NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1001 A 4.3240 8.2649 123.5817 50.9504 19.9532 176.7022 1002 P 4.1850 0.0000 0.0000 62.4831 32.1182 174.4731 1003 R 4.3801 9.9489 122.0959 55.5018 32.1585 175.3443 1004 V 4.7866 8.3509 123.8250 60.9768 34.9691 174.0490 1005 I 4.9626 8.1932 126.9007 59.5437 40.8853 174.5098 1006 T 4.6771 8.6929 116.5624 59.7419 70.7072 174.0389 1007 L 4.6360 8.3458 125.8107 54.6056 42.2144 176.9719 1008 S 4.5151 7.5652 112.1697 55.6093 65.7913 173.2344 1009 P 4.1447 0.0000 0.0000 65.8945 30.9840 178.7112 1010 A 3.8270 7.5430 118.6685 55.3915 18.4649 179.3375 1011 N 4.2927 8.2469 114.7650 56.3012 38.4914 178.0117 1012 T 3.8335 7.9018 117.6076 66.6747 68.5701 176.4396 1013 E 4.1245 8.1451 120.4509 59.4953 29.5029 179.0444 1014 L 3.8965 8.0068 119.9807 58.2193 41.9943 178.8938 1015 A 3.8871 7.8350 120.2841 55.2354 18.3305 179.4555 1016 F 4.6425 8.5033 117.1270 60.2323 38.8372 177.7898 1017 A 4.0853 8.8087 119.7697 55.1319 18.3113 178.9567 1018 A 4.2308 8.1548 116.9301 53.0309 18.4707 178.3177 1019 G 3.9004 8.3694 106.1841 45.2432 0.0000 173.4121 1020 I 4.2647 8.1658 120.5109 59.5938 38.8073 175.2937 1021 T 3.6721 7.7977 120.4222 60.2972 68.9086 171.8037 1022 P 4.2973 0.0000 0.0000 63.3254 31.7965 176.8306 1023 V 4.1040 8.4248 115.5993 60.3379 31.6124 176.1922 1024 G 4.3193 6.8839 109.4394 46.4523 0.0000 173.1344 1025 V 5.3563 8.5819 117.1908 58.9086 36.2379 174.0228 1026 S 4.7529 7.9507 116.6200 57.4485 65.5063 174.8582 1027 S 3.9902 8.0132 113.2874 61.7383 62.7585 175.5788 1028 Y 4.6761 7.6617 116.1492 56.5303 38.3237 177.2606 1029 S 4.6364 7.6217 116.5220 57.7112 62.4211 175.3671 1030 D 4.4983 7.8706 119.5348 55.0546 40.2903 176.3549 1031 Y 4.5179 7.6529 120.4551 54.6441 41.2314 173.3255 1032 P 3.0833 0.0000 0.0000 60.9373 32.2753 175.3611 1033 P 4.7135 0.0000 0.0000 65.7505 30.7188 178.6659 1034 Q 3.9158 7.6376 116.7880 58.5206 28.5910 178.1916 1035 A 4.2695 7.8098 122.0890 55.0131 18.4028 179.4772 1036 Q 4.0285 8.0478 116.4648 58.3284 28.5010 178.0446 1037 K 4.2819 7.7894 117.6865 56.3865 32.8591 176.7376 1038 I 4.2629 7.0756 120.6871 59.9829 38.3751 175.6374 1039 E 4.0615 8.8362 126.3508 57.0818 30.7653 175.2363 1040 Q 5.1260 8.5371 123.5076 54.6232 30.3068 175.7767 1041 V 4.4269 9.1594 115.1985 60.9891 34.1187 175.0840 1042 S 4.8569 7.9457 114.2093 55.8412 66.4828 173.7241 1043 T 4.8626 8.3378 119.8386 63.3445 68.4739 176.6413 1044 W 4.9016 9.2511 135.0000 58.0336 32.5617 175.4098 1045 Q 4.7632 8.4508 113.2582 55.8700 30.0085 175.7565 1046 G 3.6644 7.4984 110.6517 44.7028 0.0000 172.8230 *1048 N 4.4760 8.5584 116.3677 53.0201 39.0858 175.0400 1049 L 3.9712 8.3746 124.2248 57.6290 41.8504 178.4503 1050 E 3.9809 8.2513 117.7189 59.8104 29.2594 179.5481 1051 R 3.8916 7.9212 117.8192 59.1854 29.9671 178.4805 1052 I 3.8677 7.6024 119.0971 64.3360 37.3698 178.1491 1053 V 3.6915 8.6442 119.8041 65.8330 31.0945 177.7406 1054 A 3.9562 7.9352 119.6527 55.2418 18.4094 179.2030 1055 L 3.8913 8.7492 117.8944 55.9248 43.3851 177.2361 1056 K 3.8111 7.7302 115.3678 57.3163 30.3126 171.6087 1057 P 4.7147 0.0000 0.0000 61.9528 33.0543 176.5801 1058 D 4.8117 8.9525 118.8909 55.8132 42.0641 176.7278 1059 L 4.4439 7.4787 118.6200 53.2704 46.2586 175.1476 1060 V 4.2898 7.9732 123.0849 61.4083 34.7977 174.5683 