NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1009 H 4.6416 8.4449 117.8266 56.0615 30.0149 173.2682 1010 H 4.4711 8.5178 121.5210 53.7361 27.9690 173.3031 1011 G 3.9407 8.2218 114.0165 43.9497 0.0000 170.2784 1012 I 3.7969 8.1207 119.4450 60.9615 38.4243 175.6841 1013 R 4.4542 8.4529 126.5732 55.6304 31.0482 176.1847 1014 M 4.5464 8.5441 120.6398 55.4378 33.1933 175.6782 1015 T 4.7026 7.2560 107.3321 59.8355 71.7765 173.7794 1016 R 4.0878 8.2940 121.7067 55.7833 30.7847 176.7655 1017 I 3.8139 8.1393 121.1862 60.9737 38.8139 176.5432 1018 S 4.3657 8.4008 121.1936 58.0355 65.0808 175.2562 1019 R 3.8736 8.5509 123.5600 59.6938 29.7182 178.5040 1020 E 3.9053 8.0939 118.4906 59.5973 29.7432 178.3660 1021 M 4.0323 8.1114 118.2559 58.6537 32.1806 177.7624 1022 M 3.9610 8.2138 118.5030 58.6931 32.2067 178.3874 1023 K 3.9822 7.8597 117.3716 59.4604 31.9878 178.9074 1024 E 4.1107 7.9817 119.1009 59.3794 29.1635 179.3679 1025 L 3.9657 7.6543 118.0701 57.5065 41.9584 179.0666 1026 L 3.8827 7.8176 117.8323 56.7190 41.5152 179.0752 1027 S 4.3318 7.3739 114.7955 59.6673 63.0810 174.3058 1028 V 4.4030 8.3190 128.7345 61.3569 33.5577 172.6064 1029 Y 5.1138 8.9529 129.9185 55.9027 39.1085 173.1230 1030 F 5.1889 9.2818 129.3476 57.7300 40.7388 173.8053 1031 I 4.3612 8.0650 126.6243 59.5598 39.9150 174.2647 1032 M 4.5646 8.0777 124.7683 54.5147 36.1847 173.3535 1033 G 5.0072 9.4018 110.8255 42.9005 0.0000 173.7160 1034 S 3.9707 9.2563 115.3092 61.0808 62.8398 175.7082 1035 N 4.6205 7.9992 115.7573 53.0141 36.9673 174.8194 1036 N 4.8473 7.8991 114.1138 53.5952 39.0388 174.2722 1037 T 5.0317 7.2323 110.3934 61.6441 70.4824 173.3717 1038 K 4.3026 8.5174 123.1490 56.4215 33.3888 176.5942 1039 A 4.3937 7.4356 121.5927 50.6933 20.6505 176.2044 1040 D 4.4653 8.4751 116.7549 53.6323 42.1801 174.6631 1041 P 4.2901 0.0000 0.0000 66.2089 31.4364 178.6562 1042 V 3.8600 7.9934 116.0389 66.4380 31.4386 178.0137 1043 T 4.1878 8.1663 116.7384 66.0857 68.2263 176.7622 1044 V 3.6341 7.9923 120.2262 65.9512 31.5826 178.2764 1045 V 3.7957 7.8889 117.5661 66.1553 30.8973 177.9881 1046 Q 4.0054 8.2390 117.7796 59.0329 28.5063 179.0833 1047 K 3.9963 8.4999 119.6250 59.2754 32.0670 179.3339 1048 A 3.8170 8.1584 121.2262 55.0531 18.1112 179.7376 1049 L 3.9865 8.0419 117.5497 57.7938 41.4795 179.6076 1050 K 4.0393 8.1869 119.0013 59.4927 32.4082 178.8600 1051 G 3.7950 8.3391 106.1245 46.3814 0.0000 173.4776 1052 G 3.4382 7.2387 112.2185 44.5682 0.0000 173.5579 1053 A 4.1498 7.7043 125.3249 53.0306 18.6557 177.8453 1054 T 4.4813 8.5867 112.3104 62.1670 70.1350 174.5928 1055 L 4.5919 7.5893 123.1942 54.1880 45.5016 172.9202 1056 Y 5.5534 8.7606 125.5770 55.9180 42.6354 173.5028 1057 Q 4.4236 8.0374 127.2519 53.8965 32.1346 173.9260 1058 F 4.4029 8.6310 129.6589 56.8478 40.7245 174.4131 1059 R 3.9475 8.1436 127.0373 54.6126 32.4604 173.3019 1060 E 4.5300 8.2078 128.1507 53.6176 29.1705 174.3701 1061 K 4.5475 7.8343 121.2825 54.1204 36.7934 176.7691 1062 G 3.9693 8.5669 104.6409 45.1812 0.0000 173.2402 1063 G 3.7309 8.1150 109.1475 46.9491 0.0000 173.3298 1064 D 4.7966 9.0488 123.2079 52.8587 37.4213 175.5005 1065 A 4.3038 7.5354 122.5934 51.8057 19.0465 177.8955 1066 L 4.2346 8.6782 121.3333 55.0264 42.3143 176.7173 1067 T 4.7627 7.8411 110.4061 60.0380 73.1689 174.3831 1068 G 3.7825 8.5777 109.4691 46.3491 0.0000 175.5781 1069 E 3.9373 8.8944 118.6519 59.2947 29.6563 178.7851 1070 A 4.0345 8.0271 120.3541 55.1327 18.4935 179.4618 1071 R 4.0923 7.9221 117.1859 59.7240 30.1702 178.8110 1072 I 3.7244 7.8396 119.6253 