NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1001 A 4.4008 8.2493 123.5818 52.1358 20.6976 176.8271 1002 Q 4.3182 8.2743 127.1770 54.2512 28.1080 172.2168 1003 E 4.2485 9.4296 118.2737 55.9837 31.6095 176.9369 1004 E 4.6318 8.1269 118.2558 53.9778 31.8622 175.8380 1005 E 3.9134 8.5887 120.8348 56.6041 30.1248 175.9326 1006 A 4.5218 8.1932 126.9962 49.9618 20.5033 176.1485 1007 E 3.9162 8.8084 124.4208 56.5066 29.2200 175.6151 1008 Q 4.5514 8.5131 128.1283 54.4877 30.1779 175.1407 1009 N 5.1551 8.4602 122.7636 51.3392 39.3045 173.8501 1010 L 4.3646 9.4810 120.5614 53.9616 43.4569 178.5418 1011 S 4.4290 8.7167 114.4352 60.5837 62.4802 175.8131 1012 E 3.9908 8.3488 119.5276 59.3542 29.2610 177.5403 1013 L 4.4539 7.9359 116.0165 55.8651 41.9352 177.6067 1014 S 4.7244 8.0930 115.6496 58.4847 63.6642 175.3492 1015 G 4.1555 8.2623 110.3145 43.9717 0.0000 169.4172 1016 P 5.1873 0.0000 0.0000 62.6575 32.3742 175.6181 1017 W 5.4745 9.0029 122.7622 54.9960 33.1049 174.8754 1018 R 5.2393 9.4352 120.0717 54.8582 34.2209 174.7429 1019 T 4.1635 8.8439 118.7102 63.9023 68.8615 173.7356 1020 V 4.0044 8.3687 126.0088 64.1731 32.6091 175.1343 1021 Y 4.9273 7.2735 116.5590 56.2745 42.5887 173.8642 1022 I 4.8453 8.3857 121.7982 59.7546 41.1076 174.7946 1023 G 4.2763 9.1827 113.9280 44.7424 0.0000 171.8297 1024 S 5.2223 8.1732 113.9962 56.9214 64.9543 174.3357 1025 T 4.0527 8.6175 116.2590 63.3688 69.7413 173.8878 1026 N 4.8105 8.1396 121.1784 50.6128 40.0978 172.4944 1027 P 4.3196 0.0000 0.0000 65.7128 31.7741 178.5759 1028 E 4.0153 8.4219 118.4502 59.2704 29.6726 179.4454 1029 K 4.2489 8.1744 117.8350 58.4349 32.1799 178.1173 1030 I 4.5044 7.4337 109.1289 60.3715 38.5112 175.5016 1031 Q 4.3107 7.6125 120.0820 55.0689 29.4086 175.0635 1032 E 4.0661 8.4768 118.2633 58.5710 29.6123 177.5141 1033 N 4.5246 9.0266 119.9720 53.5333 37.9116 174.3089 1034 G 3.8943 8.3675 107.1533 45.0353 0.0000 173.5114 1035 P 4.2328 0.0000 0.0000 64.8674 31.4635 177.1641 1036 F 4.6249 8.3557 116.2271 57.2833 39.3745 177.0186 1037 R 4.2427 7.6095 123.7489 55.1504 28.1610 175.2149 1038 T 4.8056 7.5024 108.9333 60.5643 70.8886 175.5809 1039 Y 4.6044 9.3317 125.6413 56.4528 38.7289 175.3719 1040 F 4.8572 9.6168 124.2988 58.2563 39.7249 175.2787 1041 R 4.6880 9.3337 118.9817 57.6127 33.1923 175.1971 1042 E 5.3093 8.0523 117.4477 54.9067 33.5390 173.4881 1043 L 4.8810 9.1571 124.2906 52.7974 45.9212 175.6156 1044 V 4.5269 8.0780 122.6620 61.1487 34.0618 173.9135 1045 F 5.1374 9.3018 127.4149 55.9010 41.4544 174.4091 1046 D 4.9970 8.9278 123.2742 52.5695 42.5434 176.3104 1047 D 4.5472 8.9710 126.9308 56.9910 41.4039 178.1162 1048 E 4.1816 8.4510 118.4878 58.8689 29.6242 177.9813 1049 K 4.1653 8.3880 115.2029 56.0685 33.0702 176.4879 1050 G 3.9491 8.1520 107.9484 47.1091 0.0000 172.5603 1051 T 5.4257 7.6481 107.2148 59.6267 73.6208 173.2785 1052 V 4.5752 8.6889 120.5418 61.3937 35.0210 173.2765 1053 D 5.1711 8.7767 128.4453 52.8236 42.8576 175.2924 1054 F 4.5936 9.3183 123.2228 55.9370 41.3936 174.4860 1055 Y 4.9553 8.6452 121.1169 56.1901 40.9204 174.7527 1056 F 5.5079 8.4305 118.6127 55.8164 42.4987 173.1531 1057 S 5.5710 9.6013 114.1370 57.1430 66.3646 174.1494 1058 V 5.1068 9.0878 115.4330 59.8575 36.4276 173.8627 1059 K 4.0874 8.2542 125.1931 54.9249 33.3812 175.9435 1060 R 4.4365 8.6995 126.2787 55.4859 33.0426 175.2650 1061 D 4.3987 9.7204 122.8055 55.5244 38.3986 174.5168 1062 G 3.8724 8.6099 103.3953 45.6552 0.0000 174.0622 1063 K 4.5740 7.5457 117.9132 53.9422 35.8258 175.5131 1064 W 4.8481 8.7511 123.1709 56.2798 30.2416 175.8535 1065 K 4.7643 9.4105 123.3056 54.7035 35.5302 174.8100 1066 N 5.2807 8.8704 121.5423 51.9604 39.9292 174.4738 1067 V 4.2260 8.7136 124.3790 61.0485 34.6300 173.7490 1068 H 4.9346 8.3722 125.2275 54.2153 