1061 I 4.0889 8.3748 130.4198 60.2715 36.2011 175.7802 1062 A 4.5042 7.6735 129.4674 50.9417 20.4835 176.2009 1063 W 5.3683 8.6241 127.7824 55.2678 31.4578 174.4977 1064 R 3.8578 8.9588 124.0316 56.9215 30.6283 176.4863 1065 G 3.7840 8.4070 110.3041 45.4894 0.0000 174.4390 1066 G 2.1805 7.0851 99.8735 43.7763 0.0000 169.4346 1067 N 4.2151 7.9081 121.2664 53.8286 38.2772 175.3266 1068 A 3.7627 8.2713 120.0970 53.3327 15.9963 176.5532 1069 E 4.5172 7.9029 122.5294 58.3265 30.3536 177.6671 1070 R 4.0334 8.0443 116.4716 59.0925 30.2090 178.4616 1071 Q 4.1979 8.0478 117.7311 58.6883 29.0019 178.2898 1072 V 3.5829 7.3680 119.4006 65.8922 31.5289 177.6788 1073 D 4.5159 8.4261 118.8942 57.6737 40.1757 178.8225 1074 Q 4.0854 7.8559 118.3843 58.7165 28.6007 179.1650 1075 L 3.9518 7.9739 120.0111 57.5861 41.6469 178.8522 1076 A 4.1728 7.9941 121.6028 54.6155 18.0083 179.0269 1077 S 4.1606 7.8230 109.8819 61.8635 62.4912 176.2217 1078 L 4.2864 7.2573 116.1953 55.3044 41.2036 177.9375 1079 G 3.9407 8.6448 108.2796 45.2057 0.0000 173.6400 1080 I 4.0366 7.5773 121.5604 60.5976 38.5188 175.6276 1081 K 4.2687 8.6648 126.6165 56.6734 33.2155 176.3420 1082 V 5.2326 7.6205 123.9022 59.9157 34.7515 174.1930 *1084 W 4.7689 8.4898 117.9853 57.0194 29.9568 175.5990 1085 V 4.3557 8.2841 120.8787 62.1382 33.0261 175.1615 1086 D 5.1369 8.5078 129.5506 52.6119 41.4079 176.6942 1087 A 4.0976 8.0782 121.2424 53.3914 19.1487 177.8356 1088 T 4.8114 8.3851 110.2003 60.2495 70.1943 173.9338 1089 S 4.5960 7.4882 115.5954 56.8639 66.8982 174.8971 1090 I 3.7075 7.9105 123.2122 64.0517 36.7298 178.7121 1091 E 3.8594 7.7584 119.3704 59.3993 29.2347 179.1484 1092 Q 4.0163 8.6786 118.4704 58.9805 28.8771 178.8034 1093 I 3.6788 7.6472 120.2399 64.2478 37.0834 178.3717 1094 A 4.0200 8.3132 122.0898 54.8591 18.0463 179.3252 1095 N 4.2342 8.1362 115.6195 56.7994 39.1183 176.9436 1096 A 4.0201 8.2577 122.4663 55.2096 18.1778 179.5015 1097 L 3.9347 7.5590 116.0499 58.1369 41.5356 179.5603 1098 R 4.0913 7.8350 117.8217 59.1051 29.7771 178.3874 1099 Q 4.2070 8.2360 117.6801 58.2927 29.1083 177.4887 1100 L 4.4793 8.0932 118.3790 55.4087 41.8750 178.5381 1101 A 4.0271 7.5908 121.4928 54.8074 18.2036 177.9148 1102 P 4.2732 0.0000 0.0000 64.8609 31.5487 177.5431 1103 W 4.4487 7.8899 117.1499 56.3721 29.6683 175.7968 1104 S 4.8460 7.1973 113.8257 55.8333 63.7695 172.0354 1105 P 4.5680 0.0000 0.0000 63.8865 32.0550 176.4513 1106 Q 4.5805 7.8838 118.6261 52.9720 29.0119 174.0202 1107 P 4.3393 0.0000 0.0000 65.2176 31.7379 177.6718 1108 D 4.4243 8.0598 117.5624 56.8911 40.5177 178.4011 1109 K 3.9893 7.7129 119.6111 59.1476 32.5932 178.6022 1110 A 4.1284 7.7821 120.6845 55.0526 18.5256 178.9082 1111 E 4.0577 8.0375 117.6787 58.6695 30.1296 177.0008 1112 Q 4.6331 8.3122 125.4247 55.5363 28.0781 175.1834 1113 A 5.4542 7.9965 135.0000 52.9190 17.6924 178.9102 1114 A 4.0618 7.4870 117.8828 54.9502 18.4228 179.7397 1115 Q 3.9191 8.1854 118.0900 59.5602 29.1487 178.4832 1116 S 3.9882 8.0564 115.7216 61.6229 63.0455 176.3698 1117 L 3.9468 7.9626 122.8074 57.7229 41.7156 179.1667 1118 L 4.1446 7.5668 118.8581 57.9149 41.3372 178.7709 1119 D 4.4466 8.7880 119.5890 57.8181 40.4475 179.1963 1120 Q 4.0735 8.4856 118.5622 58.7035 28.6400 178.1817 1121 Y 4.0677 7.6541 119.5438 60.7823 38.7972 