64.4201 37.1446 178.6113 1073 K 4.1179 8.4318 119.6351 59.3705 31.7688 179.2352 1074 F 4.3814 8.3813 120.6182 61.2325 39.3241 176.9342 1075 A 3.0474 7.9019 120.3514 54.9937 18.0146 179.4485 1076 E 3.6442 8.1267 117.0894 59.4462 29.4925 179.8575 1077 K 3.9016 8.0656 118.2882 59.1971 32.0931 179.3671 1078 A 3.7958 7.9233 121.5545 54.9949 18.2208 179.4641 1079 Q 3.1136 7.8248 118.2822 58.8604 28.9334 178.3249 1080 A 3.8547 7.9015 121.6597 55.0070 18.3759 179.4616 1081 A 3.9198 7.9188 119.3043 55.4678 18.3532 179.6805 1082 C 4.1294 8.0706 115.2851 62.8993 28.2995 176.2950 1083 R 3.8935 8.1325 120.3598 59.5771 29.4656 178.4671 1084 E 3.9806 8.1409 117.0134 58.9791 29.5427 178.4244 1085 A 4.3599 7.8665 118.5511 51.5827 19.1318 177.3075 1086 G 3.7938 7.8063 104.6581 46.6201 0.0000 173.6881 1087 V 4.5725 7.7894 118.5256 59.8290 34.0674 173.6100 1088 P 4.6540 0.0000 0.0000 62.6372 32.9180 174.8755 1089 F 5.0778 9.9416 126.1376 56.8839 41.2590 174.2324 1090 I 4.7462 8.4289 127.7625 59.5089 39.8374 174.8833 1091 V 4.3816 8.2754 126.0010 61.2301 33.8404 173.8978 1092 N 4.9253 8.5706 126.3621 53.6740 39.0672 175.1849 1093 D 4.5701 9.5693 130.5629 56.1593 41.0391 172.9145 1094 D 4.8250 7.5964 118.2372 53.2480 40.4801 176.3928 1095 V 3.5980 8.1407 126.0411 65.8380 31.7081 177.1010 1096 E 3.9712 8.2387 117.7430 59.4163 29.2561 179.0288 1097 L 3.9671 8.4253 120.0387 58.0436 42.1309 178.7549 1098 A 4.0585 8.1714 120.7644 55.2630 17.9015 179.7022 1099 L 3.9863 8.1457 117.4289 57.9940 41.5331 179.4806 1100 N 4.3675 8.3508 115.7040 56.1824 38.5613 176.3249 1101 L 4.1127 8.1646 116.0731 54.6878 42.5563 176.3944 1102 K 3.7233 7.5152 116.2131 57.2574 29.2560 175.0794 1103 A 4.5306 8.3251 121.4632 52.4552 19.5649 177.8085 1104 D 4.6558 9.0931 118.5130 55.2979 42.2695 176.6006 1105 G 4.1750 7.3959 104.8084 46.1453 0.0000 171.7518 1106 I 5.2602 8.4397 119.2184 59.4434 42.1571 173.1193 1107 H 5.3714 9.4128 128.1821 54.3006 32.3297 172.5539 1108 I 5.0543 8.1263 118.8921 58.2675 41.1768 175.0544 1109 G 4.3985 8.4003 110.3429 44.7676 0.0000 173.4762 1110 Q 4.1826 8.7896 120.2790 59.2511 29.2317 178.1679 1111 E 4.1455 7.7878 114.5766 54.3255 28.1245 178.1769 *1113 A 4.0798 7.5476 124.3923 51.6799 20.4194 176.4737 1114 N 4.8176 8.3525 119.5080 51.5905 40.9868 175.3714 1115 A 3.9486 8.5816 130.1276 55.3966 18.3850 179.3340 1116 K 3.9518 7.9656 116.3204 59.5356 32.1876 179.3062 1117 E 3.9328 8.0452 118.3593 59.4312 29.5180 179.4080 1118 V 3.5690 7.8984 118.3150 65.9003 31.3554 177.7719 1119 R 3.8435 8.2010 117.6519 59.6257 29.6984 178.0095 1120 A 4.1309 7.8771 120.0631 54.9821 18.2365 179.5074 1121 A 4.0841 8.0519 118.7366 54.3954 18.1832 178.8287 1122 I 4.2102 7.8216 109.9545 60.3000 38.2217 176.6242 1123 G 3.9710 8.0117 108.6231 47.8083 0.0000 174.5615 1124 D 4.8237 8.6678 124.5418 53.8937 40.9323 176.0026 1125 M 4.3826 7.3849 116.7962 54.5076 32.1260 175.8820 1126 I 4.0517 8.3035 120.4452 61.5289 38.5428 175.1839 1127 L 4.9549 9.3012 128.7493 53.2568 44.6450 175.0854 1128 G 3.2385 8.8270 114.0277 43.0878 0.0000 171.9957 1129 V 4.7630 7.6865 122.4801 60.4277 34.7748 174.4253 1130 A 4.6353 8.6641 130.3652 51.8872 18.7511 176.5739 1131 A 4.7289 8.9292 123.3607 50.6022 22.5062 176.2974 1132 H 4.8532 9.7870 116.2323 54.8950 31.1595 174.1654 1133 T 4.7569 7.4888 109.1939 59.0005 73.1763 174.1490 1134 M 4.0233 8.5277 120.7981 58.8153 32.2755 178.3935 1135 S 4.1071 8.0183 113.9253 61.6704 63.0973 176.2826 1136 E 3.9696 8.1884 122.1746 58.8200 29.1547 179.5031 1137 V 3.5422 7.8868 118.3988 66.0059 31.6681 178.3273 1138 K 