NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 K 4.3507 8.2993 122.1415 54.0514 33.4868 175.4261 1 D 4.4236 8.5389 123.3530 51.6690 40.0944 174.7061 2 I 3.7755 9.0989 124.3541 61.8611 38.5104 176.5309 3 Q 4.6133 8.6083 124.0002 55.0005 30.6930 174.2732 4 M 4.8677 8.6673 122.6763 53.8572 34.1052 175.2642 5 T 4.5218 8.5082 119.4994 61.8506 71.5261 173.6810 6 Q 4.8660 8.4759 126.2669 53.6843 27.6825 175.2473 7 T 3.8998 8.3458 113.1428 64.6751 69.0428 175.6652 8 T 4.1959 7.7251 116.4290 60.1019 67.7890 174.3647 9 S 4.4024 8.5367 122.7696 60.5668 63.7543 173.6262 10 S 4.8339 7.3111 113.1248 57.8155 64.9865 173.8437 11 L 4.6000 8.3191 121.9750 55.1298 43.6309 173.4143 12 S 5.1157 8.3368 114.1494 56.9019 66.2441 173.0799 13 A 4.3465 8.2563 118.2578 51.0755 21.6277 176.4673 14 S 4.2814 8.3612 119.4621 58.6855 63.8336 174.3252 15 L 4.0978 8.3100 120.4990 55.6708 42.1511 178.0837 16 G 3.8622 8.6059 109.2996 45.6452 0.0000 173.2791 17 D 4.6537 7.5744 119.1046 53.2744 43.2802 175.7659 18 R 4.6297 8.2419 121.8603 54.9148 29.7521 175.4371 19 V 3.8495 8.0240 125.7125 62.5760 33.2275 174.6398 20 T 4.7545 8.1056 121.9372 61.7938 71.8754 173.1444 21 V 4.3629 8.5570 127.5071 60.9472 33.6800 174.3103 22 S 5.2338 8.7873 122.3467 56.8643 64.5047 174.0117 23 C 4.9008 8.9570 123.4433 55.2888 41.2374 172.3113 24 R 5.1433 8.1595 114.5117 56.0877 32.7089 173.7075 25 A 4.7091 8.9087 129.0035 51.6793 19.6806 176.6695 26 S 4.8363 8.0009 111.0193 57.1132 63.8955 174.3342 27 Q 4.8131 8.3761 120.5903 57.1960 29.7821 172.4634 28 D 4.4442 7.9057 122.0161 53.6472 40.4949 175.8053 29 I 4.1008 8.1766 120.2207 59.6568 38.8597 175.8333 30 R 3.7014 9.0775 117.7050 57.6490 28.2675 177.3204 31 N 5.0376 8.5078 114.5555 55.4347 39.1280 175.0500 32 Y 4.1425 7.3940 116.2010 57.6419 35.0866 174.4865 33 L 4.6608 7.1135 122.7406 53.1414 46.3916 174.4325 34 N 5.2936 8.7741 121.0550 51.3455 43.6478 173.1749 35 W 5.1570 9.0956 120.4070 55.2891 32.7294 174.4260 36 Y 5.2457 9.3720 120.1864 56.2916 41.9976 174.0525 37 Q 4.1789 8.7384 123.5220 54.3008 31.7169 174.1955 38 Q 4.5893 8.7992 129.0288 53.5450 29.6107 174.9771 39 K 4.0650 8.4809 125.9189 55.9578 32.4873 175.5647 40 P 4.3951 0.0000 0.0000 65.7962 31.8882 178.4545 41 D 4.5802 8.1228 119.0892 55.3407 38.2294 176.2560 42 G 4.2433 8.0435 102.4431 47.4541 0.0000 172.8577 43 T 4.5588 7.8174 115.8724 61.0784 69.9141 173.3365 44 V 4.3787 7.9826 121.5327 61.2888 34.1454 174.1096 45 K 4.6410 8.7034 127.6092 54.6156 34.7227 175.1453 46 F 5.0569 8.9078 126.8193 58.0688 39.8706 173.9309 47 L 4.3459 8.5609 125.4678 55.7654 43.3034 176.1473 48 I 5.0103 7.2731 118.4531 59.4453 41.3037 173.4857 49 Y 5.2306 8.2763 123.2256 55.4287 41.3859 174.4672 50 Y 3.3859 10.0743 119.4446 58.2399 37.9479 170.1926 51 T 3.8534 9.0349 124.8184 63.9052 67.8847 174.4233 52 S 4.6488 7.5258 109.7035 57.3263 64.7862 173.7539 53 R 3.9920 7.5131 122.5928 56.0293 30.6148 175.6984 54 L 4.5437 8.3311 124.6639 53.8197 42.7862 176.7886 55 Q 4.2788 8.9725 125.7984 55.1951 30.2616 173.9639 56 P 4.3970 0.0000 0.0000 64.2151 32.0531 174.7435 57 G 4.1190 9.0336 109.6392 46.0662 0.0000 174.7604 58 V 3.3137 6.9958 118.6700 61.7457 32.0281 173.8098 59 P 4.3209 0.0000 0.0000 62.8818 31.4934 177.6172 60 S 4.0212 8.7155 118.6839 60.9938 63.3257 175.3104 61 R 4.2080 8.1505 116.2843 56.6670 29.5066 175.8122 62 F 5.0568 8.3270 118.6903 56.0880 41.5125 175.0045 63 S 5.3135 7.8477 120.3944 58.7309 64.1792 176.9270 64 G 4.6305 8.3224 110.4979 44.5856 0.0000 172.0079 65 S 4.6204 8.7808 115.3660 57.5664 68.3197 172.9543 66 G 3.7473 8.7409 105.5235 45.7964 0.0000 172.9064 67 S 4.7252 7.5667 113.1136 59.3182 