32.2826 172.5264 1069 V 4.2898 8.4154 125.5272 60.8025 34.6641 173.7419 1070 K 4.9487 8.6324 128.2500 54.7365 33.8826 174.8686 1071 A 5.2171 9.3330 129.2065 50.5622 22.4072 175.0275 1072 T 4.9774 8.5699 117.2184 61.3934 71.4090 174.2544 1073 K 3.8507 8.6974 127.6727 56.2575 33.2808 175.6928 1074 Q 4.6250 8.1636 121.9490 53.5569 32.5520 176.3397 1075 D 4.4248 8.7239 119.0471 57.7002 40.9569 178.0067 1076 D 4.3097 7.9998 117.4236 56.1445 41.2099 176.8887 1077 G 3.9494 8.3612 106.6629 45.2138 0.0000 173.6422 1078 T 4.3806 7.5086 109.8822 61.2700 71.2272 172.9384 1079 Y 4.9995 8.3259 118.2022 56.0364 41.7077 175.3339 1080 V 5.3493 8.5959 120.8961 60.6407 35.2469 174.1176 1081 A 4.9547 8.3844 124.9199 51.2816 22.6679 174.5525 1082 D 5.3185 8.4332 119.9777 53.1619 42.5217 175.9257 1083 Y 4.3072 9.2222 120.1975 57.9177 41.9516 173.3502 1084 E 3.4794 9.5935 128.8269 57.7938 27.8534 172.9484 1085 G 3.8563 7.6896 103.8660 44.2720 0.0000 172.4864 1086 Q 5.0086 8.4454 118.2999 54.5147 31.2725 174.8877 1087 N 5.6183 9.0849 119.7784 51.5305 43.0202 173.8669 1088 V 4.6463 8.9133 121.8073 61.3215 34.5708 174.0999 1089 F 5.5683 9.0126 122.9965 54.8530 41.6447 173.8786 1090 K 4.9846 9.6086 120.9221 54.7726 35.4832 175.0793 1091 I 4.5045 8.6652 128.0543 60.9400 37.0355 175.7461 1092 V 3.9672 8.8578 128.8237 65.1769 32.3536 176.5008 1093 S 4.8205 7.9646 113.8461 56.5696 65.9066 172.4286 1094 L 5.1891 8.4992 127.3995 54.1683 44.3063 174.7104 1095 S 4.6023 8.7269 118.4795 57.4901 65.8215 174.7012 1096 R 4.0338 8.6406 118.3844 58.5632 29.9539 177.3522 1097 T 4.5860 8.1180 106.9181 61.3270 71.4398 173.3620 1098 H 5.8374 8.0789 117.1961 54.0589 32.9097 172.2098 1099 L 5.2689 9.4094 120.6299 53.6753 45.6881 174.7903 1100 V 4.9910 9.4466 126.3872 61.2259 34.0388 174.1306 1101 A 5.4424 9.1830 128.6572 50.4405 23.3987 173.7254 1102 H 5.4350 9.4773 118.8286 54.4407 33.0136 171.9158 1103 N 5.5349 9.5761 124.2609 51.8306 42.5234 172.7430 1104 I 4.8969 8.7238 126.0626 59.5283 40.0865 173.9672 1105 N 5.5117 9.2039 126.1284 51.6488 42.3965 173.2707 1106 V 4.9522 8.4632 125.0357 61.1475 34.5803 175.2393 1107 D 5.0513 8.6972 129.1439 52.1307 40.8058 176.9318 1108 K 4.1084 8.4601 117.1120 59.1303 32.3762 176.9323 1109 H 4.7807 8.2273 115.7118 55.4480 29.1364 174.9098 1110 G 3.9332 8.3110 106.7070 45.8104 0.0000 174.3464 1111 Q 4.1353 8.4912 120.2529 55.9118 29.2789 174.9338 1112 T 5.0711 8.3486 119.2217 62.4138 70.3391 174.2249 1113 T 4.6247 9.1031 122.7207 61.7398 72.5891 172.5799 1114 E 5.1243 9.0193 125.5894 54.6639 32.1509 175.0999 1115 L 5.3813 9.1572 123.7196 53.0597 46.0523 175.5941 1116 T 5.1901 8.5618 113.6703 60.9931 72.3327 173.2390 *1117 E 5.0249 8.8462 119.2700 55.2938 34.9634 174.3080 1118 L 5.1364 8.2877 123.4510 53.3459 45.0795 175.3174 1119 F 5.3587 9.4228 124.4227 55.7930 43.1354 174.4713 1120 V 5.1087 9.0719 114.5970 59.5601 35.2355 174.6250 1121 K 3.7721 8.1295 125.3537 54.9963 33.3297 176.4767 1122 L 4.3342 8.2409 127.6847 53.4874 41.7794 175.5802 1123 N 4.4584 8.3847 121.8901 51.8875 39.3992 175.2591 1124 V 4.1815 8.1111 123.3541 60.9071 32.7140 175.4587 1125 E 4.2807 8.4188 127.3797 55.9571 31.5384 177.5727 1126 D 4.4480 8.6373 122.1606 57.5893 41.0609 178.9627 1127 E 4.0064 8.1965 118.6167 59.6944 29.5406 179.0649 1128 D 4.4273 8.0513 118.3299 57.1850 40.9367 178.6258 1129 L 4.0875 8.0882 119.6711 57.8283 41.5604 179.4169 1130 E 4.1735 8.5486 118.6993 59.2857 29.4183 179.2405 1131 K 3.9418 8.0993 119.5889 59.4235 32.1662 178.6511 1132 F 4.0284 8.3363 120.8588 61.1792 39.2894 177.2446 1133 W 4.0487 8.3738 118.7276 59.3311 28.7829 178.5690 1134 K 3.9464 8.4074 119.8993 59.4270 31.7254 178.5477 1135 L 3.8986 7.7886 120.6003 58.5915 41.9403 179.0859 1136 T 3.6471 7.7074 115.7639 66.4795 68.2763 176.3151 1137 