NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1001 M 4.5027 8.3001 120.3242 54.9017 32.1768 173.7723 1002 A 3.4925 9.0736 126.3855 50.8141 18.0423 175.4550 1003 D 4.6235 9.6307 124.9438 53.4237 42.1834 173.7636 1004 P 4.3914 0.0000 0.0000 65.0633 31.9752 178.9409 1005 S 4.2123 8.6478 113.6724 60.8506 63.2406 176.3511 1006 L 4.1077 7.4377 119.2565 57.4295 41.3883 177.3940 1007 N 4.3706 7.3409 113.0457 53.2423 38.9059 173.8763 1008 N 4.5950 8.1311 116.9434 51.8421 38.9001 172.7333 1009 P 4.4196 0.0000 0.0000 62.7595 31.9553 176.9751 1010 V 3.7695 9.5245 123.6484 61.7666 31.8471 177.2901 1011 V 4.0100 7.9059 122.5991 60.2699 30.1333 174.4179 1012 I 3.9162 7.8332 128.1381 62.1338 37.7444 176.0515 1013 Q 4.4839 8.5105 122.1485 55.9067 31.1116 176.0855 1014 A 4.1603 7.8236 120.7282 51.8372 19.0416 177.1228 1015 T 4.0225 8.3614 119.6592 62.8497 69.1949 174.4888 1016 R 3.7393 8.6231 125.5754 56.4974 30.4568 175.3901 1017 L 3.9677 8.4439 126.5348 54.9687 42.5226 175.3294 1018 D 4.7085 8.5557 125.8700 52.1997 42.2484 176.3923 1019 A 4.0363 8.7394 130.4777 55.3414 18.5112 179.3674 1020 S 4.1628 8.4936 111.8847 61.4613 62.8878 175.5802 1021 I 3.9980 7.9054 112.1834 61.7520 37.9009 176.3654 1022 L 4.1567 7.4789 121.6622 53.6871 42.0744 175.1262 1023 P 4.1746 0.0000 0.0000 62.6336 31.7881 176.1320 1024 R 4.3466 8.2609 121.4326 55.9985 31.3254 176.0300 1025 N 4.4305 8.9849 118.3759 54.2221 35.8730 175.3083 1026 V 4.3446 7.8036 111.8350 61.5923 34.3556 176.0063 1027 F 5.3161 7.9803 117.6514 55.8056 40.6018 176.4458 1028 S 4.4841 8.6282 119.9279 58.0589 65.0420 175.4155 1029 K 3.9996 8.6946 122.1610 59.9784 31.9021 179.7269 1030 S 4.1853 8.0751 114.8760 61.8063 62.8453 175.8548 1031 Y 4.4816 8.1347 121.6735 60.0720 38.4851 177.6659 1032 L 3.9803 8.0088 120.4088 57.8873 41.7081 179.3850 1033 L 4.0562 7.9864 118.9101 57.5741 41.5076 178.9826 1034 Y 3.9563 7.9655 119.3122 60.7252 38.9223 178.1576 1035 V 3.3759 7.7206 119.1592 65.9012 31.3948 178.0036 1036 I 3.6046 7.6217 119.1921 64.3258 36.9658 178.3210 1037 A 3.9666 7.9943 123.0533 54.6411 18.2276 179.3242 1038 Q 3.8555 8.2852 118.5292 59.0917 28.8465 178.9446 1039 G 3.5540 7.8567 106.7534 48.0232 0.0000 175.8141 1040 T 3.8879 7.5965 112.7819 64.3914 68.6868 176.3046 1041 D 4.3876 8.4574 122.1929 57.0062 40.8912 178.6787 1042 V 3.6581 8.2418 119.2080 66.2479 31.4912 178.3758 1043 G 3.5904 7.9245 104.6869 47.5781 0.0000 175.6086 1044 A 3.9844 8.1083 123.0716 55.1020 18.3696 179.7491 1045 I 3.6075 8.1677 118.5656 64.3499 37.0748 178.4418 1046 A 4.0681 8.1641 121.7655 55.1640 18.3339 179.8742 1047 G 3.5523 7.9312 104.1390 47.8681 0.0000 175.8085 1048 K 4.1295 8.2799 122.1743 59.1950 32.2307 178.8353 1049 A 3.9915 8.2959 121.3135 55.1990 18.4195 179.3974 1050 N 4.3321 8.4096 115.1671 56.3928 38.4763 177.5818 1051 E 3.9954 8.2073 119.7235 59.1208 29.5523 179.1313 1052 A 4.0752 8.3332 121.1903 55.1587 18.4565 179.7620 1053 G 3.6878 8.1736 104.2694 48.1592 0.0000 175.6284 1054 Q 4.1363 8.0667 121.6705 58.8806 29.1044 178.5517 1055 G 3.5839 8.3887 106.8475 47.6941 0.0000 175.6360 1056 A 4.0557 8.5610 123.6712 54.9613 18.3932 179.1297 1057 Y 3.9914 8.3097 118.2030 60.9154 38.9042 177.8707 1058 D 4.2306 8.5550 119.8992 57.3548 40.9541 178.6543 1059 A 3.9536 8.0206 121.0913 55.3308 18.3701 179.7611 1060 Q 3.8642 8.0832 116.4951 58.9586 28.8850 179.0483 1061 V 3.3846 7.4553 119.2774 65.6609 31.4164 177.9229 1062 K 3.8402 7.8450 119.2664 59.7051 31.9849 178.2250 1063 N 4.3783 8.1441 116.6295 56.7347 38.3142 177.0516 1064 D 4.3108 8.0798 119.9694 57.4658 40.7753 178.7457 1065 E 3.9698 7.9932 118.7225 59.4037 29.4336 179.3921 1066 Q 4.0074 8.2784 118.3464 58.7427 28.8031 178.1937 