NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *7 I 3.9834 8.1245 118.5496 59.8324 37.6428 175.9530 *8 Y 4.2447 8.1069 119.6266 56.4095 38.7044 174.0759 *9 R 4.1908 8.5188 121.1936 55.9513 32.4208 174.8383 *10 A 4.1825 8.2592 123.6315 52.6752 20.1513 177.5239 *11 I 3.9783 8.0192 118.0879 60.3686 37.5258 176.5741 *12 V 3.9936 8.0492 120.3876 61.5131 33.4362 176.0964 *13 T 4.2236 8.1692 114.8611 61.3324 70.2871 174.5435 *14 S 4.3436 8.3292 120.6326 58.4485 64.2955 174.4101 *15 K 4.1936 8.3092 124.5871 55.0205 33.4310 176.2724 *16 F 4.4936 8.3192 120.0232 57.1477 39.9021 175.6765 *17 R 4.2136 8.2492 121.8094 56.9414 31.1814 176.0964 *18 T 4.2236 8.1692 112.9677 61.2545 70.4426 174.2087 *19 E 4.2236 8.4392 120.2869 56.2583 31.7276 176.4101 *20 K 4.1936 8.3092 123.0958 55.2573 33.7522 176.1705 *21 M 4.3536 8.2992 119.8088 54.9078 33.2722 175.9508 *22 L 4.2136 8.1792 121.6490 54.7518 43.0668 177.0094 *23 N 4.6136 8.4192 118.5685 52.7409 39.5235 174.8724 *24 F 4.4936 8.3192 119.3605 57.3101 40.0748 175.0690 *25 Y 4.4236 8.1392 121.8891 57.2770 38.6493 175.3094 *26 N 4.6136 8.4192 119.7289 52.8268 39.6923 175.0435 *27 S 4.3436 8.3292 117.4521 58.5729 64.3632 174.3239 *28 I 4.0713 7.9659 118.6904 59.6266 37.1943 175.6616 *29 G 3.7995 8.3492 112.2156 46.1145 0.0000 174.7435 *30 S 4.2796 8.2759 116.5943 57.8426 64.2891 173.8281 *31 G 3.7995 8.3492 112.1831 45.5330 0.0000 172.8159 *32 P 4.2019 0.0000 0.0000 62.5665 32.7618 176.6595 *33 D 4.5136 8.3592 119.9646 53.5628 41.7026 176.1101 *34 K 4.1936 8.3092 123.4075 55.0616 33.6903 176.0094 *35 N 4.6136 8.4192 118.8051 53.0247 39.5050 174.9964 *36 T 4.2236 8.1692 113.2711 61.2752 70.5375 174.4239 *37 I 4.0436 8.0192 122.0830 60.3283 37.4766 176.0724 *38 F 4.4936 8.3192 121.4869 57.1457 39.8122 175.5239 *39 I 4.0436 8.0192 121.2861 60.6121 37.2504 176.1964 *40 T 4.2236 8.1692 115.3974 61.2465 70.2750 174.3724 *41 F 4.5213 8.2659 120.2353 56.4154 40.0071 175.0616 *42 G 3.7995 8.3492 112.4729 46.0593 0.0000 174.7765 *43 R 4.1219 8.2492 120.8738 56.7434 31.4012 176.1099 *44 S 4.3436 8.3292 117.1486 58.5522 64.2683 174.1087 *45 E 4.2236 8.4392 119.2002 55.8584 31.4453 174.5159 *46 P 4.2936 0.0000 0.0000 62.2706 32.8071 176.9994 *47 W 4.5336 8.2692 121.7396 56.7560 30.1778 175.9435 *48 S 4.3436 8.3292 117.6468 58.6301 63.7099 174.4435 *49 S 4.3436 8.3292 119.5459 58.5853 64.0132 174.0094 *50 N 4.6136 8.4192 120.2363 52.7489 39.3278 174.7087 *51 E 4.2236 8.4392 117.1063 56.3951 31.7953 176.0094 *52 N 4.6136 8.4192 118.7450 52.7489 39.6490 174.7087 *53 E 4.2236 8.4392 117.1063 56.3944 31.7953 176.6721 *54 V 4.0213 7.9959 116.5579 60.5276 33.6700 175.5616 *55 G 3.7995 8.3492 111.6793 46.0286 0.0000 174.5724 *56 F 4.3791 8.2176 118.1239 56.4108 40.0007 174.6400 *57 A 4.1825 8.2592 126.3186 52.1509 19.9523 175.7159 *58 P 4.2283 0.0000 0.0000 62.0017 32.8174 175.3180 *59 P 4.2936 0.0000 0.0000 62.6904 32.6553 176.5690 *60 Y 4.4236 8.1392 119.5626 56.7403 38.7626 173.8159 *61 P 4.2936 0.0000 0.0000 62.7811 32.8504 177.0964 *62 T 4.2236 8.1692 113.3282 61.3157 70.3570 174.0930 *63 D 4.5136 8.3592 123.0880 53.7444 41.8155 176.1435 *64 S 4.3436 8.3292 118.3663 58.5846 64.2725 174.6721 *65 V 3.9936 8.0492 120.3550 61.1725 33.3488 175.9508 *66 L 4.2413 8.1259 120.4035 54.0091 42.7340 176.8616 *67 G 3.7995 8.3492 110.5152 46.0690 0.0000 174.9720 *68 V 3.9019 8.0492 119.7093 61.5131 33.6247 176.0628 *69 T 4.2236 8.1692 114.8611 61.3157 70.2871 174.0930 *70 D 4.5136 8.3592 123.0880 53.8953 41.8155 175.8705 *71 M 4.3536 8.2992 120.0603 54.7378 33.3543 175.9994 *72 W 4.5336 8.2692 122.2121 56.9540 30.4407 175.8964 *73 T 4.2236 8.1692 113.4658 61.5455 69.8843 174.0800 *74 H 4.6036 8.4392 120.9074 55.2149 29.9773 173.6705 *75 M 4.3536 8.2992 120.3458 55.2012 33.1841 175.8705 *76 M 4.3813 8.2459 117.3699 54.2629 