177.6278 1122 A 3.9701 8.5402 120.3661 54.8433 18.6684 179.2020 1123 Q 4.0329 7.7568 117.8533 59.4575 28.0740 178.2928 1124 L 4.0847 7.6089 119.2939 56.0991 41.5120 177.3718 1125 K 4.1785 7.0005 119.2062 56.4481 33.0871 176.0705 1126 A 4.1768 8.6761 128.4233 53.0257 17.4372 179.3930 1127 Q 4.0829 7.3485 112.5599 58.3664 29.3846 175.4658 1128 Y 4.6542 7.4167 115.5350 57.7884 38.8280 175.8671 1129 A 4.5520 8.1214 122.6298 52.7914 20.8783 178.1905 1130 D 4.4997 7.9438 113.7066 55.5599 42.0409 176.6995 1131 K 4.0225 7.9152 119.5603 56.1323 32.2452 175.7840 1132 P 4.1667 0.0000 0.0000 62.8053 31.0817 171.9177 1133 K 4.1307 8.0524 128.9144 55.7612 33.1038 174.9292 1134 K 4.6513 8.5239 125.8988 54.3721 34.4301 176.3737 1135 R 4.1835 8.6499 123.9683 56.9597 30.9472 175.8284 1136 V 5.0113 9.0863 122.1872 61.5448 36.4004 173.3859 1137 F 5.1534 8.7754 124.4870 56.4520 42.2410 173.7239 1138 L 4.2866 8.0591 126.0481 54.2258 42.7515 175.2021 1139 Q 3.9767 8.2413 125.5684 55.0133 35.8179 179.0499 1140 F 3.8327 10.2930 121.2108 58.4287 40.8641 174.0060 1141 G 3.5351 6.5392 113.2073 45.6606 0.0000 175.1564 1142 I 4.5986 8.6301 115.3094 59.0646 42.0792 172.4460 1143 N 5.1285 8.5874 120.3668 50.8449 41.1944 173.2624 1144 P 4.9541 0.0000 0.0000 60.2521 32.7126 172.3326 1145 P 4.2605 0.0000 0.0000 64.1459 30.2037 178.0620 1146 F 5.7871 9.5461 118.3830 56.2273 40.6447 175.2223 1147 T 4.2483 8.0042 113.4180 61.7691 70.2097 175.4158 1148 S 3.5470 5.8100 118.4275 57.6659 68.2858 176.4380 1149 G 4.8221 9.3596 119.5128 45.9589 0.0000 172.5266 1150 K 4.3159 8.0793 127.4306 56.8206 31.9201 176.9848 1151 E 4.3115 7.5974 118.2511 53.5890 27.7705 176.2572 1152 S 4.7275 7.2835 114.6554 56.3850 66.6154 177.6561 1153 I 3.8716 8.0351 117.6888 64.1842 37.2119 178.1493 1154 Q 3.8049 8.1609 119.4594 59.0531 28.5894 178.6724 1155 N 4.3145 7.7602 116.1646 56.7733 38.8391 176.4522 1156 Q 4.0376 7.6722 119.2646 59.4641 29.2131 178.4884 1157 V 3.8957 8.2672 119.3861 65.7550 31.6189 177.7635 1158 L 3.9579 8.0231 120.1632 58.3506 41.8344 178.8694 1159 E 4.6681 8.5489 118.1838 58.3215 29.3883 178.8613 1160 V 3.8830 7.3317 117.5982 64.8905 31.6476 176.5249 1161 C 4.0400 7.6474 114.7667 59.0376 28.4109 174.1547 1162 G 3.9534 8.0254 108.1656 45.8589 0.0000 174.1404 1163 G 4.3820 7.9200 107.3935 44.9720 0.0000 172.7151 1164 E 5.0425 8.5277 120.4167 54.1263 33.2584 173.6451 1165 N 5.3566 8.7115 125.3464 52.0735 40.2619 175.2959 1166 I 4.2658 8.5120 118.9272 62.3238 38.0152 176.2681 1167 F 4.8367 8.6382 120.3142 57.3688 39.8348 177.4090 1168 K 3.9125 7.9824 121.6272 59.6931 31.7972 178.4118 1169 D 4.3645 8.1643 116.1833 55.4451 39.1185 176.8559 1170 S 4.0294 7.6405 116.1242 59.2910 63.0050 174.6528 1171 R 4.0149 8.6211 125.6924 57.7072 30.3140 176.1439 1172 V 4.3859 7.4861 117.2166 59.8562 33.5774 173.0030 1173 P 4.0789 0.0000 0.0000 63.4359 32.3416 176.1177 1174 W 3.8719 7.7393 120.3027 57.3149 26.7152 173.1788 1175 P 4.5798 0.0000 0.0000 62.9157 32.5815 177.3860 1176 Q 4.7435 8.5032 122.1675 54.9906 28.1465 176.5868 1177 V 4.3754 7.6934 110.7768 59.4889 33.8944 176.0803 1178 S 4.7490 8.5454 120.0763 56.7489 64.0500 173.3000 1179 R 4.5511 7.9668 120.0094 54.1462 31.9533 175.0705 1180 E 4.3767 8.6096 114.8919 57.1533 29.0373 178.7522 1181 Q 4.0449 7.9686 122.7643 58.7852 