3.9972 8.2130 118.3681 59.4474 31.7771 179.2121 1139 Q 3.9506 8.2748 119.7417 58.9410 28.9299 178.0613 1140 A 3.9237 8.1622 122.0344 55.0395 18.2920 179.1980 1141 E 3.8349 8.1764 117.8810 59.4455 29.4985 178.7035 1142 E 3.9515 8.0247 118.2473 59.2861 29.8252 178.0767 1143 D 4.5630 8.1847 117.6019 55.3180 40.8892 177.1825 1144 G 3.9867 7.4884 107.7859 45.0542 0.0000 173.6954 1145 A 4.0528 7.7335 122.1792 52.1610 18.7630 178.3006 1146 D 4.8202 8.9019 121.7464 56.2978 42.0881 176.2366 1147 Y 5.0884 7.3775 114.6142 55.9667 41.5107 173.9808 1148 V 4.6701 8.9713 113.5909 59.5757 35.6983 174.9999 1149 G 4.4563 8.9895 111.8967 44.9255 0.0000 172.2845 1150 L 5.2012 8.6010 126.6900 51.2839 44.2017 177.3597 1151 G 4.0671 8.0021 108.9839 45.4149 0.0000 169.3536 1152 P 4.5245 0.0000 0.0000 62.9609 32.1286 177.8039 1153 I 3.7734 8.7281 126.0263 63.5826 37.8446 175.5092 1154 Y 5.2929 7.7082 116.2114 54.8659 41.6195 173.9269 1155 P 4.1245 0.0000 0.0000 63.4939 31.7798 176.0786 *1162 T 4.1167 8.2475 118.9664 63.2724 69.5539 174.2401 1163 R 4.1233 8.2429 123.9325 55.3753 31.0067 176.2414 1164 A 4.1526 8.1284 122.5060 51.6673 19.0466 177.9731 1165 V 3.8759 8.2766 121.6261 63.2367 32.3864 175.8212 1166 Q 4.5183 9.0008 123.1577 54.6226 30.0229 176.4893 1167 G 3.9547 7.6605 107.7190 46.6952 0.0000 175.4251 1168 V 4.2326 8.0298 117.4128 61.1858 32.3245 177.5078 1169 S 4.0914 7.9842 118.3991 61.8359 62.3982 176.4501 1170 L 3.9756 7.8078 123.4851 57.4585 41.9152 178.6046 1171 I 3.6835 7.6914 119.3680 64.5400 37.0395 178.0118 1172 E 3.9497 8.3618 119.0925 59.3991 29.1528 179.3498 1173 A 3.9692 8.0318 120.8245 54.9995 18.5475 179.8622 1174 V 3.5318 8.0921 117.0582 66.3815 31.6697 178.6140 1175 R 3.9930 8.0116 117.7875 59.2079 29.6415 179.1754 1176 R 4.0355 8.1864 117.7869 58.5387 30.0245 177.8317 1177 Q 4.6063 7.6606 115.7736 55.8256 29.5775 176.0292 1178 G 3.8528 7.7446 106.6110 47.1458 0.0000 174.0897 1179 I 4.0953 7.6224 120.8050 60.4076 37.4825 176.0056 1180 S 4.6569 8.5043 119.0675 57.7217 63.3182 174.0727 1181 I 3.7738 7.5764 120.7102 60.8409 38.4397 173.6487 1182 P 4.6913 0.0000 0.0000 62.9832 32.5715 175.2028 1183 I 5.3189 9.4170 124.8948 59.4098 40.9939 174.7972 1184 V 4.8445 8.7696 125.4750 59.8444 34.4631 175.0440 1185 G 4.2243 8.8665 111.4631 45.7502 0.0000 172.3833 1186 I 4.9606 8.2894 121.8077 58.9920 42.5067 174.8980 1187 G 4.2982 9.6135 116.1271 46.6378 0.0000 173.6588 1188 G 4.3442 8.4655 114.6094 44.8826 0.0000 171.8799 1189 I 4.4784 7.9744 119.8052 60.6395 37.6473 175.4372 1190 T 5.0073 9.3719 114.2903 59.4018 71.8107 174.9837 1191 I 3.1206 7.8467 121.5660 64.2293 37.0543 177.8224 1192 D 4.3969 7.9091 119.1949 56.1840 40.8415 176.6038 1193 N 4.8209 7.6131 114.0667 52.2284 37.8622 175.9086 1194 A 4.2390 7.9405 122.3039 55.3918 18.3462 179.9447 1195 A 3.4256 7.8557 118.8876 55.0520 18.2319 177.9354 1196 P 4.3868 0.0000 0.0000 64.9755 31.2496 179.0343 1197 V 3.5943 7.8346 117.2962 65.9899 31.4598 178.2422 1198 I 3.9428 7.6436 119.1230 64.5460 36.6430 178.2734 1199 Q 4.1102 8.4919 118.9334 58.7396 28.2839 178.4003 1200 A 4.2204 7.7800 120.4881 52.7257 18.6279 177.2732 1201 G 3.6494 7.6569 103.9415 45.1144 0.0000 174.4852 1202 A 4.2363 7.6433 123.0532 52.3088 18.8630 177.3967 1203 D 4.6515 8.7046 119.1541 53.9976 41.7179 176.5117 1204 G 4.5264 6.7337 105.7020 46.4003 0.0000 172.2416 1205 V 5.2468 8.0783 112.3297 59.3686 35.9631 175.4385 1206 S 5.7417 9.0592 117.5550 56.3856 66.0941 172.7544 1207 M 4.5076 8.1927 117.2183 55.2593 34.3145 173.0088 1208 I 4.8287 8.5074 115.7967 60.9884 40.9840 