65.5208 176.3605 68 G 4.0634 8.3733 114.4963 45.0524 0.0000 174.3822 69 T 4.7461 8.5457 113.0940 61.0883 69.8497 171.8817 70 D 4.5667 7.5864 122.4361 53.5931 43.2232 173.8467 71 Y 4.9641 8.3323 117.7598 56.4552 41.5241 174.7469 72 S 5.2492 8.7881 113.6198 57.5617 66.9171 173.6031 73 L 4.0227 7.4871 125.8425 54.3396 43.4489 175.4283 74 T 4.5999 7.9866 121.4841 62.0739 71.6888 174.2704 75 I 3.8273 8.5239 129.1884 58.9640 37.0186 174.5745 76 N 4.0681 8.5820 123.5044 54.8638 39.3274 175.9735 77 N 3.9200 8.6984 112.6184 53.2696 35.8193 173.3652 78 L 3.9809 9.1094 133.1296 56.2883 43.3488 175.9114 79 E 4.9105 8.9116 120.0459 54.9607 33.4896 176.9016 80 Q 3.8158 8.6637 124.4761 59.1739 29.6211 177.8586 81 E 4.3961 8.0160 114.1020 56.9508 30.0578 176.4123 82 D 5.0791 8.1527 118.8533 54.8492 43.1143 176.7850 83 I 3.8329 7.3068 118.8074 61.4316 37.9015 176.1977 84 G 4.0163 6.9557 108.8730 44.5716 0.0000 171.3441 85 T 4.9528 8.1190 116.9613 61.9996 71.0176 173.4329 86 Y 5.1612 8.9124 124.5019 57.0863 40.0148 175.0279 87 F 5.2840 9.7670 122.6631 56.0985 42.7293 172.6712 88 C 5.0770 8.6525 113.9406 53.6762 44.5667 172.0615 89 Q 4.6374 8.6643 127.1485 55.2424 30.2446 175.3188 90 Q 4.2643 8.2120 125.1590 55.4941 30.6482 176.2274 91 G 3.0159 7.9803 103.4042 45.6134 0.0000 175.1128 92 N 4.0449 8.7545 119.9513 54.8461 39.4317 175.3133 93 T 4.5091 7.4976 120.1392 60.5807 69.8646 172.3573 94 P 4.2062 0.0000 0.0000 61.5937 31.6661 174.5035 95 P 4.0522 0.0000 0.0000 62.0723 32.0150 176.3246 96 W 4.8166 7.5328 121.4998 57.6283 30.0423 175.5985 97 T 4.9165 8.2519 111.9705 60.5533 71.6304 173.5027 98 F 5.0336 8.9220 125.1593 56.1562 40.7950 176.8813 99 G 4.1205 8.6815 110.7749 46.7805 0.0000 175.3757 100 G 4.1413 9.0152 110.6563 44.4096 0.0000 172.5315 101 G 3.9312 7.6838 107.1938 45.7854 0.0000 174.1043 102 T 4.7268 7.7787 118.0253 59.1319 69.0415 171.2812 103 K 3.8319 8.3169 124.4608 56.9908 33.6495 174.3631 104 L 4.9829 9.3520 130.7585 53.3958 43.3754 174.0569 105 E 4.9895 8.8413 126.6764 56.2986 32.6822 179.3540 106 I 4.2259 8.8092 129.1812 61.9303 38.9228 174.0504 107 K 4.0975 8.3349 128.3648 53.8761 32.8069 175.7339 108 R 4.2589 8.2239 120.1447 55.2777 30.5827 177.1293 *109 G 3.8828 8.3823 103.8243 47.4350 0.0000 173.9706 *1001 E 4.2912 8.2377 118.5596 57.2752 31.0242 175.6988 1002 V 3.6865 10.3385 117.0770 62.9021 28.6919 172.9781 1003 Q 3.2473 7.1637 115.6713 54.3740 29.0331 174.9125 1004 L 4.5151 7.1299 126.8334 53.7543 42.6949 176.1008 1005 Q 4.3771 8.2336 127.1657 54.4487 30.7343 175.4762 1006 Q 5.0386 8.6413 126.2053 54.2702 30.7770 175.5522 1007 S 4.4325 8.3259 114.5900 58.3236 64.8359 173.2807 1008 G 4.3052 7.7071 106.9194 43.9046 0.0000 172.0574 1009 P 4.5498 0.0000 0.0000 63.1733 31.4171 175.6432 1010 E 4.7099 8.5643 122.6550 54.7924 32.5512 175.1087 1011 L 4.9776 8.1790 123.0049 53.2586 44.5940 175.2223 1012 V 4.5351 8.3350 125.5094 60.6560 35.7034 173.8768 1013 K 4.2075 8.5332 126.0455 55.1687 33.4699 172.7672 1014 P 4.1901 0.0000 0.0000 66.3878 30.4676 174.7611 1015 G 3.6087 7.4101 110.7986 44.7837 0.0000 171.8568 1016 A 4.8307 7.9074 122.2037 50.1183 22.3331 176.4691 1017 S 4.9521 8.2601 114.8046 57.3234 65.3689 173.6430 1018 V 4.6165 7.8769 113.0629 60.0198 36.4649 174.4458 1019 K 5.5546 8.2664 122.6489 53.5561 33.1969 175.4540 1020 I 4.2721 7.9712 127.0126 60.7286 38.9756 174.7462 1021 S 5.0252 8.6006 118.8221 56.7379 66.2432 172.9443 1022 C 4.6026 9.3037 125.1678 55.0616 40.3557 172.1946 1023 K 4.6415 8.6856 128.8955 53.9916 32.2590 173.3387 1024 D 4.6861 8.2261 123.5763 53.9799 41.8208 175.5592 1025 S 4.4633 8.8479 118.9634 58.3463 64.9848 175.6657 1026 G 3.8725 