28.4227 178.6874 1182 V 3.4599 7.6236 119.1562 65.9374 31.5039 177.3660 1183 L 4.1966 7.6570 114.6451 55.8545 41.6841 178.0370 1184 A 4.3842 7.3681 120.3357 54.4202 19.7153 179.1936 1185 R 3.9003 8.2945 115.9284 57.3424 31.3674 176.6835 1186 S 3.8801 7.6305 110.4778 58.4435 59.3555 167.3680 1187 P 4.5486 0.0000 0.0000 62.8329 32.3388 177.0033 1188 Q 4.4742 8.8644 118.5576 54.7812 29.2749 175.4827 1189 A 4.7707 6.8980 121.8352 51.9115 22.3338 176.0880 1190 I 4.9462 7.8918 112.4907 59.5016 40.1537 175.3403 1191 V 4.5965 8.5379 120.3964 59.8378 33.7283 175.3433 1192 I 4.7827 7.7189 114.9719 59.1391 41.2901 174.8617 1193 T 4.1313 7.8746 115.2657 62.2168 68.2552 176.1772 1194 G 2.8268 7.6142 109.6475 49.0603 0.0000 174.4411 *1212 I 4.1908 7.8395 121.7194 59.4808 39.1147 174.2904 1213 P 4.4120 0.0000 0.0000 62.8885 32.6455 175.2037 1214 V 4.6670 8.2934 122.1667 61.6162 32.8912 174.8074 1215 I 4.2308 8.0748 128.7587 59.0765 38.6637 173.5266 1216 P 4.4579 0.0000 0.0000 62.5654 30.9816 175.7292 1217 L 4.6568 8.3132 125.9161 52.9569 43.0563 176.7256 1218 T 3.7106 8.6192 120.7209 64.4761 69.9956 172.8781 1219 S 4.2265 8.5796 110.9444 61.0470 62.9539 176.7173 1220 D 4.9223 9.0052 115.8219 53.7865 39.4304 174.5785 1221 W 4.9798 7.7557 119.7921 58.4844 32.0572 177.5619 1222 F 4.5626 8.0002 119.1428 60.0916 39.0709 176.0397 1223 E 4.1029 7.5511 115.3165 57.2924 30.1761 176.6031 1224 R 4.2473 7.7092 118.2049 54.7708 31.3925 176.9303 1225 A 4.2909 8.1055 126.4514 50.7477 17.2545 175.9315 1226 S 4.6259 7.5446 116.0575 55.7433 66.3712 174.1110 1227 P 4.2319 0.0000 0.0000 65.3928 30.9157 178.1338 1228 R 4.2275 7.7045 115.9921 56.1746 30.2227 177.8924 1229 I 3.9173 7.6717 120.8601 63.7935 37.7344 177.6265 1230 I 3.8282 7.2439 119.1604 63.3549 37.7031 177.5088 1231 L 3.8081 7.2992 121.1406 57.4697 41.5587 177.8015 1232 A 4.5655 7.7148 118.2764 53.1956 18.9187 178.4962 1233 A 4.1300 7.7016 119.2037 54.1574 19.1585 179.8262 1234 Q 3.8929 7.7976 116.8983 59.2664 28.8816 178.6496 1235 Q 4.0793 7.7982 118.5907 58.1642 29.0057 177.8369 1236 L 3.9843 7.1720 121.4940 58.0739 42.3448 178.0274 1237 C 3.5596 7.7421 116.5713 62.8386 27.8165 175.9054 1238 N 4.3708 7.7508 116.0470 56.6957 38.7818 176.4321 1239 A 4.1725 7.4597 117.9995 53.6142 18.7361 178.2713 1240 L 4.3215 7.8084 118.8676 56.7817 42.3211 178.1109 1241 S 4.6274 7.9339 108.8795 58.7182 62.1810 173.7550 1242 Q 4.6090 8.2567 118.6635 55.4553 29.3630 176.9687 1243 V 3.9415 7.9602 119.5639 62.0401 30.4759 175.0249 1244 D 4.7168 8.4529 123.8347 53.3730 40.7244 174.2171 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 A 8.26 4.32 1.27 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 0.00 0.00 0.00 1002 P 0.00 4.18 0.00 2.49 2.21 0.00 3.71 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 2.03 2.15 0.00 1003 R 9.95 4.38 0.00 1.84 1.85 0.00 3.07 0.00 0.00 3.10 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 1004 V 8.35 4.79 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 0.90 0.00 0.00 0.87 0.00 0.00 1005 I 8.19 4.96 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.79 0.88 0.00 0.00 1006 T 8.69 4.68 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 1.14 0.00 0.00 1007 L 8.35 4.64 0.00 1.70 1.80 0.89 0.90 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 1008 S 7.57 