1067 D 4.4392 8.3590 120.4027 57.1850 40.7543 179.0291 1068 V 3.5502 7.5336 118.9763 65.9880 31.5986 177.7874 1069 E 3.8560 7.8956 119.2270 59.1711 29.4311 178.6751 1070 L 3.9928 8.4316 119.2909 57.6514 41.6409 179.4357 1071 A 3.9714 8.0532 120.7569 55.0430 18.3592 179.1384 1072 D 4.2683 8.2151 116.6202 57.8944 41.2553 178.1201 1073 H 4.2117 8.6597 117.0593 58.8408 28.6242 177.1128 1074 E 3.8856 8.3763 120.7649 59.3614 29.6010 178.4971 1075 A 3.9875 8.0726 120.4694 55.6210 18.4772 179.9157 1076 R 3.9268 8.1271 116.2132 59.3281 30.0389 179.4911 1077 I 3.7366 8.0651 120.0016 64.0784 37.1208 178.3891 1078 K 3.8959 8.2086 119.5055 59.6523 31.9654 179.1568 1079 Q 3.9747 7.8727 117.5478 59.1393 28.7042 178.8450 1080 L 3.9540 7.8662 119.7673 58.1446 41.7737 179.7896 1081 R 3.9748 8.1693 118.3296 59.3939 30.0266 178.6825 1082 I 3.7499 7.7711 119.7688 64.2821 37.0794 178.1761 1083 D 4.2459 8.4815 120.1687 57.4430 40.8005 179.0897 1084 V 3.5810 8.1969 118.9129 65.7737 31.3399 177.6556 1085 D 4.4380 7.9784 118.3610 56.8739 40.6551 178.1486 1086 D 4.3592 7.9667 118.3240 57.6432 41.1336 178.0376 1087 H 4.3451 8.4402 116.8514 58.4008 28.6437 177.3967 1088 E 3.9386 8.0006 121.2007 59.3205 29.5403 179.0351 1089 S 4.1461 7.8658 114.0163 61.6759 63.0361 176.6966 1090 R 3.9670 7.8921 121.5153 58.8525 29.7400 179.1181 1091 I 3.7721 8.1677 120.1705 64.4047 37.0792 178.5533 1092 T 3.8174 7.9808 116.4107 66.6618 68.2997 176.3483 1093 A 4.0109 8.0537 122.5411 55.4503 18.3503 179.4417 1094 N 4.2775 8.2716 114.7712 56.8322 38.6940 177.8390 1095 T 3.9244 8.1415 117.2129 66.4647 68.4060 176.9797 1096 K 4.0100 8.2082 120.3820 59.1879 32.0990 179.1773 1097 A 3.9842 8.2118 121.2533 55.2672 18.1781 179.8247 1098 I 3.6697 7.8056 118.2374 64.8692 37.3318 178.8018 1099 T 3.8479 7.8878 116.1938 66.5541 68.3535 176.6251 1100 A 4.0370 8.2758 122.9170 55.0891 18.3373 179.7378 1101 L 3.9849 8.1540 117.6646 57.6300 41.6348 179.1167 1102 N 4.2644 8.4698 117.5341 56.8427 38.8268 177.3381 1103 V 3.6297 7.6526 113.2300 64.5434 31.6663 178.7305 1104 R 3.8984 7.8579 117.3736 59.3793 29.8485 179.3431 1105 V 3.6750 8.1598 118.2393 66.0788 31.5574 178.3126 1106 T 4.0621 8.0136 115.7875 66.7343 68.1917 176.9097 1107 T 3.8518 8.2233 117.7019 66.5088 68.4358 176.5019 1108 A 4.2228 7.9007 123.9913 54.6327 18.3850 179.4196 1109 E 3.9922 8.4289 117.1609 59.6351 29.5991 179.9471 1110 G 3.6151 7.9366 105.1044 47.9132 0.0000 175.6441 1111 E 4.0441 8.4300 121.1406 59.1013 29.3290 179.5759 1112 I 3.8121 8.0972 120.0356 64.1825 37.1571 178.2919 1113 A 4.4037 8.0041 123.0561 54.5943 18.1118 179.6628 1114 S 4.0019 8.1498 111.5611 61.5237 62.5460 176.1287 1115 L 3.9611 8.1071 121.9353 58.0280 41.2593 179.5236 1116 Q 3.9704 8.2671 117.8164 59.5292 28.5910 179.2541 1117 T 3.8901 7.9983 116.4916 66.7504 68.3622 176.5098 1118 N 4.3925 8.5064 118.7062 56.1437 38.6480 177.7500 1119 V 3.5862 8.4592 120.0045 65.8220 31.6042 178.4450 1120 S 4.0651 8.1103 114.9685 61.5527 62.7453 176.4429 1121 A 4.0243 7.7788 123.4238 55.0316 18.0799 179.4615 1122 L 3.9436 8.2184 119.1469 58.3530 41.9977 178.9683 1123 D 4.5141 8.1562 119.1345 56.8627 40.7844 179.0552 1124 G 3.5887 7.8471 105.9909 47.9376 0.0000 175.9535 1125 R 3.9396 7.8782 121.3928 58.7299 30.0426 179.1259 1126 V 3.5722 7.7943 117.9177 66.5082 31.4375 178.2099 1127 T 4.2721 7.5253 116.5182 66.5069 68.2265 176.7440 1128 T 3.8701 7.8199 116.9257 66.4862 68.3992 176.5753 1129 A 3.9447 8.3097 122.9247 55.1253 18.3068 179.2276 1130 E 3.8829 8.7328 117.4467 60.0584 29.7011 179.6943 1131 N 4.4036 8.6285 116.3782 56.2426 38.3065 177.3500 1132 N 4.4122 8.1123 117.6032 55.9541 38.8224 177.4104 1133 I 3.8127 7.8610 121.5058 64.6281 37.1328 