NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *2 G 3.7393 8.4545 109.7364 45.3807 0.0000 174.4530 *3 N 4.3430 8.3869 117.5854 51.7881 39.5332 173.3428 *4 K 4.1936 8.4758 122.2387 55.0492 34.7118 175.9886 *5 I 4.0436 8.0192 119.5651 60.6273 37.3716 175.7800 *6 H 4.6036 8.4392 119.8532 54.4826 29.7824 172.0159 *7 P 4.2936 0.0000 0.0000 62.5260 32.5750 177.0239 *8 I 4.0713 7.9659 116.6537 59.6266 37.3637 175.6616 *9 G 3.7995 8.3492 112.2156 46.0286 0.0000 174.5724 *10 F 4.4019 8.3192 120.8086 57.1477 40.0007 175.6429 *11 R 4.2136 8.2492 121.8094 56.6009 31.1814 175.9508 *12 L 4.2413 8.1259 118.5101 54.0091 42.8896 176.8616 *13 G 3.7995 8.3492 110.5152 46.0573 0.0000 174.6239 *14 I 3.9519 8.0192 120.3505 60.6121 37.4702 176.1628 *15 T 4.2236 8.1692 115.3974 61.2772 70.2750 174.5765 *16 R 4.2136 8.2492 122.6063 56.7268 31.4076 175.6930 *17 D 4.5136 8.3592 119.6040 53.4318 41.7883 175.9994 *18 W 4.5336 8.2692 122.5967 56.6782 30.2677 175.6087 *19 E 4.2236 8.4392 117.3011 56.4398 31.1420 176.4435 *20 S 4.3436 8.3292 118.0546 58.5749 64.3344 174.4765 *21 R 4.2136 8.2492 121.5196 56.4309 31.1253 175.9994 *22 W 4.5336 8.2692 121.3791 56.8633 30.2635 175.3690 *23 Y 4.4008 8.0376 117.0155 56.5297 38.2899 174.7736 *24 A 4.2102 8.2059 123.2155 51.9449 20.2608 177.0616 *25 G 3.7341 8.3492 109.2747 45.9329 0.0000 174.8122 *26 K 4.1019 8.3092 123.9413 54.9248 33.7069 176.3766 *27 K 4.1936 8.3092 123.1559 55.0913 33.6082 176.2786 *28 Q 4.2136 8.3392 120.1342 55.6434 30.0148 175.2690 *29 Y 4.4236 8.1392 119.2323 57.2666 38.8894 175.7765 *30 R 4.2136 8.2492 121.0122 56.9566 31.4899 175.6800 *31 H 4.6036 8.4392 117.4235 54.9214 29.9501 173.7508 *32 L 4.2136 8.1792 122.3190 54.6540 42.7236 177.2508 *33 L 4.2136 8.1792 121.5453 54.6540 42.8302 177.2508 *34 L 4.2136 8.1792 121.5453 54.7188 42.8302 177.1087 *35 E 4.2236 8.4392 117.5323 56.4232 31.6411 175.9930 *36 D 4.5136 8.3592 120.5100 53.7294 41.8544 175.9786 *37 Q 4.2136 8.3392 120.3858 55.4810 30.0968 175.8765 *38 R 4.2136 8.2492 119.1526 56.6862 31.4216 176.0239 *39 I 4.0436 8.0192 118.5990 60.3590 37.4494 176.2765 *40 R 4.2413 8.1959 119.2463 55.9559 31.2127 175.5616 *41 G 3.7995 8.3492 109.7858 45.9719 0.0000 174.5508 *42 L 4.1219 8.1792 122.5674 54.6540 42.9104 177.2173 *43 L 4.2136 8.1792 121.5453 54.7188 42.8302 177.1087 *44 E 4.2236 8.4392 117.5323 56.2583 31.6411 176.4101 *45 K 4.1936 8.3092 123.0958 55.0285 33.7522 176.1087 *46 E 4.2236 8.4392 117.7690 56.2973 31.6226 176.2508 *47 L 4.2136 8.1792 121.7219 54.9039 42.9557 176.8690 *48 Y 4.4236 8.1392 119.9315 57.3218 38.7889 175.7435 *49 S 4.3208 8.2276 116.3538 57.8380 64.3778 173.4736 *50 A 4.2102 8.2059 123.7229 51.9449 19.8962 177.0616 *51 G 3.7341 8.3492 109.2747 45.9719 0.0000 174.6529 *52 L 4.0991 8.0776 119.8827 54.0045 42.9104 176.4400 *53 A 4.1825 8.2592 124.3609 52.6772 20.0919 177.6765 *54 R 4.1483 8.2492 118.6113 56.6979 31.4568 176.4742 *55 V 3.9936 8.0492 117.9578 61.2984 33.6039 175.6930 *56 D 4.5136 8.3592 121.4975 53.6872 41.6327 176.0239 *57 I 4.0436 8.0192 119.8166 60.3363 37.4536 175.9087 *58 E 4.2236 8.4392 119.2327 56.3847 31.5327 176.4765 *59 R 4.1908 8.1476 117.3436 55.9513 31.4465 175.1736 *60 A 4.1597 8.1576 120.9468 51.9403 20.1513 176.6736 *61 A 4.1172 8.2592 123.1204 52.7157 20.2277 177.2951 *62 D 4.4483 8.3592 119.0930 53.6996 41.8647 175.8115 *63 N 4.6136 8.4192 119.0567 52.7813 39.5871 175.2720 *64 V 3.9708 7.9476 115.5765 60.5230 33.6988 175.1736 *65 A 4.1825 8.2592 125.5250 52.6869 19.9957 177.8721 *66 V 3.9283 8.0492 117.4467 61.5131 33.6804 176.1985 *67 T 4.2236 8.1692 114.8611 61.2869 70.2871 174.7720 *68 V 3.9936 8.0492 121.4418 61.5282 33.6311 175.6800 *69 H 4.6036 8.4392 119.3169 55.0185 29.7945 174.1721 *70 V 3.9708 7.9476 116.7762 60.5230 33.4379 175.1736 *71 A 4.1825 8.2592 125.5250 52.5508 19.9957 177.6101 *72 