8.4205 110.1849 45.7003 0.0000 172.0007 1027 Y 4.6979 8.3923 114.5967 58.7769 39.8565 176.4252 1028 A 4.5866 7.8496 122.9508 50.0299 17.4228 175.3622 1029 F 4.6685 7.9075 123.0790 59.7344 41.1948 177.0770 1030 N 4.3052 8.1625 114.3445 53.8644 38.1993 176.1087 1031 S 5.0265 7.7275 110.5215 56.5894 63.8273 173.3326 1032 S 4.7586 8.3227 116.7924 56.9934 67.0843 175.3449 1033 W 4.8335 8.5844 123.2141 58.7500 28.8855 175.3678 1034 M 4.4025 8.2516 115.7577 56.2978 34.1584 174.6698 1035 N 5.6107 9.0763 124.4064 51.9476 41.4426 174.4867 1036 W 4.5758 8.8528 121.5932 55.0739 32.0327 174.7333 1037 V 4.7008 8.2934 125.6455 61.3472 33.5105 174.7910 1038 K 4.4312 8.9174 128.7081 54.7968 33.7690 174.0293 1039 Q 4.6973 8.2826 128.9716 54.6615 31.0366 174.5788 1040 R 5.0063 8.4754 121.9224 53.7429 33.0865 172.4550 1041 P 4.3311 0.0000 0.0000 64.7977 31.3414 175.7128 1042 G 4.0885 9.2189 110.5495 45.2717 0.0000 173.8335 1043 Q 4.4483 7.8665 119.3833 59.6731 28.8761 178.4216 1044 G 3.3645 7.5720 101.7689 44.2192 0.0000 174.6399 1045 L 4.6377 8.4233 117.3629 53.3736 47.4246 174.9978 1046 E 5.1668 8.6065 120.1907 54.2973 33.0207 174.8993 1047 W 4.8277 9.3930 135.0000 57.8461 31.3172 175.5599 1048 I 4.2666 8.4951 128.9806 62.2139 37.7774 176.3014 1049 G 2.7428 6.0227 107.2140 46.9522 0.0000 171.3112 1050 R 5.6122 6.9835 112.9659 56.7252 31.9554 173.6446 1051 I 5.1956 8.3569 119.3990 59.8751 42.4615 173.2710 1052 Y 4.5914 8.6656 129.0705 55.1424 38.1102 174.7780 1052A P 3.9760 0.0000 0.0000 65.0309 31.7744 178.0490 1053 G 3.7988 7.1250 104.9776 47.5725 0.0000 173.3701 1054 D 4.4890 8.3148 115.1194 53.8563 43.5333 175.8539 1055 G 3.9552 8.2548 104.5192 45.0056 0.0000 173.5844 1056 D 4.8623 9.6913 122.5711 54.5519 41.9567 175.6035 1057 S 5.4994 8.6614 115.0441 57.3583 66.4931 172.8085 1058 N 5.3906 9.7026 118.0946 51.9749 42.4886 173.1157 1059 Y 4.8656 8.7843 118.4501 56.1799 41.7708 174.0544 1060 N 4.8293 8.5742 118.9381 52.1900 40.8041 176.2381 1061 G 3.6256 8.7221 112.7621 48.6097 0.0000 175.9727 1062 K 3.8269 8.0805 120.3189 58.2358 32.5327 177.3396 1063 F 5.1587 7.4798 115.2670 57.1578 39.2752 176.8664 1064 E 3.9420 8.0994 124.1092 58.9541 29.7858 178.1357 1065 G 4.1049 7.5892 105.7247 43.0107 0.0000 170.6347 1066 K 4.7160 7.3096 124.3274 57.4945 40.3500 175.6369 1067 A 4.5652 7.8230 121.6043 51.6392 20.2110 177.0723 1068 I 4.5522 7.9329 119.7189 59.6770 40.2952 173.7444 1069 L 4.4886 9.1936 127.9724 54.6863 42.1376 176.7041 1070 T 4.8597 8.9515 117.8608 60.3733 71.0241 172.3176 1071 A 5.4201 8.6898 127.5274 50.5802 23.2252 175.3236 1072 D 4.7253 9.5745 119.0872 52.0690 42.5450 176.1726 1073 K 4.4339 9.3878 125.5494 58.6075 32.3906 178.9044 1074 S 4.3255 8.3585 112.4995 60.2899 63.2024 174.8093 1075 S 4.5359 8.0012 114.4548 58.0063 63.0791 174.8822 1076 S 2.0000 7.8655 111.8435 59.5723 59.5497 170.3351 1077 T 4.7994 6.6542 117.5300 61.9086 73.3801 172.7717 1078 A 5.5096 9.1508 126.5601 50.7399 23.0849 174.7529 1079 Y 5.7302 9.2126 115.9204 56.4196 42.8508 174.2907 1080 M 4.2180 7.9194 122.2697 53.5013 35.3065 174.4414 1081 Q 5.3815 7.2426 119.9750 53.0162 28.6917 173.6287 1082 L 4.2011 7.7459 120.4930 55.1067 42.4240 176.6190 1082A S 4.4860 8.6052 118.5142 57.4829 64.3912 173.8847 1082B S 3.5630 8.5951 117.3264 59.0689 59.4068 171.1829 1082C L 4.7284 8.1383 122.9608 53.5990 42.9695 175.9608 1083 T 4.8933 8.0179 108.8138 60.2199 71.4528 174.7375 1084 S 4.3134 8.6032 115.9160 60.1874 62.0317 175.6081 1085 V 3.8754 8.1467 122.1574 65.8716 31.6856 177.7872 1086 D 4.5824 8.1794 119.3072 56.9115 40.7667 174.3429 1087 S 5.1439 7.3422 115.0019 58.8845 63.2372 173.4525 1088 A 4.4687 