178.2695 1134 S 4.5950 8.4217 116.0482 61.0840 62.7885 176.8042 1135 A 4.1900 7.9586 122.9749 54.5030 19.3148 177.7932 1136 L 4.5912 7.5672 118.4035 51.3817 38.8966 176.8883 1137 Q 5.4676 6.8856 126.0253 56.3687 29.6467 175.3084 1138 A 4.8267 8.1068 119.5278 51.7564 20.4357 176.2614 1139 D 4.8800 8.2317 112.9855 54.0459 43.5216 175.6266 1140 Y 4.3945 8.1587 115.9624 56.3271 39.0153 174.8632 1141 V 3.8967 8.0167 121.1662 61.4128 32.0616 175.5238 1142 S 4.1494 8.4252 123.0183 57.5175 62.9870 174.1227 1143 K 4.1804 8.4879 125.1303 58.1799 32.4547 177.7372 1144 T 4.2285 7.7241 111.0747 62.4486 68.2179 174.6898 1145 A 4.1252 8.0717 125.0189 52.6509 18.9490 177.1369 1146 T 4.2439 8.3869 111.7227 63.7287 70.0543 176.0018 1147 T 3.8670 7.7311 116.9567 63.0996 68.9361 173.6579 1148 S 4.2435 8.2680 117.9671 58.9710 62.5150 173.0436 1149 Q 4.5324 8.1066 120.1826 54.8997 31.6064 173.7008 1150 S 4.6994 8.5224 120.3507 56.6266 66.2821 173.1273 1151 L 4.6162 8.3304 123.9970 53.2009 43.2912 176.4502 1152 A 4.5219 8.5559 125.5719 52.0462 18.5429 176.7092 1153 S 4.7192 7.4934 112.1183 56.9157 66.2183 172.0301 1154 P 4.5562 0.0000 0.0000 62.3175 32.0486 175.2088 1155 L 4.8184 8.1778 119.8402 53.0918 44.8483 174.9762 1156 N 5.0594 8.7090 122.5176 51.7307 41.4232 173.3315 1157 V 4.3702 8.0877 123.0930 61.2810 35.1127 174.1810 1158 T 4.3220 8.0335 118.5212 63.1783 69.3320 176.2759 1159 T 3.5176 8.7631 123.6403 62.9436 67.4537 171.8071 1160 S 5.0256 6.1349 115.4100 58.4658 66.1715 176.3102 1161 Y 4.7610 8.7552 118.1170 56.4171 41.2602 175.3096 1162 S 5.4548 8.7176 118.6665 56.8623 67.5442 173.5537 1163 V 4.4659 8.5336 119.7314 61.9393 33.6805 175.4765 1164 G 3.9852 9.1511 112.5421 45.5272 0.0000 173.2127 1165 G 4.1087 7.6305 108.4340 44.7808 0.0000 174.4810 1166 K 4.5179 7.7801 118.7564 54.2424 34.4635 175.6763 1167 K 4.6344 8.5543 122.8549 56.4347 32.5373 176.3207 1168 V 4.4297 8.6376 123.1436 62.6387 33.6601 175.8355 1169 V 4.6017 7.5539 117.4496 60.3788 34.3485 173.3059 1170 G 4.2122 8.2390 111.1570 44.4427 0.0000 171.9269 1171 A 4.1216 8.5397 123.9281 51.6431 19.1350 177.4852 1172 R 3.9812 8.5878 121.5935 57.2766 30.6820 176.2262 1173 Q 4.4285 8.8178 124.4155 56.3123 30.0675 175.2193 1174 T 4.9884 8.5903 117.8232 62.1734 72.2570 173.4931 1175 G 3.6240 9.2808 109.5340 46.8267 0.0000 175.5476 1176 W 4.4700 8.1039 118.7970 54.1929 29.8967 176.1025 1177 T 3.9350 8.3349 119.3353 63.1807 68.5691 174.5428 1178 A 4.1234 8.5622 128.0892 52.2531 19.1660 177.4620 1179 A 4.0670 8.0183 124.2799 55.4094 18.6693 176.6702 1180 T 3.1413 8.5484 107.1832 60.4961 65.0240 169.7928 1181 G 3.7798 6.5876 122.0376 44.1053 0.0000 169.8070 1182 T 4.3574 6.9923 121.8169 60.7043 69.7755 171.6423 1183 A 4.7717 7.5242 131.3732 51.5132 22.2526 173.1369 1184 N 4.3277 8.0480 114.2994 54.0543 41.8718 174.5640 1185 K 4.6639 8.4369 117.7797 55.8309 32.3332 177.2863 1186 G 3.7847 7.5933 106.3063 44.8391 0.0000 169.4119 1187 V 3.0820 8.7427 130.3129 62.3969 30.7818 171.7602 1188 F 4.5923 8.3342 128.5608 56.2987 41.0264 174.7870 1189 D 4.4473 8.4851 127.7154 54.9931 41.8585 178.5797 1190 A 3.8846 6.6733 122.9113 53.1307 19.8536 179.1666 1191 D 3.4666 8.6958 111.1186 56.8109 40.0452 177.4084 1192 L 3.3908 8.5976 118.3447 55.1518 42.6649 178.0669 1193 T 4.3770 6.4200 112.8323 61.6629 69.2669 172.8763 1194 F 4.6097 7.4286 119.9900 57.0852 38.9831 175.9024 *1207 A 4.1101 8.2167 126.5893 52.3184 18.5039 176.6746 1208 I 4.9690 8.1861 116.7972 62.4088 38.3034 176.8853 1209 A 4.3547 7.9011 119.9279 53.0706 18.7766 177.5193 1210 N 4.7920 7.9384 114.5745 53.7470 40.5049 176.4226 1211 A 4.1282 7.2722 120.8851 53.7463 18.4843 179.3254 1212 L 3.9390 7.7605 118.8129 58.0286 