4.52 0.00 3.22 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 1009 P 0.00 4.14 0.00 1.99 2.25 0.00 3.19 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.08 0.00 1010 A 7.54 3.83 1.12 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 1011 N 8.25 4.29 0.00 2.74 2.81 0.00 0.00 7.16 7.62 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 1012 T 7.90 3.83 4.43 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 1.44 0.00 0.00 1013 E 8.15 4.12 0.00 2.08 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 2.64 2.64 0.00 1014 L 8.01 3.90 0.00 1.95 1.83 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 1015 A 7.83 3.89 1.27 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 0.00 0.00 0.00 1016 F 8.50 4.64 0.00 3.31 3.06 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 1017 A 8.81 4.09 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 1018 A 8.15 4.23 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 1019 G 8.37 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1020 I 8.17 4.26 1.77 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.61 0.78 0.00 0.00 1021 T 7.80 3.67 4.14 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 1.20 0.00 0.00 1022 P 0.00 4.30 0.00 1.92 1.89 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.88 0.00 1023 V 8.42 4.10 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 0.62 0.00 0.00 0.96 0.00 0.00 1024 G 6.88 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.58 5.36 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 1.02 0.00 0.00 0.97 0.00 0.00 1026 S 7.95 4.75 0.00 3.83 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 1027 S 8.01 3.99 0.00 3.92 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 1028 Y 7.66 4.68 0.00 2.75 2.88 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 1029 S 7.62 4.64 0.00 3.87 3.87 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 1130 D 7.94 4.50 0.00 2.62 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 1131 K 7.92 4.02 0.00 1.91 1.77 0.00 1.89 0.00 0.00 1.88 0.00 0.00 2.80 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.51 1.43 7.81 1132 P 0.00 4.17 0.00 2.05 2.09 0.00 3.78 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 2.03 2.08 0.00 1133 K 8.05 4.13 0.00 1.94 1.89 0.00 2.01 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.60 7.81 1134 K 8.52 4.65 0.00 1.77 1.72 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.43 7.81 1135 R 8.65 4.18 0.00 1.80 1.91 0.00 3.10 0.00 0.00 3.35 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.67 0.00 1136 V 9.09 5.01 2.19 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 0.95 0.00 0.00 1.02 0.00 0.00 1137 F 8.78 5.15 0.00 3.12 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 3.39 3.11 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 1147 T 8.00 4.25 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 1.19 0.00 0.00 1148 S 5.81 3.55 0.00 3.66 3.11 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 1149 G 9.36 4.82 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 0.00 0.00 0.00 1150 K 8.08 4.32 0.00 1.89 1.94 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.44 7.81 1151 E 7.60 4.31 0.00 1.89 1.87 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 2.26 2.20 0.00 1152 S 7.28 4.73 0.00 4.36 