177.8885 1209 S 4.2385 8.7749 119.1172 61.4672 63.1270 176.2399 1210 A 4.1645 8.2898 121.7874 54.5014 18.3065 178.2179 1211 I 4.2872 7.6928 116.0915 63.2087 38.6113 178.0776 1212 S 4.3963 8.6888 115.1374 60.8759 62.6008 175.4099 1213 Q 4.5050 8.1966 118.9644 55.2421 28.0955 175.2583 1214 A 4.3107 7.7225 122.8563 51.5390 19.0220 178.9310 1215 E 4.1974 8.7726 119.3562 58.6851 30.1303 176.8054 1216 D 4.7471 7.4386 116.5098 50.2317 41.4080 173.3519 1217 P 4.2014 0.0000 0.0000 65.0623 31.5929 177.3467 1218 E 4.0804 8.1121 117.4792 59.5361 29.6218 178.9577 1219 S 4.1348 8.6054 115.0923 61.3172 62.8389 176.5113 1220 A 3.9407 8.2420 123.4279 55.2009 18.0976 179.5549 1221 A 4.0944 8.1416 119.3094 55.2764 18.3397 179.8575 1222 R 4.2838 8.0723 118.5547 59.1196 30.1931 178.9185 1223 K 3.9709 8.4144 118.6534 59.3666 31.9031 179.3992 1224 F 4.1403 8.2787 118.0981 60.5232 38.8875 177.6038 1225 R 3.9846 8.4325 118.8080 59.5252 29.9732 178.4005 1226 E 4.0271 8.6168 117.8217 59.2497 29.6756 178.7952 1227 E 4.0119 8.3210 120.2589 59.2977 29.8095 178.8767 1228 I 3.8869 8.2644 120.2735 64.5600 37.0211 178.4673 1229 Q 4.0788 8.3795 118.9416 59.2027 28.2779 178.9802 1230 T 3.8267 7.7284 115.7870 66.8600 68.6601 175.8168 1231 Y 4.1121 7.9470 115.5619 59.3839 38.2287 177.1743 1232 K 4.3216 7.8607 118.4291 58.0061 32.5677 178.3458 1233 T 4.0805 7.6705 113.5598 64.2991 67.3578 174.6784 1234 G 3.7636 7.9063 108.6862 46.3685 0.0000 174.1323 *1235 R 4.1219 7.8264 123.2160 56.3590 30.1199 180.4619 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 1009 H 8.44 4.64 0.00 3.15 3.27 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1010 H 8.52 4.47 0.00 3.35 3.29 0.00 5.69 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1011 G 8.22 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 0.00 0.00 0.00 1012 I 8.12 3.80 1.88 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 1.42 0.87 0.92 0.00 0.00 1013 R 8.45 4.45 0.00 1.93 2.07 0.00 3.41 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 1014 M 8.54 4.55 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.44 0.00 1015 T 7.26 4.70 4.25 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 1.21 0.00 0.00 1016 R 8.29 4.09 0.00 1.83 1.91 0.00 3.21 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 1017 I 8.14 3.81 1.89 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 1.48 0.76 0.94 0.00 0.00 1018 S 8.40 4.37 0.00 4.09 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 1019 R 8.55 3.87 0.00 1.91 1.98 0.00 3.19 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 1020 E 8.09 3.91 0.00 2.08 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 1021 M 8.11 4.03 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.55 0.00 1022 M 8.21 3.96 0.00 2.30 2.14 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.96 0.00 1023 K 7.86 3.98 0.00 1.93 1.86 0.00 1.77 0.00 0.00 1.86 0.00 0.00 3.22 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.62 1.68 7.81 1024 E 7.98 4.11 0.00 2.13 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 0.00 2.33 2.50 0.00 1025 L 7.65 3.97 0.00 1.64 1.52 0.83 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 1026 L 7.82 3.88 0.00 1.55 1.58 0.82 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 1027 S 7.37 4.33 0.00 3.89 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 1028 V 8.32 4.40 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 0.97 0.00 0.00 1.00 0.00 0.00 1029 Y 8.95 5.11 0.00 3.09 2.80 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 1030 F 9.28 5.19 0.00 3.17 3.16 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 1031 I 8.07 4.36 1.55 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.44 0.56 0.00 0.00 1032 M 8.08 4.56 0.00 2.07 0.87 0.00 0.00 0.00 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 1033 G 9.40 5.