33.5272 175.5616 *77 G 3.7995 8.3492 110.6189 46.3124 0.0000 174.6964 *78 T 4.1319 8.1692 114.7191 61.2869 70.4635 174.7385 *79 V 3.9936 8.0492 121.4418 61.1335 33.6311 176.1101 *80 K 4.1936 8.3092 124.0833 55.0609 33.5305 176.6721 *81 V 3.9936 8.0492 118.9238 61.1725 33.5261 175.9508 *82 L 4.2136 8.1792 122.7094 54.2152 42.7340 175.5159 *83 P 4.2936 0.0000 0.0000 62.5832 32.6816 177.1435 *84 S 4.3436 8.3292 117.5092 58.7809 64.1826 174.1705 *85 M 4.3536 8.2992 121.2400 54.9078 33.0950 175.9508 *86 L 4.2136 8.1792 121.6490 54.7799 43.0668 176.9930 *87 D 4.4908 8.2576 117.6488 52.9523 41.7289 175.1736 *88 A 4.1825 8.2592 124.8491 52.6869 20.1555 177.8721 *89 V 3.9283 8.0492 117.4467 61.2579 33.6804 176.1260 *90 I 4.0436 8.0192 120.4925 59.8327 37.2938 174.3159 *91 P 4.2936 0.0000 0.0000 62.5280 32.5733 177.1765 *92 R 4.2136 8.2492 119.4829 56.6883 31.2947 176.1765 *93 R 4.2136 8.2492 119.1224 56.7268 31.3804 175.6930 *94 D 4.5136 8.3592 119.6040 53.4318 41.7883 175.9994 *95 W 4.5613 8.2159 120.2908 55.9685 30.2677 175.3616 *96 G 3.7995 8.3492 110.2840 46.0978 0.0000 174.2930 *97 D 4.4219 8.3592 121.3555 53.9424 41.8091 176.0628 *98 T 4.2236 8.1692 114.1853 61.2772 70.4469 174.5765 *99 R 4.2136 8.2492 122.6063 56.8507 31.4076 175.5690 *100 Y 4.4236 8.1392 119.2021 56.7403 38.8482 173.8159 *101 P 4.2936 0.0000 0.0000 62.5665 32.8504 176.6930 *102 D 4.5136 8.3592 119.9646 53.1630 41.7026 174.2159 *103 P 4.2936 0.0000 0.0000 62.6904 32.7452 176.5690 *104 Y 4.4236 8.1392 119.5626 57.5197 38.7626 175.6964 *105 T 4.2236 8.1692 114.8575 61.2465 70.5521 174.3724 *106 F 4.4936 8.3192 122.5411 57.1477 40.0071 175.6765 *107 R 4.2136 8.2492 121.8094 56.6862 31.1814 176.0239 *108 I 4.0436 8.0192 118.5990 60.3694 37.4494 175.8094 *109 N 4.6136 8.4192 120.2689 52.8101 39.4152 174.5930 *110 D 4.5136 8.3592 119.9075 53.6872 41.8832 176.0239 *111 I 4.0436 8.0192 119.8166 60.3686 37.4536 176.4720 *112 V 3.9936 8.0492 120.3876 61.2696 33.4362 176.3721 *113 V 3.9936 8.0492 119.8512 61.4027 33.4484 176.4663 *114 C 4.5836 8.4492 119.3665 55.4700 41.8046 174.0094 *115 N 4.6136 8.4192 119.5787 52.8268 39.1707 175.0435 *116 S 4.3208 8.2276 114.7674 57.8380 64.3632 173.4736 *117 A 4.1825 8.2592 126.0288 52.1509 19.8962 175.7159 *118 P 4.2283 0.0000 0.0000 62.6904 32.8174 176.6711 *119 Y 4.4236 8.1392 119.5626 57.2770 38.7626 175.3094 *120 N 4.5908 8.3176 117.0443 52.0347 39.6923 174.0736 *121 A 4.1825 8.2592 123.9349 52.9303 20.2462 177.5964 *122 T 4.1583 8.1692 112.4566 61.2545 70.5191 174.3108 *123 E 4.2236 8.4392 120.2869 56.4398 31.7276 176.4435 *124 S 4.3713 8.2759 115.7487 57.8426 64.3344 173.8616 *125 G 3.7766 8.2476 109.4984 45.3224 0.0000 173.7736 *126 A 4.1185 8.2059 123.0771 51.9449 20.1721 177.0281 *127 G 3.7341 8.3492 109.2747 45.8019 0.0000 174.7015 *128 W 4.4419 8.2692 123.1305 56.6135 30.2843 175.7173 *129 L 4.2136 8.1792 121.3141 54.7511 42.3312 177.6721 *130 V 3.9936 8.0492 118.6872 61.4223 33.5446 175.5690 *131 Y 4.4236 8.1392 121.0955 57.2666 38.6927 175.7765 *132 R 4.2136 8.2492 121.0122 56.8310 31.4899 176.4663 *133 C 4.5836 8.4492 117.4731 55.3722 41.9602 174.2508 *134 L 4.2136 8.1792 122.5556 54.7799 42.4775 176.9930 *135 D 4.5136 8.3592 120.3334 53.6989 41.7289 176.3721 *136 V 3.9936 8.0492 119.1754 60.7337 33.6081 174.2159 *137 P 4.2936 0.0000 0.0000 62.5665 32.5854 176.6930 *138 D 4.5136 8.3592 119.9646 53.9424 41.7026 176.0964 *139 T 4.2513 8.1159 111.8795 60.5449 70.4469 173.9616 *140 G 3.7995 8.3492 113.2698 46.2653 0.0000 174.4705 *141 M 4.2619 8.2992 120.5942 55.1380 33.3709 176.4327 *142 C 4.5836 8.4492 118.3061 55.5148 42.1373 174.4435 *143 S 4.3436 8.3292 118.8883 58.5729 63.8562 174.3239 *144 I 4.0208 7.9176 118.3116 59.6220 37.1943 175.2736 *145 A 4.1825 8.2592 126.0613 52.7324 19.9836 177.6435 *146 S 4.2783 8.3292 116.6376 