42.0901 179.3232 1213 I 3.7619 7.5418 119.7729 64.5784 36.8107 178.1992 1214 T 3.9751 7.7628 110.0567 64.6212 68.2745 175.9930 1215 E 4.3027 8.0482 122.3134 59.3805 30.0004 178.6032 1216 R 4.1455 8.3640 118.6430 59.2085 29.9901 178.9567 1217 R 4.1776 8.1745 115.6282 58.5723 29.7624 178.8123 1218 R 4.1073 7.7699 120.5709 59.1137 29.8183 178.3673 1219 T 3.9762 8.5604 114.7197 65.2638 68.1972 176.1736 1220 K 4.1718 7.3734 120.1043 58.3285 32.7235 178.2601 1221 A 4.0675 8.1745 121.7007 55.3010 18.3186 179.0330 1222 M 3.8715 8.0929 116.8055 58.9574 32.4303 178.0764 1223 E 3.8118 7.8874 117.4670 58.5427 29.7170 177.5863 1224 D 4.5379 8.0300 117.1445 55.8765 41.4547 178.0022 1225 A 3.9868 7.8129 121.0517 54.8862 18.4204 179.3795 1226 L 3.9213 7.5926 117.9679 57.7801 41.4490 179.5409 1227 R 3.8462 7.2844 116.4491 59.0475 30.0565 178.0884 1228 A 4.0931 7.7221 120.1513 55.3218 18.4034 179.0422 1229 H 4.3423 7.7487 114.1901 57.9697 28.7942 176.7769 1230 G 4.1069 7.9872 107.0876 44.8726 0.0000 175.0328 1231 L 4.0419 7.9439 120.2713 56.8216 42.6454 176.4547 1232 I 4.7869 6.9811 110.4893 59.3466 41.4964 175.1550 1233 D 4.2878 8.2562 119.4261 54.9276 41.6078 174.8156 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 1001 M 8.30 4.50 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.61 0.00 1002 A 9.07 3.49 1.09 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 0.00 0.00 1003 D 9.63 4.62 0.00 2.74 2.66 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 1004 P 0.00 4.39 0.00 2.22 2.09 0.00 3.70 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.20 0.00 1005 S 8.65 4.21 0.00 3.99 4.11 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 1006 L 7.44 4.11 0.00 1.94 2.10 1.08 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 1007 N 7.34 4.37 0.00 1.61 2.20 0.00 0.00 7.08 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 1008 N 8.13 4.60 0.00 2.57 2.81 0.00 0.00 7.10 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 1009 P 0.00 4.42 0.00 2.05 1.98 0.00 3.69 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 1010 V 9.52 3.77 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 0.70 0.00 0.00 0.92 0.00 0.00 1011 V 7.91 4.01 2.07 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 0.78 0.00 0.00 0.92 0.00 0.00 1012 I 7.83 3.92 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.80 0.90 0.00 0.00 1013 Q 8.51 4.48 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.93 0.00 0.00 0.00 0.00 0.00 2.24 2.46 0.00 1014 A 7.82 4.16 1.23 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 0.00 0.00 1015 T 8.36 4.02 4.23 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 1.20 0.00 0.00 1016 R 8.62 3.74 0.00 1.73 1.86 0.00 3.27 0.00 0.00 3.13 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 1017 L 8.44 3.97 0.00 1.62 1.55 0.89 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 1018 D 8.56 4.71 0.00 2.69 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 1019 A 8.74 4.04 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 1020 S 8.49 4.16 0.00 3.87 3.93 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 0.00 0.00 0.00 1021 I 7.91 4.00 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.51 0.90 0.00 0.00 1022 L 7.48 4.16 0.00 1.79 1.61 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 1023 P 0.00 4.17 0.00 1.36 1.63 0.00 3.07 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 1.71 0.00 1024 R 8.26 4.35 0.00 1.75 1.83 0.00 3.29 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 1025 N 8.98 4.43 0.00 2.88 2.95 0.00 0.00 6.86 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1026 V 7.80 4.34 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 0.70 0.00 0.00 0.61 0.00 0.00 