E 3.9689 8.3148 121.3634 59.3113 29.4575 178.4680 1138 D 4.4257 8.3403 118.4886 57.1730 40.9367 178.0875 1139 K 4.3665 7.8786 116.0346 55.5157 32.1669 176.9606 1140 G 3.9418 7.7789 107.0436 46.5694 0.0000 173.8640 1141 I 4.2685 7.4864 120.2221 59.2586 38.6168 175.7711 1142 D 4.5752 8.4943 124.8114 53.6457 41.6562 176.9756 1143 K 4.3242 8.8861 125.2057 59.5644 32.1969 178.8327 1144 K 4.2601 8.2754 115.5678 58.4623 32.8628 176.7307 1145 N 4.9634 8.4264 117.6487 53.3245 39.0220 174.6732 1146 V 4.4843 7.5138 117.1150 60.9900 33.9530 174.5795 1147 V 4.2037 8.4410 126.3848 61.0037 33.0809 174.1827 1148 N 4.7315 8.5068 125.4568 52.6896 39.1052 174.5146 1149 F 4.4589 8.8576 123.8410 57.9477 39.9617 177.0527 1150 L 4.2553 8.3892 121.3832 56.5569 41.8466 177.1749 1151 E 4.5902 8.0890 116.1737 53.8351 28.9065 173.1835 1152 N 4.8930 7.8492 122.1363 52.1970 42.4904 173.7403 1153 E 3.9939 9.0061 124.0165 59.4441 29.6950 177.3053 1154 N 4.4747 7.7776 120.0033 52.5624 37.2930 172.9941 1155 H 4.9578 7.5369 117.8428 52.2395 32.0584 172.1022 1156 P 4.2322 0.0000 0.0000 63.0029 31.7194 175.4732 1157 H 4.4525 8.1605 117.2500 53.3087 30.2443 174.5253 1158 P 4.2671 0.0000 0.0000 64.6883 31.6578 176.1125 1159 E 4.5452 7.8354 122.3590 57.1235 29.6247 175.2224 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 8.25 4.40 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 Q 8.27 4.32 0.00 2.25 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 1003 E 9.43 4.25 0.00 2.10 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 2.27 2.32 0.00 1004 E 8.13 4.63 0.00 1.96 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 2.22 2.21 0.00 1005 E 8.59 3.91 0.00 1.89 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 0.00 2.29 2.38 0.00 1006 A 8.19 4.52 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 1007 E 8.81 3.92 0.00 1.92 1.92 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 2.29 2.36 0.00 1008 Q 8.51 4.55 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.93 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 1009 N 8.46 5.16 0.00 2.69 2.70 0.00 0.00 7.07 7.85 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 1010 L 9.48 4.36 0.00 1.44 0.84 0.78 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 1011 S 8.72 4.43 0.00 4.04 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 1012 E 8.35 3.99 0.00 1.98 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 2.32 2.38 0.00 1013 L 7.94 4.45 0.00 1.58 2.10 0.89 1.12 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 1014 S 8.09 4.72 0.00 4.09 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 1015 G 8.26 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 0.00 0.00 0.00 1016 P 0.00 5.19 0.00 2.15 2.23 0.00 3.64 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 2.20 1.98 0.00 1017 W 9.00 5.47 0.00 3.33 3.40 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 1018 R 9.44 5.24 0.00 1.76 1.89 0.00 3.41 0.00 0.00 3.53 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 1019 T 8.84 4.16 4.18 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 0.90 0.00 0.00 1020 V 8.37 4.00 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 0.49 0.00 0.00 0.90 0.00 0.00 1021 Y 7.27 4.93 0.00 2.79 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 1022 I 8.39 4.85 1.80 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 1.04 0.33 0.89 0.00 0.00 1023 G 9.18 4.28 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 0.00 1024 S 8.17 5.22 0.00 3.79 3.65 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 1025 T 8.62 4.05 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 1.18 0.00 0.00 1026 N 8.14 4.81 0.00 2.70 2.69 0.00 0.00 6.75 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1027 P 0.00 4.32 0.00 2.42 2.31 0.00 3.75 