58.4875 64.3447 174.3529 *147 L 4.2136 8.1792 123.2132 54.9946 42.6345 177.3964 *148 T 4.2236 8.1692 113.6971 61.3157 70.3833 174.0930 *149 D 4.5136 8.3592 123.0880 53.5628 41.8155 176.1101 *150 K 4.1936 8.3092 123.4075 55.0897 33.6903 175.9930 *151 D 4.5136 8.3592 120.5701 53.6665 41.7105 175.8087 *152 E 4.2236 8.4392 118.0205 56.5274 31.7046 176.7663 *153 C 4.5836 8.4492 118.3790 55.3722 42.0263 174.2508 *154 L 4.2136 8.1792 122.5556 54.6150 42.4775 177.4101 *155 K 4.1936 8.3092 122.9193 54.9638 33.6267 176.2508 *156 L 4.2413 8.1259 119.4761 54.0091 42.8118 176.8616 *157 G 3.8272 8.2959 108.2094 45.3270 0.0000 174.1616 *158 G 3.7078 8.3492 111.5373 45.9329 0.0000 174.6766 *159 K 4.1019 8.3092 123.9413 54.7938 33.7069 176.2659 *160 W 4.5336 8.2692 122.3451 56.9540 30.1857 175.8964 *161 T 4.2236 8.1692 113.4658 60.7510 69.8843 172.6159 *162 P 4.2936 0.0000 0.0000 62.5832 32.7681 177.1435 *163 S 4.3208 8.2276 114.8245 57.8380 64.1826 173.4736 *164 A 4.1825 8.2592 126.0288 52.6772 19.8962 177.6765 *165 R 4.1483 8.2492 118.6113 56.7434 31.4568 176.2456 *166 S 4.3436 8.3292 117.1486 58.7809 64.2683 174.1705 *167 M 4.3536 8.2992 121.2400 55.2483 33.0950 176.0964 *168 T 4.2236 8.1692 113.8007 60.7510 70.6198 172.6159 *169 P 4.2936 0.0000 0.0000 62.0017 32.7681 175.2159 *170 P 4.2936 0.0000 0.0000 62.5053 32.6553 176.8087 *171 E 4.2513 8.3859 114.8576 55.6523 31.6147 175.8616 *172 G 3.7995 8.3492 110.6917 46.0593 0.0000 174.7765 *173 R 4.1496 8.1959 118.5680 55.9559 31.4012 175.5281 *174 G 3.7995 8.3492 109.7858 46.0978 0.0000 174.2930 *175 D 4.3991 8.2576 118.6708 52.9523 41.8091 175.1400 *176 A 4.1825 8.2592 124.8491 52.6545 20.1555 177.3087 *177 E 4.1860 8.3859 113.9860 55.6523 31.7768 175.9637 *178 G 3.7995 8.3492 110.6917 46.3124 0.0000 174.6964 *179 T 4.1319 8.1692 114.7191 61.2752 70.4635 174.3904 *180 I 4.0436 8.0192 122.0830 60.3363 37.4766 175.9087 *181 E 4.2236 8.4392 119.2327 55.8584 31.5327 174.5159 *182 P 4.3213 0.0000 0.0000 61.7956 32.8071 176.5616 *183 G 3.7995 8.3492 110.1464 46.0978 0.0000 174.2930 *184 D 4.4496 8.3059 119.0497 52.9569 41.8091 175.5281 *185 G 3.7995 8.3492 111.0034 46.2217 0.0000 174.1690 *186 Y 4.3319 8.1392 120.9535 57.2763 38.8691 175.9385 *187 V 3.9936 8.0492 119.8476 61.0025 33.7134 175.9994 *188 W 4.5336 8.2692 123.2725 56.6782 30.1079 175.6087 *189 E 4.2236 8.4392 117.3011 56.5471 31.1420 175.8690 *190 Y 4.4236 8.1392 120.1080 57.1792 38.9144 175.5508 *191 L 4.2136 8.1792 122.7058 54.7107 42.9991 177.2724 *192 F 4.4936 8.3192 119.7865 57.1250 39.9206 175.3087 *193 E 4.2236 8.4392 119.4900 56.3827 31.5014 176.3239 *194 I 4.0436 8.0192 119.5050 59.8327 37.5155 174.3159 *195 P 4.2936 0.0000 0.0000 62.0017 32.5733 175.2159 *196 P 4.2936 0.0000 0.0000 62.5665 32.6553 176.6930 *197 D 4.5136 8.3592 119.9646 53.6989 41.7026 176.3721 *198 V 3.9936 8.0492 119.1754 61.3151 33.6081 176.1435 *199 S 4.3436 8.3292 119.0421 58.5729 64.1127 174.3239 *200 I 4.0436 8.0192 120.9963 60.3694 37.1943 175.8094 *201 N 4.6136 8.4192 120.2689 52.7716 39.4152 175.0765 *202 R 4.2136 8.2492 119.4258 56.8310 31.4753 175.7530 *203 C 4.4236 8.3392 117.6730 58.5127 29.8835 174.3964 *204 T 4.2236 8.1692 114.7073 61.2876 70.0306 174.1094 *205 N 4.6136 8.4192 121.3231 52.7489 39.6100 174.7087 *206 E 4.2236 8.4392 117.1063 56.5471 31.7953 175.8690 *207 Y 4.4236 8.1392 120.1080 57.2646 38.9144 175.6239 *208 I 4.0436 8.0192 120.4889 60.3686 37.5589 176.4720 *209 V 3.9936 8.0492 120.3876 61.2696 33.4362 176.3721 *210 V 3.9936 8.0492 119.8512 60.7337 33.4484 174.2159 *211 P 4.2936 0.0000 0.0000 62.2706 32.5854 176.9994 *212 W 4.5336 8.2692 121.7396 56.1746 30.1778 174.0159 *213 P 4.2936 0.0000 0.0000 62.5053 32.1825 176.8087 *214 E 4.2236 8.4392 117.1635 56.3620 31.6147 176.1087 *215 E 4.2236 8.4392 117.7088 56.2973 31.7665 176.2508 *216 L 4.2136 8.1792 121.7219 54.6150 42.9557 177.4101 *217 K 4.1936 8.3092 122.9193 55.0285 33.6267 176.1087 *218 E 4.2236 8.4392 117.7690 56.4232 31.6226 175.9930 *219 D 4.5136 8.3592 120.5100 53.1630 41.8544 174.2159 *220 P 4.2936 0.0000 0.0000 62.7811 32.7452 177.0964 *221 T 4.2236 8.1692 113.3282 61.2772 70.3570 174.5765 *222 R 4.2136 8.2492 122.6063 56.4309 31.4076 175.9994 *223 W 4.5613 8.2159 119.0732 55.9685 30.2635 175.3616 *224 G 3.7995 8.3492 110.2840 46.2217 0.0000 174.1690 *225 Y 4.3319 8.1392 120.9535 57.2439 38.8691 175.3751 *226 E 4.2236 8.4392 118.6928 56.4232 31.8099 175.9930 *227 D 4.5136 8.3592 120.5100 53.6996 41.8544 175.7094 *228 N 4.6136 8.4192 119.0567 52.6842 39.5871 174.8508 *229 L 4.2136 8.1792 121.1194 54.9946 42.9845 177.3964 *230 T 4.2236 8.1692 113.6971 61.0198 70.3833 174.3994 *231 W 4.5336 8.2692 124.8630 56.7410 30.2907 175.7786 *232 Q 4.2136 8.3392 119.6664 55.5211 29.5342 175.6786 *233 Q 4.2136 8.3392 119.1985 55.5195 30.1337 175.3930 *234 D 4.5136 8.3592 119.6343 53.7277 41.8294 175.6930 *235 D 4.5136 8.3592 120.8217 53.6585 41.7925 175.9724 *236 F 4.5213 8.2659 117.9689 56.4154 39.9841 175.0616 *237 G 3.7995 8.3492 112.4729 45.9719 0.0000 174.5508 *238 L 4.1219 8.1792 122.5674 54.7394 42.9104 177.2904 *239 I 4.0436 8.0192 119.3284 60.5214 37.3901 175.6690 *240 Y 4.4236 8.1392 121.6318 57.2666 38.6806 175.7765 *241 R 4.2136 8.2492 121.0122 56.6979 31.4899 176.3721 *242 V 3.9936 8.0492 117.9578 61.1335 33.6039 176.1101 *243 K 4.1708 8.2076 121.3986 54.3143 33.5305 175.4736 *244 A 4.1825 8.2592 124.5975 52.6876 20.0735 177.2094 *245 N 4.5483 8.4192 117.3280 53.0247 39.6593 175.0985 *246 T 4.2236 8.1692 113.2711 61.2752 70.5375 174.4239 *247 I 4.0436 8.0192 122.0830 60.3590 37.4766 176.2765 *248 R 4.2136 8.2492 121.5521 56.6576 31.2127 175.9724 *249 F 4.4936 8.3192 119.0571 57.0213 39.9799 175.6101 *250 K 4.1708 8.2076 122.1922 54.3143 33.4871 175.4736 *251 A 4.1825 8.2592 124.5975 52.8396 20.0735 177.0690 *252 Y 4.3583 8.1392 118.6910 57.1792 38.9247 175.6529 *253 L 4.2136 8.1792 122.7058 54.7799 42.9991 176.9930 *254 D 4.5136 8.3592 120.3334 53.7444 41.7289 176.1435 *255 S 4.3436 8.3292 118.3663 58.5846 64.2725 174.6721 *256 V 3.9936 8.0492 120.3550 61.4223 33.3488 175.5690 *257 Y 4.4236 8.1392 121.0955 57.2359 38.6927 175.5724 *258 F 4.4936 8.3192 120.9470 56.6214 40.0894 173.7159 *259 P 4.2936 0.0000 0.0000 62.5053 32.5420 176.8087 *260 E 4.2008 8.3376 114.4788 55.6478 31.6147 175.4736 *261 A 4.1597 8.1576 121.8528 51.9403 20.2174 176.6736 *262 A 4.1172 8.2592 123.1204 52.5898 20.2277 177.5529 *263 L 4.1483 8.1792 120.3049 54.2152 42.9660 175.6180 *264 P 4.3213 0.0000 0.0000 61.7956 32.6816 176.5616 *265 G 3.7995 8.3492 110.1464 46.0697 0.0000 174.3094 *266 N 4.5219 8.4192 119.5906 52.6452 39.6037 174.9766 *267 K 4.2213 8.2559 120.1874 54.3189 33.7809 175.8616 *268 G 3.7995 8.3492 110.7519 46.0286 0.0000 174.5724 *269 F 4.4019 8.3192 120.8086 57.1477 40.0007 175.6429 *270 R 4.2136 8.2492 121.8094 56.7284 31.1814 175.9786 *271 Q 4.2136 8.3392 119.1682 55.4790 30.0926 175.7239 *272 I 4.0436 8.0192 118.6293 60.4141 37.4905 176.2435 *273 S 4.3436 8.3292 119.5784 58.5729 64.1006 174.3239 *274 I 4.0436 8.0192 120.9963 60.3569 37.1943 176.1239 *275 I 4.0436 8.0192 121.0288 60.6121 37.2817 176.1964 *276 T 4.2236 8.1692 115.3974 61.2876 70.2750 174.1094 *277 N 4.6136 8.4192 121.3231 52.2453 39.6100 173.1159 *278 P 4.2936 0.0000 0.0000 62.4406 32.8358 176.9508 *279 L 4.2136 8.1792 121.1765 54.7188 42.8039 177.1087 *280 E 4.2008 8.3376 114.8476 55.6478 31.6411 175.4736 *281 A 4.1825 8.2592 124.5374 52.5508 20.2174 177.6101 *282 K 4.1054 8.2076 118.9941 54.3143 33.7625 175.5757 *283 A 4.1825 8.2592 124.5975 52.9455 20.0735 177.1800 *284 H 4.5383 8.4392 116.9124 54.4826 30.0265 172.1180 *285 P 4.2936 0.0000 