8.3046 125.6067 51.6003 22.8126 174.6735 1089 V 4.5358 8.3265 117.4503 62.2695 34.1670 175.4867 1090 Y 4.7676 8.0911 120.7221 56.5981 40.7230 175.1086 1091 F 4.4954 9.3012 124.0802 56.9496 40.9624 172.8082 1092 C 4.6461 8.2450 114.7974 53.1267 42.1900 170.7912 1093 A 4.9835 7.8079 127.4677 51.1040 19.5829 176.3326 1094 R 4.5595 8.4621 120.0802 55.2090 31.6764 175.6283 1095 S 4.8785 8.3520 118.4731 56.0109 64.0439 173.3034 1096 G 3.9963 8.2095 111.2587 44.2284 0.0000 169.5200 1097 L 3.4566 9.4202 128.9551 55.1729 38.1571 172.2686 1098 L 4.0041 8.2920 122.0302 53.8467 39.6164 174.4690 1099 R 3.8009 8.3071 120.4361 58.6851 29.2647 177.6716 1100 Y 3.9815 6.7735 114.3841 55.3228 38.8072 175.1309 1100A A 4.3591 7.3395 122.2408 52.2929 22.4615 176.0927 1100B M 4.3395 8.4565 124.2664 54.1119 32.6914 175.8731 1101 D 4.4613 8.2414 124.4642 54.4388 40.8337 176.1915 1102 Y 5.2480 7.9485 120.7348 55.4208 41.3106 174.5090 1103 W 4.9976 9.4052 125.8043 54.7245 32.0853 178.1065 1104 G 3.9520 7.9602 110.0095 46.4500 0.0000 172.6069 1105 Q 4.4930 8.9112 116.4344 57.0144 30.2577 174.6329 1106 G 3.3785 7.4298 102.1859 44.3901 0.0000 174.6708 1107 T 4.4645 7.8610 113.4788 61.8716 70.2664 171.0803 1108 S 3.9609 7.8137 118.2340 57.8618 63.5781 172.8342 1109 V 4.6667 8.7248 129.8128 60.9056 30.0169 174.0367 1110 T 4.5074 7.8620 118.9807 61.1630 69.3575 172.9144 1111 V 4.6649 8.1724 127.6594 61.0380 33.7322 176.0453 1112 S 4.4826 8.4117 126.3054 58.8490 64.6411 175.3266 1113 S 4.4119 8.4662 115.4624 58.6061 62.3058 169.6663 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 0 K 8.30 4.35 0.00 1.79 1.67 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 1 D 8.54 4.42 0.00 2.92 2.75 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 0.00 0.00 0.00 0.00 2 I 9.10 3.78 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.55 0.91 0.00 0.00 3 Q 8.61 4.61 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.88 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 4 M 8.67 4.87 0.00 1.87 2.13 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.47 0.00 5 T 8.51 4.52 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 6 Q 8.48 4.87 0.00 1.92 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.86 0.00 0.00 0.00 0.00 0.00 2.50 2.35 0.00 7 T 8.35 3.90 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 8 T 7.73 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 9 S 8.54 4.40 0.00 4.03 4.16 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.31 4.83 0.00 3.85 3.72 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 0.00 0.00 0.00 0.00 11 L 8.32 4.60 0.00 1.72 1.67 0.89 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.34 5.12 0.00 3.94 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.26 4.35 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.36 4.28 0.00 3.84 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.31 4.10 0.00 1.52 1.59 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.61 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 D 7.57 4.65 0.00 2.62 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.24 4.63 0.00 1.73 1.78 0.00 3.16 0.00 0.00 3.07 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.68 0.00 19 V 8.02 3.85 1.83 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 0.69 0.00 0.00 0.82 0.00 0.00 20 T 8.11 4.75 4.13 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 1.10 0.00 0.00 21 V 8.56 4.36 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.53 0.00 0.00 22 S 8.79 5.23 0.00 3.96 3.84 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.96 4.90 0.00 2.99 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.16 5.14 