1027 F 7.98 5.32 0.00 3.00 3.01 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 1028 S 8.63 4.48 0.00 4.10 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 1029 K 8.69 4.00 0.00 1.86 1.95 0.00 1.70 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.57 1.59 7.81 1030 S 8.08 4.19 0.00 3.91 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 1031 Y 8.13 4.48 0.00 2.91 2.97 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 1032 L 8.01 3.98 0.00 2.06 1.74 1.13 0.40 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 1033 L 7.99 4.06 0.00 1.77 1.74 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 1034 Y 7.97 3.96 0.00 3.27 3.22 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 1035 V 7.72 3.38 1.86 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 0.90 0.00 0.00 0.22 0.00 0.00 1036 I 7.62 3.60 1.97 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.28 0.88 0.00 0.00 1037 A 7.99 3.97 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 1038 Q 8.29 3.86 0.00 1.41 1.95 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 2.25 2.26 0.00 1039 G 7.86 3.55 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 0.00 0.00 0.00 1040 T 7.60 3.89 4.21 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 1.17 0.00 0.00 1041 D 8.46 4.39 0.00 2.75 2.72 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 1042 V 8.24 3.66 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 0.99 0.00 0.00 0.96 0.00 0.00 1043 G 7.92 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1044 A 8.11 3.98 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 1045 I 8.17 3.61 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.78 0.91 0.00 0.00 1046 A 8.16 4.07 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1047 G 7.93 3.55 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 0.00 0.00 0.00 1048 K 8.28 4.13 0.00 1.87 1.95 0.00 1.53 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.50 7.81 1049 A 8.30 3.99 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 1050 N 8.41 4.33 0.00 2.87 2.87 0.00 0.00 7.02 7.19 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 1051 E 8.21 4.00 0.00 2.23 2.00 0.00 0.00 0.00 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 2.39 0.00 1052 A 8.33 4.08 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 1053 G 8.17 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 0.00 0.00 0.00 1054 Q 8.07 4.14 0.00 2.38 2.25 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 2.40 2.73 0.00 1055 G 8.39 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1056 A 8.56 4.06 1.40 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 1057 Y 8.31 3.99 0.00 3.07 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 1058 D 8.55 4.23 0.00 2.89 2.70 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 1059 A 8.02 3.95 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 1060 Q 8.08 3.86 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.55 0.00 1061 V 7.46 3.38 1.95 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 0.88 0.00 0.00 0.17 0.00 0.00 1062 K 7.84 3.84 0.00 1.88 1.92 0.00 1.57 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.49 7.81 1063 N 8.14 4.38 0.00 2.93 2.84 0.00 0.00 7.10 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 1064 D 8.08 4.31 0.00 2.86 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1065 E 7.99 3.97 0.00 2.19 1.97 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 2.30 2.48 0.00 1066 Q 8.28 4.01 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 1067 D 8.36 4.44 0.00 2.82 2.70 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 1068 V 7.53 3.55 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 0.98 0.00 0.00 0.97 