0.0000 62.5384 32.5750 176.7094 *286 N 4.6136 8.4192 118.1997 52.8101 39.4972 174.5930 *287 D 4.5136 8.3592 119.9075 53.1630 41.8832 174.2159 *288 P 4.2936 0.0000 0.0000 62.5384 32.7452 176.7094 *289 N 4.6136 8.4192 118.1997 52.7813 39.4972 175.2720 *290 V 3.9936 8.0492 118.2612 61.1335 33.6988 176.1101 *291 K 4.1708 8.2076 121.3986 54.3143 33.5305 175.4736 *292 A 4.1825 8.2592 124.5975 52.6545 20.0735 177.3087 *293 E 4.1583 8.4392 116.2918 56.2583 31.7768 176.5122 *294 K 4.1936 8.3092 123.0958 55.0897 33.7522 175.9930 *295 D 4.5136 8.3592 120.5701 53.8517 41.7105 175.5690 *296 Y 4.4236 8.1392 120.4197 57.4290 38.8525 175.1690 *297 Y 4.4236 8.1392 121.0919 57.3051 38.9577 175.2930 *298 D 4.5136 8.3592 121.4939 53.1630 41.8978 174.2159 *299 P 4.2936 0.0000 0.0000 62.5053 32.7452 176.8087 *300 E 4.2236 8.4392 117.1635 56.4232 31.6147 175.9930 *301 D 4.5136 8.3592 120.5100 53.6018 41.8544 175.9508 *302 L 4.2136 8.1792 122.0336 54.9475 42.8938 177.1705 *303 M 4.3536 8.2992 119.5721 54.9952 33.2907 176.1765 *304 R 4.2136 8.2492 119.9554 56.9566 31.5576 175.6800 *305 H 4.6036 8.4392 117.4235 55.0640 29.9501 173.9435 *306 S 4.3713 8.2759 116.3459 57.8426 64.1023 173.8616 *307 G 3.7995 8.3492 112.1831 46.0366 0.0000 174.4087 *308 E 4.1319 8.4392 118.5544 56.5907 31.7212 176.1369 *309 M 4.3536 8.2992 119.7486 54.9932 33.4162 176.0239 *310 I 4.0436 8.0192 119.4321 60.5214 37.6266 175.6690 *311 Y 4.4236 8.1392 121.6318 57.4727 38.6806 175.4705 *312 M 4.3536 8.2992 120.7326 54.9725 33.4595 175.8087 *313 E 4.2236 8.4392 117.6359 56.3951 31.8776 176.0094 *314 N 4.6136 8.4192 118.7450 52.7716 39.6490 175.0765 *315 R 4.2136 8.2492 119.4258 56.1620 31.4753 174.2159 *316 P 4.2936 0.0000 0.0000 62.0017 32.7409 175.2159 *317 P 4.2936 0.0000 0.0000 62.5260 32.6553 177.0239 *318 I 4.0436 8.0192 118.9596 60.3569 37.3637 176.1239 *319 I 4.0436 8.0192 121.0288 60.5650 37.2817 175.9705 *320 M 4.3308 8.1976 118.5878 54.2583 33.1824 175.1736 *321 A 4.1825 8.2592 124.4645 52.8833 20.3285 177.3705 *322 M 4.2883 8.2992 118.3316 55.0337 33.4265 175.7951 *323 D 4.5136 8.3592 120.4371 53.7294 41.9655 175.9786 *324 Q 4.2136 8.3392 120.3858 55.7341 30.0968 175.7964 *325 T 4.2236 8.1692 112.9979 61.2545 70.4838 174.2087 *326 E 4.2236 8.4392 120.2869 56.3620 31.7276 176.1087 *327 E 4.2236 8.4392 117.7088 56.3827 31.7665 176.3239 *328 I 4.0436 8.0192 119.5050 60.3694 37.5155 175.8094 *329 N 4.6136 8.4192 120.2689 52.7696 39.4152 174.9239 *330 I 4.0436 8.0192 118.9024 60.2715 37.5443 176.0508 *331 L 4.2136 8.1792 123.2457 54.7107 42.7219 177.2724 *332 F 4.4936 8.3192 119.7865 57.4008 39.9206 175.5964 *333 T 4.2236 8.1692 115.6547 61.2465 70.2437 174.3724 *334 F 4.4936 8.3192 122.5411 56.9887 38.7257 174.6053 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ *7 I 8.12 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 1.21 0.91 0.00 0.00 *8 Y 8.11 4.24 0.00 2.15 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 *9 R 8.52 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 *10 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 *11 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 *12 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 *13 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 *14 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 *15 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 *16 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 *17 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 *18 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 *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 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 *21 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 *22 L 8.18 4.21 0.00 1.40 1.51 0.92 0.96 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 *23 