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1153 I 8.04 3.87 1.83 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 1.68 0.83 0.88 0.00 0.00 1154 Q 8.16 3.80 0.00 2.21 2.34 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 1.46 0.50 0.97 0.00 0.00 1213 P 0.00 4.41 0.00 2.11 2.18 0.00 3.78 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 2.08 1.97 0.00 1214 V 8.29 4.67 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 0.87 0.00 0.00 0.95 0.00 0.00 1215 I 8.07 4.23 1.79 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 1.20 0.71 0.83 0.00 0.00 1216 P 0.00 4.46 0.00 1.85 1.95 0.00 3.60 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.06 0.00 1217 L 8.31 4.66 0.00 1.58 1.42 -0.01 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 1218 T 8.62 3.71 3.67 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 0.00 0.00 0.00 0.19 0.00 0.00 1219 S 8.58 4.23 0.00 3.92 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 1220 D 9.01 4.92 0.00 2.64 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 1221 W 7.76 4.98 0.00 3.30 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 1222 F 8.00 4.56 0.00 3.16 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 1223 E 7.55 4.10 0.00 2.15 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 0.00 2.52 2.27 0.00 1224 R 7.71 4.25 0.00 1.77 1.79 0.00 3.23 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.54 0.00 1225 A 8.11 4.29 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 1226 S 7.54 4.63 0.00 4.04 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 1227 P 0.00 4.23 0.00 2.18 2.14 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 1228 R 7.70 4.23 0.00 1.54 1.12 0.00 2.47 0.00 0.00 2.64 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.39 0.00 1229 I 7.67 3.92 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.29 0.93 0.00 0.00 1230 I 7.24 3.83 1.86 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.06 0.91 0.00 0.00 1231 L 7.30 3.81 0.00 1.29 0.64 0.68 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 1232 A 7.71 4.57 1.60 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 0.00 0.00 1233 A 7.70 4.13 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 1234 Q 7.80 3.89 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.75 0.00 0.00 0.00 0.00 0.00 2.66 2.48 0.00 1235 Q 7.80 4.08 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 1236 L 7.17 3.98 0.00 1.66 1.66 0.71 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 1237 C 7.74 3.56 0.00 2.82 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 0.00 0.00 0.00 0.00 1238 N 7.75 4.37 0.00 2.78 2.86 0.00 0.00 7.30 7.92 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 1239 A 7.46 4.17 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 1240 L 7.81 4.32 0.00 1.92 1.83 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 1241 S 7.93 4.63 0.00 4.32 4.08 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 0.00 0.00 0.00 0.00 1242 Q 8.26 4.61 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.86 0.00 0.00 0.00 0.00 0.00 2.50 2.40 0.00 1243 V 7.96 3.94 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 0.85 0.00 0.00 0.98 0.00 0.00 1244 D 8.45 4.72 0.00 2.91 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 * Residues marked with a * may have inaccurate shift predictions.