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1034 S 9.26 3.97 0.00 3.67 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1035 N 8.00 4.62 0.00 2.87 2.99 0.00 0.00 5.91 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1036 N 7.90 4.85 0.00 2.90 2.89 0.00 0.00 6.59 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1037 T 7.23 5.03 4.38 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 1.25 0.00 0.00 1038 K 8.52 4.30 0.00 1.78 1.82 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.36 7.81 1039 A 7.44 4.39 1.29 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 0.00 0.00 1040 D 8.48 4.47 0.00 2.82 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 1041 P 0.00 4.29 0.00 1.99 1.75 0.00 3.63 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.05 0.00 1042 V 7.99 3.86 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.21 0.00 0.00 1043 T 8.17 4.19 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 1.24 0.00 0.00 1044 V 7.99 3.63 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 1.25 0.00 0.00 1.08 0.00 0.00 1045 V 7.89 3.80 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 0.47 0.00 0.00 1.01 0.00 0.00 1046 Q 8.24 4.01 0.00 2.33 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.62 0.00 1047 K 8.50 4.00 0.00 1.90 1.92 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.63 7.81 1048 A 8.16 3.82 0.99 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 0.00 0.00 1049 L 8.04 3.99 0.00 1.87 1.75 0.92 0.51 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 1050 K 8.19 4.04 0.00 1.85 2.02 0.00 1.80 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.46 7.81 1051 G 8.34 3.79 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 0.00 0.00 0.00 1052 G 7.24 3.44 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 0.00 0.00 0.00 0.00 1053 A 7.70 4.15 1.38 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 1054 T 8.59 4.48 4.22 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 1.26 0.00 0.00 1055 L 7.59 4.59 0.00 1.66 1.11 0.77 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 1056 Y 8.76 5.55 0.00 3.22 2.92 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 1057 Q 8.04 4.42 0.00 1.98 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.73 0.00 0.00 0.00 0.00 0.00 1.91 2.07 0.00 1058 F 8.63 4.40 0.00 2.98 2.64 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 0.00 0.00 0.00 0.00 1059 R 8.14 3.95 0.00 1.58 1.46 0.00 2.90 0.00 0.00 2.91 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.37 0.00 1060 E 8.21 4.53 0.00 1.19 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 1061 K 7.83 4.55 0.00 1.65 1.61 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.27 1.29 7.81 1062 G 8.57 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 0.00 0.00 0.00 1063 G 8.11 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 1064 D 9.05 4.80 0.00 2.83 3.18 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 1065 A 7.54 4.30 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1066 L 8.68 4.23 0.00 1.74 1.70 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 1067 T 7.84 4.76 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 1.27 0.00 0.00 1068 G 8.58 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 1069 E 8.89 3.94 0.00 2.07 1.99 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 