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 *24 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 *25 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 *26 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 *27 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 *28 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 *29 G 8.35 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *30 S 8.28 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 *31 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 *32 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 *33 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 *34 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 *35 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 *36 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 *37 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 *38 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 *39 I 8.02 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.91 0.00 0.00 *40 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 *41 F 8.27 4.52 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 *42 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 *43 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 *44 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 *45 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 *46 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 *47 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 *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 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 *50 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *51 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 *52 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *53 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 *54 V 8.00 4.02 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 *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 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 *57 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 *58 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 *59 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 *60 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 *61 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 *62 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 *63 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 *64 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 *65 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 *66 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 *67 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 *68 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 *69 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 *70 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 *71 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 *72 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 *73 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 *74 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 *75 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 *76 M 8.25 4.38 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 2.61 0.00 *77 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 *78 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 *79 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 *80 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 *81 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 *82 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 *83 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 *84 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 *85 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 *86 L 8.18 4.21 0.00 1.40 1.51 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 *87 D 8.26 4.49 0.00 2.44 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *88 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 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0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.08 0.00 *163 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 *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 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 *166 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 *167 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 *168 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 *169 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 *170 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 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*179 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 *180 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 *181 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 *182 P 0.00 4.32 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 *183 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 *184 D 8.31 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 *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 Y 8.14 4.33 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 *187 V 8.05 3.99 2.08 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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 *196 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 *197 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 *198 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 *199 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 *200 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 *201 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *202 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 *203 C 8.34 4.42 0.00 2.69 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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*220 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 *221 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 *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 W 8.22 4.56 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 *224 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 *225 Y 8.14 4.33 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 *226 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 *227 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 *228 N 8.42 4.61 0.00 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0.00 0.00 0.00 0.00 0.00 *253 L 8.18 4.21 0.00 1.40 1.51 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 *254 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 *255 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 *256 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 *257 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 *258 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 *259 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 *260 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 *261 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 *262 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 *263 L 8.18 4.15 0.00 1.42 1.50 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 *264 P 0.00 4.32 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 *265 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 *266 N 8.42 4.52 0.00 2.50 2.64 0.00 0.00 6.76 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *267 K 8.26 4.22 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 *268 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 *269 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 *270 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 *271 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 *272 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 *273 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 *274 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 *275 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 *276 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 *277 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 *278 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 *279 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 *280 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 *281 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 *282 K 8.21 4.11 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 *283 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 *284 H 8.44 4.54 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 *285 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 *286 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 *287 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 *288 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 *289 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *290 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 *291 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 *292 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 *293 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 *294 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 *295 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 *296 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 *297 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 *298 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 *299 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 *300 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 *301 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 *302 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 *303 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 *304 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 *305 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 *306 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 *307 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 *308 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 *309 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 *310 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 *311 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 *312 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 *313 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 *314 N 8.42 4.61 0.00 2.48 2.66 0.00 0.00 6.76 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *315 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 *316 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 *317 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 *318 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 *319 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 *320 M 8.20 4.33 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 2.61 0.00 *321 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 *322 M 8.30 4.29 0.00 1.80 1.89 0.00 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 *323 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 *324 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 *325 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 *326 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 *327 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 *328 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 *329 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 *330 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 *331 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 *332 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 *333 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 *334 F 8.32 4.49 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.