.8530 *2 E 4.0219 8.3024 115.6308 55.1588 31.7290 173.9049 *3 A 4.1825 8.4258 124.2829 52.9303 21.1484 177.2611 *4 T 4.1583 8.1692 112.4566 61.2752 70.5191 174.5260 *5 I 4.0436 8.0192 122.0830 60.5214 37.4766 175.6690 *6 Y 4.4236 8.1392 121.6318 57.3051 38.6806 175.2930 *7 D 4.5136 8.3592 121.4939 53.6996 41.8978 175.7094 *11 N 4.6136 8.4192 119.0567 53.0247 39.5871 174.9964 *12 T 4.2236 8.1692 113.2711 61.3157 70.5375 174.0930 *13 D 4.5413 8.3059 120.7822 52.9569 41.8155 175.5616 *14 G 3.7995 8.3492 111.0034 46.0366 0.0000 174.4087 *15 E 4.1319 8.4392 118.5544 56.3944 31.7212 176.6385 *16 V 3.9936 8.0492 118.8637 61.2984 33.6700 175.6930 *17 D 4.5136 8.3592 121.4975 53.6018 41.6327 175.9508 *18 L 4.2136 8.1792 122.0336 54.2152 42.8938 175.5159 *19 P 4.2936 0.0000 0.0000 62.5665 32.6816 176.6930 *20 D 4.5136 8.3592 119.9646 53.6989 41.7026 176.3721 *21 V 3.9936 8.0492 119.1754 61.2292 33.6081 175.9724 *22 F 4.4936 8.3192 120.9506 57.1250 39.8243 175.3087 *23 E 4.2236 8.4392 119.4900 56.6378 31.5014 176.3964 *24 T 4.2236 8.1692 113.8736 60.7510 70.5088 172.6159 *25 P 4.2936 0.0000 0.0000 62.5377 32.7681 177.3721 *26 V 3.9936 8.0492 118.3184 61.2599 33.5182 176.1765 *27 R 4.2136 8.2492 121.0158 56.7434 31.2248 176.1435 *28 S 4.3436 8.3292 117.1486 58.6134 64.2683 173.9930 *29 D 4.5136 8.3592 122.0013 53.6018 41.5332 175.9508 *30 L 4.2136 8.1792 122.0336 54.7394 42.8938 177.3239 *31 I 4.0713 7.9659 117.0226 59.6266 37.3901 175.6616 *32 G 3.7995 8.3492 112.2156 45.9329 0.0000 174.7101 *33 K 4.0791 8.2076 121.2566 54.3143 33.7069 175.4400 *34 A 4.1825 8.2592 124.5975 52.6869 20.0735 177.8721 *35 V 3.9283 8.0492 117.4467 61.2599 33.6804 176.2786 *36 R 4.1908 8.1476 118.3311 55.9513 31.2248 175.1736 *37 A 4.1597 8.1576 120.9468 51.9403 20.1513 176.6736 *38 A 4.1172 8.2592 123.1204 52.7173 20.2277 177.5807 *39 Q 4.1254 8.2376 115.9724 54.7441 30.1690 174.9757 *40 A 4.1825 8.2592 123.6618 52.6876 20.1924 177.2094 *41 N 4.5483 8.4192 117.3280 52.7716 39.6593 175.1786 *42 R 4.2136 8.2492 119.4258 56.5619 31.4753 176.1101 *43 K 4.1936 8.3092 122.1899 55.0913 33.6860 176.2786 *44 Q 4.2136 8.3392 120.1342 55.5195 30.0148 175.3930 *45 D 4.5136 8.3592 119.6343 53.8517 41.8294 175.5690 *46 Y 4.4513 8.0859 118.1139 56.5343 38.8525 175.1616 *47 G 3.7995 8.3492 111.6757 46.1145 0.0000 174.7435 *48 S 4.2519 8.3292 118.9001 58.6134 64.2891 173.9595 *49 D 4.5136 8.3592 122.0013 53.6665 41.5332 175.8087 *50 E 4.2236 8.4392 118.0205 56.5471 31.7046 175.8690 *51 Y 4.4008 8.0376 117.4233 56.5297 38.9144 174.7736 *52 A 4.2102 8.2059 123.2155 51.9449 20.2608 177.0616 *53 G 3.7341 8.3492 109.2747 45.9719 0.0000 174.6529 *54 L 4.1219 8.1792 122.5674 54.7415 42.9104 177.4429 *55 R 4.2136 8.2492 119.8517 56.9414 31.3211 176.0964 *56 T 4.2236 8.1692 112.9677 60.7510 70.4426 172.6159 *57 P 4.2708 0.0000 0.0000 61.7911 32.7681 176.1736 *58 A 4.1825 8.2592 123.9921 52.6545 20.0656 177.3087 *59 E 4.1583 8.4392 116.2918 56.4398 31.7768 176.5456 *60 S 4.3436 8.3292 118.0546 58.5442 64.3344 174.2724 *61 F 4.5213 8.2659 119.1485 56.4154 39.7248 175.0616 *62 G 3.7995 8.3492 112.4729 46.1145 0.0000 174.7435 *63 S 4.2796 8.2759 116.5943 57.8426 64.2891 173.8281 *64 G 3.7995 8.3492 112.1831 46.0593 0.0000 174.7765 *65 R 4.1496 8.1959 118.5680 55.9559 31.4012 175.5281 *66 G 3.7995 8.3492 109.7858 46.0994 0.0000 174.5786 *67 Q 4.0991 8.2376 118.2350 54.7441 30.1134 174.8400 *68 A 4.1825 8.2592 123.6618 52.9455 20.1924 177.1800 *69 H 4.5383 8.4392 116.9124 55.0089 30.0265 174.0786 *79 R 4.2136 8.2492 120.6254 56.6979 31.2144 176.3721 *80 V 3.9936 8.0492 117.9578 60.7337 33.6039 174.2159 *81 P 4.2936 0.0000 0.0000 62.5681 32.5854 176.9786 *82 Q 4.1908 8.2376 116.8441 54.7441 30.0069 174.8736 *83 A 4.1825 8.2592 123.6618 52.6869 20.1924 177.8721 *84 V 3.9283 8.0492 117.4467 61.1335 33.6804 176.2122 *85 K 4.2213 8.2559 121.7775 54.3189 33.5305 175.8616 *86 G 3.7995 8.3492 110.7519 46.0593 0.0000 174.7765 *87 R 4.1219 8.2492 120.8738 56.7434 31.4012 176.1099 *88 S 4.3208 8.2276 114.4640 57.8380 64.2683 173.4736 *89 A 4.1825 8.2592 126.0288 52.9455 19.8962 177.1800 *90 H 4.5383 8.4392 116.9124 54.4826 30.0265 172.1180 *91 P 4.2936 0.0000 0.0000 62.0017 32.5750 175.2159 *92 P 4.2936 0.0000 0.0000 62.4016 32.6553 177.1101 *93 K 4.1936 8.3092 122.5504 55.3044 33.6004 176.3964 *94 T 4.2236 8.1692 113.9337 61.2545 70.3649 174.2087 *95 E 4.2236 8.4392 