2.41 2.41 0.00 1070 A 8.03 4.03 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1071 R 7.92 4.09 0.00 2.09 2.27 0.00 3.44 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.07 0.00 1072 I 7.84 3.72 2.02 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 1.80 0.76 0.90 0.00 0.00 1073 K 8.43 4.12 0.00 1.82 1.91 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.68 1.62 7.81 1074 F 8.38 4.38 0.00 3.22 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1075 A 7.90 3.05 0.61 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 1076 E 8.13 3.64 0.00 2.06 1.89 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 2.20 2.53 0.00 1077 K 8.07 3.90 0.00 1.95 1.85 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.19 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.44 1.61 7.81 1078 A 7.92 3.80 1.13 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 0.00 0.00 1079 Q 7.82 3.11 0.00 0.93 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.97 1.58 0.00 1080 A 7.90 3.85 1.28 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 0.00 0.00 0.00 0.00 0.00 0.00 1081 A 7.92 3.92 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 1082 C 8.07 4.13 0.00 3.26 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1083 R 8.13 3.89 0.00 1.86 2.05 0.00 3.08 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 1084 E 8.14 3.98 0.00 2.12 1.99 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 2.53 2.45 0.00 1085 A 7.87 4.36 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1086 G 7.81 3.79 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 0.00 0.00 0.00 1087 V 7.79 4.57 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 0.93 0.00 0.00 1.08 0.00 0.00 1088 P 0.00 4.65 0.00 2.02 1.84 0.00 3.66 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.30 0.00 1089 F 9.94 5.08 0.00 3.13 3.09 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 1090 I 8.43 4.75 1.91 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 1.19 0.90 0.99 0.00 0.00 1091 V 8.28 4.38 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 1.11 0.00 0.00 0.89 0.00 0.00 1092 N 8.57 4.93 0.00 2.84 2.66 0.00 0.00 7.20 8.51 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 1093 D 9.57 4.57 0.00 2.85 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.60 4.82 0.00 2.77 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1095 V 8.14 3.60 2.09 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 1.02 0.00 0.00 0.93 0.00 0.00 1096 E 8.24 3.97 0.00 2.28 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 1097 L 8.43 3.97 0.00 2.04 1.89 0.95 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 1098 A 8.17 4.06 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 1099 L 8.15 3.99 0.00 1.87 1.73 0.98 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 1100 N 8.35 4.37 0.00 2.73 2.88 0.00 0.00 7.10 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 1101 L 8.16 4.11 0.00 1.74 1.67 0.89 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 1102 K 7.52 3.72 0.00 1.92 1.91 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.37 7.81 1103 A 8.33 4.53 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 1104 D 9.09 4.66 0.00 2.79 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 1105 G 7.40 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1106 I 8.44 5.26 1.88 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 1.10 1.82 0.89 0.00 0.00 1107 H 9.41 5.37 0.00 3.36 3.11 0.00 5.77 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1108 I 8.13 5.05 1.81 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.40 