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 1028 E 8.42 4.02 0.00 2.28 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 0.00 2.34 2.30 0.00 1029 K 8.17 4.25 0.00 1.92 2.03 0.00 1.80 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.51 7.81 1030 I 7.43 4.50 1.90 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 1.40 0.68 0.97 0.00 0.00 1031 Q 7.61 4.31 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.95 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 1032 E 8.48 4.07 0.00 1.96 1.92 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 2.37 2.35 0.00 1033 N 9.03 4.52 0.00 2.84 2.96 0.00 0.00 7.09 7.98 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 1034 G 8.37 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 0.00 0.00 0.00 1035 P 0.00 4.23 0.00 1.87 2.08 0.00 3.93 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.05 0.00 1036 F 8.36 4.62 0.00 3.19 3.13 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 1037 R 7.61 4.24 0.00 1.91 2.05 0.00 3.33 0.00 0.00 3.86 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.57 0.00 1038 T 7.50 4.81 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 0.87 0.00 0.00 1039 Y 9.33 4.60 0.00 3.20 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 1040 F 9.62 4.86 0.00 3.13 3.32 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 1041 R 9.33 4.69 0.00 1.98 1.97 0.00 3.14 0.00 0.00 3.15 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 1042 E 8.05 5.31 0.00 2.05 1.72 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 2.16 2.54 0.00 1043 L 9.16 4.88 0.00 1.20 0.60 -0.10 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 1044 V 8.08 4.53 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 1.09 0.00 0.00 0.98 0.00 0.00 1045 F 9.30 5.14 0.00 3.09 2.93 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 1046 D 8.93 5.00 0.00 2.78 2.58 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 1047 D 8.97 4.55 0.00 2.75 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 1048 E 8.45 4.18 0.00 2.13 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 2.36 2.30 0.00 1049 K 8.39 4.17 0.00 1.86 1.88 0.00 1.93 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.40 7.81 1050 G 8.15 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 1051 T 7.65 5.43 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 1.32 0.00 0.00 1052 V 8.69 4.58 1.92 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 -0.36 0.00 0.00 0.81 0.00 0.00 1053 D 8.78 5.17 0.00 2.67 2.41 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 1054 F 9.32 4.59 0.00 2.68 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 1055 Y 8.65 4.96 0.00 3.02 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 1056 F 8.43 5.51 0.00 3.32 2.87 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 1057 S 9.60 5.57 0.00 4.07 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 0.00 1058 V 9.09 5.11 2.23 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 1.06 0.00 0.00 1.16 0.00 0.00 1059 K 8.25 4.09 0.00 0.79 1.11 0.00 1.08 0.00 0.00 1.36 0.00 0.00 2.51 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.83 0.21 7.81 1060 R 8.70 4.44 0.00 1.72 1.72 0.00 3.46 0.00 0.00 3.13 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.70 0.00 1061 D 9.72 4.40 0.00 2.77 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 1062 G 8.61 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 1063 K 7.55 4.57 0.00 1.98 1.63 0.00 1.58 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.43 7.81 1064 W 8.75 4.85 0.00 3.20 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 1065 K 9.41 4.76 0.00 1.90 1.70 0.00 1.58 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.45 7.81 1066 N 8.87 5.28 0.00 2.62 2.78 0.00 0.00 6.77 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 