K 4.1283 8.3092 121.6788 54.5250 33.7625 174.6180 *73 P 4.3213 0.0000 0.0000 61.7956 32.6631 176.5616 *74 G 3.7995 8.3492 110.1464 46.0690 0.0000 174.9720 *75 V 3.9019 8.0492 119.7093 61.2696 33.6247 176.3385 *76 V 3.9936 8.0492 119.8512 61.2579 33.4484 176.0239 *77 I 4.0713 7.9659 118.1866 59.6266 37.2938 175.6616 *78 G 3.7995 8.3492 112.2156 46.0593 0.0000 174.7765 *79 R 4.1496 8.1959 118.5680 55.9559 31.4012 175.5281 *80 G 3.8272 8.2959 107.4800 45.3270 0.0000 174.1616 *81 G 3.7078 8.3492 111.5373 46.0366 0.0000 174.3751 *82 E 4.1319 8.4392 118.5544 56.3847 31.7212 176.4429 *83 R 4.2136 8.2492 120.0283 56.6862 31.4465 176.0239 *84 I 4.0436 8.0192 118.5990 60.3590 37.4494 176.2765 *85 R 4.2136 8.2492 121.5521 56.6979 31.2127 176.3721 *86 V 3.9936 8.0492 117.9578 61.1725 33.6039 175.9508 *87 L 4.2136 8.1792 122.7094 54.7415 42.7340 177.4765 *88 R 4.2136 8.2492 119.8517 56.6656 31.3211 175.8087 *89 E 4.2236 8.4392 116.8029 56.3620 31.7004 176.1087 *90 E 4.2236 8.4392 117.7088 56.2973 31.7665 176.2508 *91 L 4.1908 8.0776 119.0372 54.0045 42.9557 176.4736 *92 A 4.1825 8.2592 124.3609 52.5508 20.0919 177.6101 *93 K 4.1283 8.3092 121.6788 54.9638 33.7625 176.3529 *94 L 4.2136 8.1792 121.7820 54.9946 42.8118 177.3964 *95 T 4.2513 8.1159 111.3912 60.5449 70.3833 173.9616 *96 G 3.7995 8.3492 113.2698 45.9329 0.0000 174.7101 *97 K 4.1019 8.3092 123.9413 55.0616 33.7069 175.9758 *98 N 4.6136 8.4192 118.8051 52.7813 39.5050 175.2720 *99 V 3.9708 7.9476 115.5765 60.5230 33.6988 175.1736 *100 A 4.1825 8.2592 125.5250 52.5898 19.9957 177.4508 *101 L 4.1483 8.1792 120.3049 54.7518 42.9660 177.1115 *102 N 4.6136 8.4192 118.5685 52.7813 39.5235 175.2720 *103 V 3.9936 8.0492 118.2612 61.3000 33.6988 175.9786 *104 Q 4.2136 8.3392 121.0617 55.4583 29.9370 175.5087 *105 E 4.2236 8.4392 116.8332 56.3944 31.7416 176.6721 *106 V 3.9936 8.0492 118.8637 61.3000 33.6700 175.9786 *107 Q 4.2136 8.3392 121.0617 55.4914 29.9370 175.4094 *108 N 4.6136 8.4192 117.8694 52.2453 39.6240 173.1159 *109 P 4.2936 0.0000 0.0000 62.5384 32.8358 176.7094 *110 N 4.6136 8.4192 118.1997 52.6842 39.4972 174.8508 *111 L 4.2136 8.1792 121.1194 54.7966 42.9845 177.4435 *112 S 4.3208 8.2276 115.1933 57.8380 64.2089 173.4736 *113 A 4.1825 8.2592 126.0288 52.1509 19.8962 175.7159 *114 P 4.2283 0.0000 0.0000 62.4406 32.8174 177.0529 *115 L 4.2136 8.1792 121.1765 54.7511 42.8039 177.6721 *116 V 3.9708 7.9476 116.0025 60.5230 33.5446 175.1736 *117 A 4.1825 8.2592 125.5250 52.7173 19.9957 177.4786 *118 Q 4.1483 8.3392 118.6571 55.4810 30.1690 175.9786 *119 R 4.2136 8.2492 119.1526 56.6979 31.4216 176.3721 *120 V 3.9708 7.9476 115.2731 60.5230 33.6039 175.1736 *121 A 4.1825 8.2592 125.5250 52.6545 19.9957 177.3087 *122 E 4.1583 8.4392 116.2918 56.4248 31.7768 176.3807 *123 Q 4.2136 8.3392 120.0741 55.4790 30.1587 175.7239 *124 I 4.0436 8.0192 118.6293 60.3363 37.4905 175.9087 *125 E 4.2236 8.4392 119.2327 56.3847 31.5327 176.4765 *126 R 4.2136 8.2492 120.0283 56.6883 31.4465 176.1765 *127 R 4.2136 8.2492 119.1224 56.6576 31.3804 175.9724 *128 F 4.4708 8.2176 116.3724 56.4108 39.9799 174.6736 *129 A 4.1825 8.2592 126.3186 52.6869 19.9523 177.8721 *130 V 3.9283 8.0492 117.4467 61.2599 33.6804 176.2786 *131 R 4.2136 8.2492 121.0158 56.6883 31.2248 176.1765 *132 R 4.1908 8.1476 116.4377 55.9513 31.3804 175.1736 *133 A 4.1825 8.2592 123.6315 52.6752 20.1513 177.5239 *134 I 3.9783 8.0192 118.0879 60.2325 37.5258 176.3122 *135 K 4.1936 8.3092 124.6196 55.0913 33.5184 176.2786 *136 Q 4.1908 8.2376 117.4496 54.7441 30.0148 174.8736 *137 A 4.1825 8.2592 123.6618 52.6869 20.1924 177.8721 *138 V 3.9283 8.0492 117.4467 61.3000 33.6804 176.0807 *139 Q 4.2136 8.3392 121.0617 55.4810 29.9370 175.8765 *140 R 4.2136 8.2492 119.1526 56.6979 31.4216 176.3721 *141 V 3.9936 8.0492 117.9578 61.4660 33.6039 175.8705 *142 M 4.3536 