0.00 1.85 1.87 0.00 3.22 0.00 0.00 3.29 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.34 0.00 25 A 8.91 4.71 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.00 4.84 0.00 3.87 4.09 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.38 4.81 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.71 0.00 0.00 0.00 0.00 0.00 2.08 2.10 0.00 28 D 7.91 4.44 0.00 2.67 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.18 4.10 1.72 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.62 0.88 0.00 0.00 30 R 9.08 3.70 0.00 2.25 2.22 0.00 2.81 0.00 0.00 3.10 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 31 N 8.51 5.04 0.00 2.43 1.78 0.00 0.00 6.90 7.58 0.00 0.00 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 Y 7.39 4.14 0.00 2.76 2.37 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.11 4.66 0.00 0.82 0.68 0.39 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.77 5.29 0.00 2.49 2.86 0.00 0.00 6.71 7.28 0.00 0.00 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 W 9.10 5.16 0.00 3.21 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.37 5.25 0.00 2.90 2.71 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 37 Q 8.74 4.18 0.00 1.65 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.82 0.00 0.00 0.00 0.00 0.00 2.01 1.64 0.00 38 Q 8.80 4.59 0.00 1.87 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.49 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 39 K 8.48 4.06 0.00 1.65 1.79 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.44 7.81 40 P 0.00 4.40 0.00 2.06 2.13 0.00 3.69 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 41 D 8.12 4.58 0.00 2.93 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 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 0.00 0.00 0.00 0.00 43 T 7.82 4.56 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 44 V 7.98 4.38 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -1.42 0.00 0.00 -0.20 0.00 0.00 45 K 8.70 4.64 0.00 1.80 1.65 0.00 1.66 0.00 0.00 1.52 0.00 0.00 2.76 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.33 7.81 46 F 8.91 5.06 0.00 3.37 3.12 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 47 L 8.56 4.35 0.00 1.87 1.59 1.19 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 48 I 7.27 5.01 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.79 1.00 0.00 0.00 49 Y 8.28 5.23 0.00 3.41 3.25 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 10.07 3.39 0.00 3.16 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.03 3.85 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 52 S 7.53 4.65 0.00 3.88 3.96 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.51 3.99 0.00 0.67 1.39 0.00 3.12 0.00 0.00 3.06 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.03 0.00 54 L 8.33 4.54 0.00 1.48 1.53 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 8.97 4.28 0.00 1.77 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.98 0.00 0.00 0.00 0.00 0.00 2.44 2.33 0.00 56 P 0.00 4.40 0.00 2.21 2.05 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 57 G 9.03 4.12 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 0.00 0.00 0.00 58 V 7.00 3.31 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.72 0.00 0.00 59 P 0.00 4.32 0.00 2.35 2.18 0.00 3.23 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.93 0.00 60 S 8.72 4.02 0.00 4.01 4.07 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.15 4.21 0.00 2.00 2.22 0.00 3.20 0.00 0.00 3.37 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.81 0.00 62 F 8.33 5.06 0.00 2.88 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 S 7.85 5.31 0.00 3.91 3.98 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.32 4.