0.00 0.00 1069 E 7.90 3.86 0.00 1.95 1.94 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 1.91 2.18 0.00 1070 L 8.43 3.99 0.00 1.87 1.69 0.90 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 1071 A 8.05 3.97 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 1072 D 8.22 4.27 0.00 2.80 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 1073 H 8.66 4.21 0.00 3.36 3.33 0.00 5.88 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1074 E 8.38 3.89 0.00 2.18 2.18 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 2.31 2.39 0.00 1075 A 8.07 3.99 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 1076 R 8.13 3.93 0.00 1.88 1.98 0.00 3.14 0.00 0.00 3.44 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 1077 I 8.07 3.74 2.07 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 1.50 0.76 0.90 0.00 0.00 1078 K 8.21 3.90 0.00 1.97 1.86 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.46 1.63 7.81 1079 Q 7.87 3.97 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 1080 L 7.87 3.95 0.00 1.86 1.72 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 1081 R 8.17 3.97 0.00 1.91 2.12 0.00 3.26 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 1082 I 7.77 3.75 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.98 0.90 0.00 0.00 1083 D 8.48 4.25 0.00 2.76 2.55 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 1084 V 8.20 3.58 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 1.03 0.00 0.00 0.92 0.00 0.00 1085 D 7.98 4.44 0.00 2.74 2.69 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 1086 D 7.97 4.36 0.00 2.76 2.84 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 1087 H 8.44 4.35 0.00 3.36 3.31 0.00 5.69 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1088 E 8.00 3.94 0.00 2.21 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 0.00 2.31 2.37 0.00 1089 S 7.87 4.15 0.00 4.06 4.11 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 1090 R 7.89 3.97 0.00 1.84 2.00 0.00 3.25 0.00 0.00 3.31 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 1091 I 8.17 3.77 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 1.51 0.72 0.91 0.00 0.00 1092 T 7.98 3.82 4.41 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 1.21 0.00 0.00 1093 A 8.05 4.01 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 1094 N 8.27 4.28 0.00 3.02 2.87 0.00 0.00 7.05 6.35 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 1095 T 8.14 3.92 4.39 0.00 0.00 0.00 0.00 0.00 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 1096 K 8.21 4.01 0.00 1.96 1.85 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.59 7.81 1097 A 8.21 3.98 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1098 I 7.81 3.67 2.02 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 1.52 0.90 0.91 0.00 0.00 1099 T 7.89 3.85 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 1.21 0.00 0.00 1100 A 8.28 4.04 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 1101 L 8.15 3.98 0.00 1.92 1.73 0.92 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 1102 N 8.47 4.26 0.00 2.89 2.98 0.00 0.00 7.16 7.81 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 1103 V 7.65 3.63 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 0.78 0.00 0.00 0.95 0.00 0.00 1104 R 7.86 3.90 0.00 2.04 1.98 0.00 3.12 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 1105 V 8.16 3.67 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 1.03 0.00 0.00 0.93 0.00 0.00 1106 T 8.01 4.06 4.39 0.00 0.00 0.00 0.00 0.00 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 1107 T 8.22 3.85 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 1.21 0.00 0.00 1108 A 7.90 4.22 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.43 3.99 