120.2869 56.2583 31.7276 176.4101 *96 K 4.1936 8.3092 123.0958 55.0897 33.7522 175.9930 *97 D 4.5136 8.3592 120.5701 53.6893 41.7105 176.1765 *98 R 4.2136 8.2492 120.3400 56.7434 31.3846 176.1435 *99 S 4.3436 8.3292 117.1486 58.4875 64.2683 174.2508 *100 L 4.2136 8.1792 123.2132 54.7799 42.6345 176.9930 *101 D 4.5136 8.3592 120.3334 53.6018 41.7289 175.9508 *102 L 4.2136 8.1792 122.0336 54.7518 42.8938 177.0094 *103 N 4.6136 8.4192 118.5685 52.8101 39.5235 174.5930 *104 D 4.5136 8.3592 119.9075 53.5628 41.8832 176.1101 *105 K 4.1936 8.3092 123.4075 55.0285 33.6903 176.1087 *106 E 4.2236 8.4392 117.7690 56.3847 31.6226 176.4765 *107 R 4.2136 8.2492 120.0283 56.7284 31.4465 175.9786 *108 Q 4.2136 8.3392 119.1682 55.3936 30.0926 175.6508 *109 L 4.1908 8.0776 118.1615 54.0045 42.9307 176.4736 *110 A 4.1825 8.2592 124.3609 52.6869 20.0919 177.8721 *111 V 3.9283 8.0492 117.4467 61.2599 33.6804 176.2786 *112 R 4.2136 8.2492 121.0158 56.7434 31.2248 176.1435 *113 S 4.3208 8.2276 114.4640 57.8380 64.2683 173.4736 *114 A 4.1825 8.2592 126.0288 52.5898 19.8962 177.4508 *115 L 4.1254 8.0776 117.6202 54.0045 42.9660 176.5757 *116 A 4.1597 8.1576 121.6762 51.9403 20.0919 176.6736 *117 A 4.1172 8.2592 123.1204 52.9303 20.2277 177.6985 *118 T 4.1354 8.0676 109.7719 60.5403 70.5191 173.6757 *119 A 4.1825 8.2592 127.1155 52.7157 20.1785 177.1930 *120 D 4.4483 8.3592 119.0930 53.6989 41.8647 176.4742 *138 V 3.9936 8.0492 119.1754 61.2696 33.6081 176.3721 *139 V 3.9936 8.0492 119.8512 61.2696 33.4484 176.3721 *140 V 3.9936 8.0492 119.8512 61.3151 33.4484 176.1435 *141 S 4.3436 8.3292 119.0421 58.6134 64.1127 173.9930 *142 D 4.5136 8.3592 122.0013 53.7277 41.5332 175.6930 *143 D 4.5136 8.3592 120.8217 53.6585 41.7925 175.9724 *144 F 4.4936 8.3192 120.2747 57.1250 39.9841 175.3087 *145 E 4.2236 8.4392 119.4900 56.4232 31.5014 175.9930 *146 D 4.5136 8.3592 120.5100 53.6018 41.8544 175.9508 *147 L 4.2136 8.1792 122.0336 54.7511 42.8938 177.6721 *148 V 3.9936 8.0492 118.6872 61.1335 33.5446 176.1101 *149 K 4.1936 8.3092 124.0833 55.3044 33.5305 176.3964 *150 T 4.2236 8.1692 113.9337 61.3173 70.3649 174.3786 *151 Q 4.2136 8.3392 122.6522 55.4583 30.1198 175.5087 *152 E 4.2236 8.4392 116.8332 56.3944 31.7416 176.6721 *153 V 3.9936 8.0492 118.8637 61.2696 33.6700 176.3721 *154 V 3.9936 8.0492 119.8512 61.3151 33.4484 176.1435 *155 S 4.3436 8.3292 119.0421 58.4875 64.1127 174.2508 *156 L 4.2136 8.1792 123.2132 54.6540 42.6345 177.2508 *157 L 4.2136 8.1792 121.5453 54.7188 42.8302 177.1087 *158 E 4.2008 8.3376 114.8476 55.6478 31.6411 175.4736 *159 A 4.1825 8.2592 124.5374 52.5898 20.2174 177.4508 *160 L 4.1483 8.1792 120.3049 54.7799 42.9660 177.0951 *161 D 4.5136 8.3592 120.3334 53.6989 41.7289 176.3721 *162 V 3.9936 8.0492 119.1754 61.5282 33.6081 175.6800 *163 H 4.5808 8.3376 116.6322 54.2719 29.7945 172.9736 *164 A 4.1825 8.2592 125.1346 52.7157 19.9853 177.1930 *165 D 4.4483 8.3592 119.0930 53.6872 41.8647 176.1260 *166 I 4.0436 8.0192 119.8166 60.3974 37.4536 175.7930 *167 D 4.5136 8.3592 122.0338 53.6893 41.6206 176.1765 *168 R 4.2136 8.2492 120.3400 56.6009 31.3846 175.9508 *193 L 4.2136 8.1792 120.8159 54.7107 42.8896 177.2724 *194 F 4.4936 8.3192 119.7865 57.1574 39.9206 175.8721 *195 V 3.9936 8.0492 120.6449 61.5131 33.4049 176.0964 *196 T 4.2236 8.1692 114.8611 61.3324 70.2871 174.5435 *197 S 4.3436 8.3292 120.6326 58.6134 64.2955 173.9930 *198 D 4.5136 8.3592 122.0013 53.6665 41.5332 175.8087 *199 E 4.2236 8.4392 118.0205 55.8584 31.7046 174.5159 *200 P 4.2936 0.0000 0.0000 62.5832 32.8071 177.1435 *201 S 4.3436 8.3292 117.5092 58.8280 64.1826 174.3964 *202 T 4.2008 8.0676 112.6802 60.5403 70.1876 173.5736 *203 A 4.1597 8.1576 124.4308 51.9403 20.1785 176.6736 *204 A 4.1172 8.2592 123.1204 52.6772 20.2277 177.7786 *205 R 4.1483 8.2492 118.6113 56.6987 31.4568 175.8115 *206 N 4.6136 8.4192 117.8391 52.6842 39.5828 174.8508 *207 L 4.1908 8.0776 118.4347 54.0045 42.9845 176.4736 *208 A 4.2102 8.2059 122.0551 51.9449 20.0919 177.0616 *209 G 3.7113 8.2476 106.5900 45.3224 0.0000 173.8757 *210 A 4.0908 8.2592 125.3830 52.7157 20.1721 177.1595 *211 D 4.4483 8.3592 119.0930 53.6989 41.8647 176.4742 *212 V 3.9708 7.9476 116.4907 60.5230 33.6081 175.1736 *213 A 4.1825 8.2592 125.5250 52.9303 19.9957 177.5964 *214 T 4.1354 8.0676 109.7719 60.5403 70.5191 173.6757 *215 A 4.1825 8.2592 127.1155 52.7324 20.1785 177.6435 *216 S 4.2783 8.3292 116.6376 58.5522 64.3447 174.2108 *217 E 4.2236 8.4392 119.2002 56.3944 31.4453 176.6721 *218 V 3.9936 8.0492 118.8637 61.2703 33.6700 175.7094 *219 N 4.6136 8.4192 119.7325 53.0247 39.4273 174.9964 *220 T 4.2236 8.1692 113.2711 61.2545 70.5375 174.2087 *221 E 4.2236 8.4392 120.2869 56.4232 31.7276 175.9930 *222 D 4.5136 8.3592 120.5100 53.6018 41.8544 175.9508 *223 L 4.1908 8.0776 119.3489 54.0045 42.8938 176.4736 *224 A 4.1825 8.2592 124.3609 52.1509 20.0919 175.7159 *225 P 4.2560 0.0000 0.0000 61.7956 32.8174 176.6637 *230 G 3.7995 8.3492 110.1464 46.0593 0.0000 174.7765 *231 R 4.1219 8.2492 120.8738 56.6009 31.4012 175.9173 *232 L 4.2136 8.1792 120.8159 54.9946 42.8896 177.3964 *233 T 4.2236 8.1692 113.6971 61.2869 70.3833 174.7720 *234 V 3.9936 8.0492 121.4418 61.2292 33.6311 175.9724 *235 F 4.4936 8.3192 120.9506 57.4008 39.8243 175.5964 *236 T 4.2236 8.1692 115.6547 61.2545 70.2437 174.2087 *237 E 4.2236 8.4392 120.2869 56.4398 31.7276 176.4435 *238 S 4.3208 8.2276 115.3699 57.8380 64.3344 173.4736 *239 A 4.1825 8.2592 126.0288 52.5898 19.8962 177.4508 *240 L 4.1254 8.0776 117.6202 54.0045 42.9660 176.5757 *241 A 4.1825 8.2592 124.3609 52.6545 20.0919 177.3087 *242 E 4.1583 8.4392 116.2918 56.3944 31.7768 176.7742 *243 V 3.9708 7.9476 116.1790 60.5230 33.6700 175.1736 *244 A 4.1825 8.2592 125.5250 52.6545 19.9957 177.3087 *245 E 4.1583 8.4392 116.2918 56.3847 31.7768 176.5786 *246 R 4.2136 8.2492 120.0283 56.5293 30.1652 175.1053 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 E 8.30 4.02 0.00 1.81 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 *3 A 8.43 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 *4 T 8.17 4.16 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 *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 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 *7 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 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 *12 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 *13 D 8.31 4.54 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 *14 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 *15 E 8.44 4.13 0.00 1.75 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 2.13 2.37 0.00 *16 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 *17 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 *18 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 *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 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 *21 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 *22 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 *23 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 *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 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 *26 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 *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 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 *29 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 *30 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 *31 I 7.97 4.07 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 *32 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 *33 K 8.21 4.08 0.00 1.54 1.64 0.00 1.61 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 *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 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 *36 R 8.15 4.19 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 *37 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 *38 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 *39 Q 8.24 4.13 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 *40 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 *41 N 8.42 4.55 0.00 2.50 2.64 0.00 0.00 6.76 7.66 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *142 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 *143 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 *144 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 *145 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 *146 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 *147 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 *148 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 *149 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 *150 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 *151 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 *152 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 *153 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 *154 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 *155 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 *156 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 *157 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 *158 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 *159 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 *160 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 *161 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 *162 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 *163 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 *164 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 *165 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 *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 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 *168 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 *193 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 *194 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 *195 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 *196 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 *197 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 *198 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 *199 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 *200 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 *201 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 *202 T 8.07 4.20 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 *203 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 *204 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 *205 R 8.25 4.15 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 *206 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.79 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 *207 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 *208 A 8.21 4.21 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 *209 G 8.25 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 0.00 0.00 0.00 *210 A 8.26 4.09 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 *211 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 *212 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 *213 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 *214 T 8.07 4.14 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 *215 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 *216 S 8.33 4.28 0.00 3.61 3.69 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 0.00 0.00 0.00 0.00 *217 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 *218 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 *219 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 *220 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 *221 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 *222 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 *223 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 *224 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 *225 P 0.00 4.26 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 *230 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 *231 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 *232 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 *233 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 *234 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 *235 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 *236 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 *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 S 8.23 4.32 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 *239 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 *240 L 8.08 4.13 0.00 1.42 1.50 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 *241 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 *242 E 8.44 4.16 0.00 1.75 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 2.13 2.37 0.00 *243 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 *244 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 *245 E 8.44 4.16 0.00 1.75 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 2.13 2.37 0.00 *246 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 * Residues marked with a * may have inaccurate shift predictions.