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.78 4.62 0.00 3.69 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 G 8.74 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.57 4.73 0.00 3.77 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.37 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.55 4.75 4.44 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 0.00 0.00 0.00 1.27 0.00 0.00 70 D 7.59 4.57 0.00 2.47 2.51 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 79 E 8.91 4.91 0.00 2.31 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 2.24 2.25 0.00 80 Q 8.66 3.82 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 7.18 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 81 E 8.02 4.40 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 82 D 8.15 5.08 0.00 2.79 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.31 3.83 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.77 1.01 0.00 0.00 84 G 6.96 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.12 4.95 4.44 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 0.00 0.00 0.00 1.15 0.00 0.00 86 Y 8.91 5.16 0.00 3.09 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 F 9.77 5.28 0.00 3.20 3.29 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.65 5.08 0.00 1.63 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Q 8.66 4.64 0.00 0.93 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.93 0.00 0.00 0.00 0.00 0.00 1.85 1.16 0.00 90 Q 8.21 4.26 0.00 1.91 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.16 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 91 G 7.98 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.75 4.04 0.00 2.62 2.69 0.00 0.00 6.82 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 T 7.50 4.51 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 94 P 0.00 4.21 0.00 1.52 0.49 0.00 3.74 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.61 0.00 95 P 0.00 4.05 0.00 2.48 2.34 0.00 3.79 0.00 0.00 3.68 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0.00 1.57 1.50 0.99 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 1012 V 8.34 4.54 2.06 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 0.90 0.00 0.00 0.89 0.00 0.00 1013 K 8.53 4.21 0.00 1.87 1.65 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.46 7.81 1014 P 0.00 4.19 0.00 2.08 2.07 0.00 3.71 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.21 0.00 1015 G 7.41 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1016 A 7.91 4.83 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1017 S 8.26 4.95 0.00 3.74 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 1018 V 7.88 4.62 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.76 0.00 0.00 1019 K 8.27 5.55 0.00 1.65 1.67 0.00 1.48 0.00 0.00 2.19 0.00 0.00 2.20 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.40 1.42 7.81 1020 I 7.97 4.27 1.85 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.33 1.13 0.00 0.00 1021 S 8.60 5.03 0.00 3.54 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 1022 C 9.30 4.60 0.00 2.80 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1023 K 8.69 4.64 0.00 1.73 1.69 0.00 1.69 0.00 0.00 1.43 0.00 0.00 2.88 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.21 1.24 7.81 1024 D 8.23 4.69 0.00 2.89 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1025 S 8.85 4.46 0.00 3.81 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1026 G 8.42 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1027 Y 8.39 4.70 0.00 3.04 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.43 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1052A