0.00 2.20 2.02 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 2.33 2.45 0.00 1110 G 7.94 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 0.00 0.00 0.00 1111 E 8.43 4.04 0.00 2.16 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 2.33 2.51 0.00 1112 I 8.10 3.81 2.10 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 1.45 0.74 0.91 0.00 0.00 1113 A 8.00 4.40 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 1114 S 8.15 4.00 0.00 3.91 3.99 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 1115 L 8.11 3.96 0.00 1.88 1.71 0.92 1.21 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 1116 Q 8.27 3.97 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.67 0.00 1117 T 8.00 3.89 4.37 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 1.21 0.00 0.00 1118 N 8.51 4.39 0.00 2.79 2.85 0.00 0.00 6.64 8.48 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 1119 V 8.46 3.59 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 0.95 0.00 0.00 1120 S 8.11 4.07 0.00 4.09 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 1121 A 7.78 4.02 1.29 0.00 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*1207 A 8.22 4.11 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 1208 I 8.19 4.97 1.94 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 1.54 0.38 0.99 0.00 0.00 1209 A 7.90 4.35 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 1210 N 7.94 4.79 0.00 2.70 2.82 0.00 0.00 6.99 8.10 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 1211 A 7.27 4.13 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 1212 L 7.76 3.94 0.00 1.77 1.67 0.93 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 1213 I 7.54 3.76 2.03 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 1.85 0.80 0.93 0.00 0.00 1214 T 7.76 3.98 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 1.20 0.00 0.00 1215 E 8.05 4.30 0.00 2.27 2.30 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 2.38 2.46 0.00 1216 R 8.36 4.15 0.00 2.04 2.01 0.00 3.18 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.90 0.00 1217 R 8.17 4.18 0.00 2.16 2.21 0.00 2.82 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.75 0.00 1218 R 7.77 4.11 0.00 2.24 2.02 0.00 3.25 0.00 0.00 3.04 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 1.23 0.00 1219 T 8.56 3.98 4.36 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 1.25 0.00 0.00 1220 K 7.37 4.17 0.00 1.97 1.97 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.17 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.50 7.81 1221 A 8.17 4.07 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 M 8.09 3.87 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.49 0.00 1223 E 7.89 3.81 0.00 2.19 1.96 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 2.12 2.52 0.00 1224 D 8.03 4.54 0.00 3.00 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.81 3.99 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 1226 L 7.59 3.92 0.00 1.58 1.52 0.72 0.66 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 1227 R 7.28 3.85 0.00 1.77 1.89 0.00 3.25 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 1228 A 7.72 4.09 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 1229 H 7.75 4.34 0.00 3.18 3.28 0.00 5.63 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1230 G 7.99 4.11 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 0.00 0.00 0.00 1231 L 7.94 4.04 0.00 1.51 1.64 0.83 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 1232 I 6.98 4.79 1.12 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.40 0.35 0.00 0.00 1233 D 8.26 4.29 0.00 2.79 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 * Residues marked with a * may have inaccurate shift predictions.