0.86 0.00 0.00 1109 G 8.40 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 0.00 0.00 0.00 0.00 1110 Q 8.79 4.18 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 7.50 0.00 0.00 0.00 0.00 0.00 2.48 2.61 0.00 1111 E 7.79 4.15 0.00 1.99 1.77 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 2.22 1.87 0.00 *1113 A 7.55 4.08 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 1114 N 8.35 4.82 0.00 2.80 2.76 0.00 0.00 7.07 7.69 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 1115 A 8.58 3.95 1.34 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 1116 K 7.97 3.95 0.00 1.79 1.86 0.00 1.66 0.00 0.00 1.80 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.58 7.81 1117 E 8.05 3.93 0.00 2.18 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 0.00 2.39 2.35 0.00 1118 V 7.90 3.57 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 0.96 0.00 0.00 0.96 0.00 0.00 1119 R 8.20 3.84 0.00 1.84 2.15 0.00 3.42 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 1120 A 7.88 4.13 1.34 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 1121 A 8.05 4.08 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1122 I 7.82 4.21 1.88 0.00 0.00 0.85 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1211 I 7.69 4.29 1.63 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.22 0.32 0.00 0.00 1212 S 8.69 4.40 0.00 4.29 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1213 Q 8.20 4.50 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.02 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 1214 A 7.72 4.31 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1215 E 8.77 4.20 0.00 2.09 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 2.28 2.30 0.00 1216 D 7.44 4.75 0.00 2.60 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 1217 P 0.00 4.20 0.00 2.16 2.04 0.00 3.65 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.40 0.00 1218 E 8.11 4.08 0.00 2.02 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 0.00 2.37 2.60 0.00 1219 S 8.61 4.13 0.00 4.07 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1220 A 8.24 3.94 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 1221 A 8.14 4.09 1.37 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 0.00 0.00 1222 R 8.07 4.28 0.00 2.06 2.10 0.00 3.15 0.00 0.00 3.27 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.55 0.00 1223 K 8.41 3.97 0.00 1.86 1.72 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.67 7.81 1224 F 8.28 4.14 0.00 3.28 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 1225 R 8.43 3.98 0.00 2.08 2.14 0.00 3.20 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 1226 E 8.62 4.03 0.00 2.24 2.22 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 2.58 2.39 0.00 1227 E 8.32 4.01 0.00 2.23 2.24 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 2.30 2.47 0.00 1228 I 8.26 3.89 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.95 1.04 0.00 0.00 1229 Q 8.38 4.08 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.66 0.00 1230 T 7.73 3.83 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1231 Y 7.95 4.11 0.00 3.02 3.09 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 1232 K 7.86 4.32 0.00 1.83 1.89 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.71 7.81 1233 T 7.67 4.08 4.33 0.00 0.00 0.00 0.00 0.00 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 1234 G 7.91 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *1235 R 7.83 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 * Residues marked with a * may have inaccurate shift predictions.