P 0.00 3.98 0.00 1.36 1.80 0.00 3.44 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 1.82 0.00 1053 G 7.12 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 1054 D 8.31 4.49 0.00 2.64 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1055 G 8.25 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1056 D 9.69 4.86 0.00 2.69 2.79 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 0.00 0.00 0.00 1057 S 8.66 5.50 0.00 4.12 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1058 N 9.70 5.39 0.00 2.83 2.87 0.00 0.00 7.03 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1059 Y 8.78 4.87 0.00 2.69 2.82 0.00 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0.00 0.00 0.00 1082B S 8.60 3.56 0.00 3.99 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1082C L 8.14 4.73 0.00 1.78 1.57 0.89 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 1083 T 8.02 4.89 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1084 S 8.60 4.31 0.00 4.02 4.06 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 0.00 0.00 0.00 0.00 1085 V 8.15 3.88 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.97 0.00 0.00 1086 D 8.18 4.58 0.00 2.84 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1087 S 7.34 5.14 0.00 3.96 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1088 A 8.30 4.47 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1089 V 8.33 4.54 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.91 0.00 0.00 1090 Y 8.09 4.77 0.00 2.85 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1091 F 9.30 4.50 0.00 2.97 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1092 C 8.24 4.65 0.00 1.23 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1093 A 7.81 4.98 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1094 R 8.46 4.56 0.00 1.92 2.06 0.00 3.14 0.00 0.00 3.53 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 1095 S 8.35 4.88 0.00 4.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1096 G 8.21 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1097 L 9.42 3.46 0.00 1.75 1.67 0.91 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 1098 L 8.29 4.00 0.00 1.39 1.39 0.29 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 1099 R 8.31 3.80 0.00 1.97 2.06 0.00 3.11 0.00 0.00 3.43 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 1100 Y 6.77 3.98 0.00 1.95 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1100A A 7.34 4.36 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1100B M 8.46 4.34 0.00 1.66 2.15 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.44 0.00 1101 D 8.24 4.46 0.00 2.72 2.56 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 0.00 0.00 0.00 0.00 1102 Y 7.95 5.25 0.00 3.08 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1103 W 9.41 5.00 0.00 3.28 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1104 G 7.96 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1105 Q 8.91 4.49 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.41 0.00 0.00 0.00 0.00 0.00 2.18 2.26 0.00 1106 G 7.43 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1107 T 7.86 4.46 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 1108 S 7.81 3.96 0.00 3.90 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 1109 V 8.72 4.67 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.87 0.00 0.00 1110 T 7.86 4.51 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 1111 V 8.17 4.66 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.94 0.00 0.00 1112 S 8.41 4.48 0.00 3.88 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1113 S 8.47 4.41 0.00 3.64 3.66 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.