8.2992 120.7362 54.9725 33.1945 175.8087 *143 E 4.2236 8.4392 117.6359 56.4398 31.8776 176.4435 *144 S 4.3713 8.2759 115.7487 57.8426 64.3344 173.8616 *145 G 3.7766 8.2476 109.4984 45.3224 0.0000 173.7736 *146 A 4.0908 8.2592 125.3830 52.5508 20.1721 177.5766 *147 K 4.1560 8.2559 119.3729 54.3189 33.7625 175.9637 *148 G 3.7766 8.2476 108.0672 45.3224 0.0000 173.7736 *149 A 4.0908 8.2592 125.3830 52.5508 20.1721 177.5766 *150 K 4.1283 8.3092 121.6788 55.0609 33.7625 176.7742 *151 V 3.9936 8.0492 118.9238 61.2579 33.5261 176.0239 *152 I 4.0436 8.0192 120.4925 60.3686 37.2938 176.4720 *153 V 3.9936 8.0492 120.3876 61.3151 33.4362 176.1435 *154 S 4.3713 8.2759 116.7362 57.8426 64.1127 173.8616 *155 G 3.7995 8.3492 112.1831 46.0593 0.0000 174.7765 *156 R 4.1219 8.2492 120.8738 56.6862 31.4012 175.9904 *157 I 4.0713 7.9659 116.2932 59.6266 37.4494 175.6616 *158 G 3.8272 8.2959 109.9097 45.3270 0.0000 174.1616 *159 G 3.6849 8.2476 108.8526 45.3224 0.0000 173.7400 *160 A 4.0908 8.2592 125.3830 52.6545 20.1721 177.2751 *161 E 4.1583 8.4392 116.2918 56.4248 31.7768 176.3807 *162 Q 4.1908 8.2376 117.3895 54.7441 30.1587 174.8736 *163 A 4.1825 8.2592 123.6618 52.6772 20.1924 177.6765 *164 R 4.1483 8.2492 118.6113 56.9414 31.4568 176.1985 *165 T 4.2236 8.1692 112.9677 61.2545 70.4426 174.2087 *166 E 4.2236 8.4392 120.2869 56.1273 31.7276 176.2994 *167 W 4.5108 8.1676 119.6003 55.9639 30.3296 174.9736 *168 A 4.1597 8.1576 121.4450 51.9403 19.5929 176.6736 *169 A 4.1172 8.2592 123.1204 52.7173 20.2277 177.5807 *170 Q 4.1760 8.2859 116.3513 54.7487 30.1690 175.3637 *171 G 3.7995 8.3492 109.8161 46.0593 0.0000 174.7765 *172 R 4.1219 8.2492 120.8738 56.6979 31.4012 176.3385 *173 V 3.9936 8.0492 117.9578 60.7337 33.6039 174.2159 *174 P 4.2936 0.0000 0.0000 62.4406 32.5854 176.9508 *175 L 4.2136 8.1792 121.1765 55.0098 42.8039 176.9800 *176 H 4.6036 8.4392 118.1529 55.2620 29.8907 173.8964 *177 T 4.2236 8.1692 114.4708 61.1898 70.2767 174.3508 *178 L 4.2136 8.1792 124.2999 54.7415 42.9168 177.4765 *179 R 4.1908 8.1476 117.1671 55.9513 31.3211 175.1736 *180 A 4.1825 8.2592 123.6315 52.6876 20.1513 177.2094 *181 N 4.5483 8.4192 117.3280 52.7696 39.6593 175.0260 *182 I 4.0436 8.0192 118.9024 60.3974 37.5443 175.7930 *183 D 4.5136 8.3592 122.0338 53.8517 41.6206 175.5690 *184 Y 4.4513 8.0859 118.1139 56.5343 38.8525 175.1616 *185 G 3.7995 8.3492 111.6757 46.0286 0.0000 174.5724 *186 F 4.3791 8.2176 118.1239 56.4108 40.0007 174.6400 *187 A 4.1825 8.2592 126.3186 52.5898 19.9523 177.4508 *188 L 4.1254 8.0776 117.6202 54.0045 42.9660 176.5757 *189 A 4.1825 8.2592 124.3609 52.6772 20.0919 177.6765 *190 R 4.1483 8.2492 118.6113 56.9414 31.4568 176.1985 *191 T 4.2236 8.1692 112.9677 61.5303 70.4426 174.4964 *192 T 4.2236 8.1692 116.4517 61.4396 70.4698 173.9690 *193 Y 4.4513 8.0859 120.3802 56.5343 38.8754 175.1616 *194 G 3.7995 8.3492 111.6757 46.0690 0.0000 174.9720 *195 V 3.9019 8.0492 119.7093 61.1725 33.6247 175.9173 *196 L 4.2413 8.1259 120.4035 54.0091 42.7340 176.8616 *197 G 3.7995 8.3492 110.5152 46.0690 0.0000 174.9720 *198 V 3.9019 8.0492 119.7093 61.1335 33.6247 176.0766 *199 K 4.1708 8.2076 121.3986 54.3143 33.5305 175.4736 *200 A 4.1825 8.2592 124.5975 52.8396 20.0735 177.0690 *201 Y 4.3583 8.1392 118.6910 57.2646 38.9247 175.7260 *202 I 4.0436 8.0192 120.4889 60.3283 37.5589 176.0724 *203 F 4.4936 8.3192 121.4869 57.0603 39.8122 175.4508 *204 L 4.2413 8.1259 121.1972 54.0091 42.6906 176.8616 *205 G 3.7995 8.3492 110.5152 46.0366 0.0000 174.4087 *206 E 4.1319 8.4392 118.5544 56.3944 31.7212 176.6385 *207 V 3.9936 8.0492 118.8637 61.1009 32.3887 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 *2 G 8.45 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 0.00 0.00 0.00 *3 N 8.39 4.34 0.00 2.58 2.64 0.00 0.00 6.76 6.56 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 *4 K 8.48 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 *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 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 *7 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 *8 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 *9 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 *10 F 8.32 4.40 0.00 2.06 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 0.00 0.00 0.00 0.00 *11 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 *12 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 *13 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 *14 I 8.02 3.95 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 *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 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 *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 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 *19 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 *20 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 *21 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 *22 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 *23 Y 8.04 4.40 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 *24 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 *25 G 8.35 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *26 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 *27 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 *28 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 *29 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 *30 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 *31 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 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*106 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 *107 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 *108 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *109 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 *110 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 *111 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 *112 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 *113 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 *114 P 0.00 4.23 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 0.00 0.00 2.13 2.37 0.00 *123 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 *124 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 *125 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 *126 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 *127 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 *128 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 *129 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 *130 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 *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 8.15 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 *133 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 *134 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 *135 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 *136 Q 8.24 4.19 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 2.43 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 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 *139 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 *140 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 *141 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 *142 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 *143 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 *144 S 8.28 4.37 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 *145 G 8.25 3.78 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 0.00 0.00 0.00 *146 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 *147 K 8.26 4.16 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 *148 G 8.25 3.78 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 0.00 0.00 0.00 *149 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 *150 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 *151 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 *152 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 *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 S 8.28 4.37 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 *155 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 *156 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 *157 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 *158 G 8.30 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *159 G 8.25 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 *160 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 *161 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 *162 Q 8.24 4.19 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 2.43 0.00 *163 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 *164 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 *165 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 *166 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 *167 W 8.17 4.51 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 *168 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 *169 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 *170 Q 8.29 4.18 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 *171 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 *172 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 *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 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 *175 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 *176 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 *177 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 *178 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 *179 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 *180 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 *181 N 8.42 4.55 0.00 2.50 2.64 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 *182 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 *183 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 *184 Y 8.09 4.45 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 *185 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 *186 F 8.22 4.38 0.00 2.06 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 0.00 0.00 0.00 0.00 *187 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 *188 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 *189 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 *190 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 *191 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 *192 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 *193 Y 8.09 4.45 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 *194 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 *195 V 8.05 3.90 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 *196 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 *197 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 *198 V 8.05 3.90 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 *199 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 *200 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 *201 Y 8.14 4.36 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *202 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 *203 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 *204 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 *205 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 *206 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 *207 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 * Residues marked with a * may have inaccurate shift predictions.