1067 V 8.71 4.23 0.67 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 0.58 0.00 0.00 0.81 0.00 0.00 1068 H 8.37 4.93 0.00 2.91 3.00 0.00 5.92 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1069 V 8.42 4.29 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 0.86 0.00 0.00 0.80 0.00 0.00 1070 K 8.63 4.95 0.00 1.75 1.69 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.63 7.81 1071 A 9.33 5.22 1.68 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 0.00 0.00 1072 T 8.57 4.98 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 1.21 0.00 0.00 1073 K 8.70 3.85 0.00 1.29 1.50 0.00 1.57 0.00 0.00 1.56 0.00 0.00 2.76 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.08 0.53 7.81 1074 Q 8.16 4.62 0.00 2.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.50 0.00 0.00 0.00 0.00 0.00 2.17 2.29 0.00 1075 D 8.72 4.42 0.00 2.62 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 1076 D 8.00 4.31 0.00 2.58 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 1077 G 8.36 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 1078 T 7.51 4.38 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 1.19 0.00 0.00 1079 Y 8.33 5.00 0.00 1.51 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 1080 V 8.60 5.35 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 1.22 0.00 0.00 0.91 0.00 0.00 1081 A 8.38 4.95 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 1082 D 8.43 5.32 0.00 2.61 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 1083 Y 9.22 4.31 0.00 2.84 2.98 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 1084 E 9.59 3.48 0.00 1.53 1.76 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 1.47 1.47 0.00 1085 G 7.69 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 1086 Q 8.45 5.01 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.69 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 1087 N 9.08 5.62 0.00 2.95 2.83 0.00 0.00 6.21 7.03 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 1088 V 8.91 4.65 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 1.06 0.00 0.00 0.94 0.00 0.00 1089 F 9.01 5.57 0.00 3.26 3.13 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 1090 K 9.61 4.98 0.00 1.80 1.76 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.38 1.58 7.81 1091 I 8.67 4.50 2.02 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.95 0.99 0.00 0.00 1092 V 8.86 3.97 2.27 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 0.75 0.00 0.00 1.08 0.00 0.00 1093 S 7.96 4.82 0.00 3.97 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 1094 L 8.50 5.19 0.00 1.64 1.46 0.97 0.71 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 1095 S 8.73 4.60 0.00 4.05 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 1096 R 8.64 4.03 0.00 1.83 2.03 0.00 3.15 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 1097 T 8.12 4.59 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 1.18 0.00 0.00 1098 H 8.08 5.84 0.00 3.56 3.49 0.00 5.41 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1099 L 9.41 5.27 0.00 1.71 1.70 0.99 0.47 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 1100 V 9.45 4.99 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 1.03 0.00 0.00 1.05 0.00 0.00 1101 A 9.18 5.44 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 1102 H 9.48 5.44 0.00 3.19 3.20 0.00 5.55 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1103 N 9.58 5.53 0.00 2.74 2.55 0.00 0.00 6.60 7.89 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 1104 I 8.72 4.90 1.86 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 1.09 0.59 0.90 0.00 0.00 1105 N 9.20 5.51 0.00 2.58 2.37 0.00 0.00 6.15 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 1106 V 8.46 4.95 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 0.92 0.00 0.00 0.94 0.00 0.00 1107 D 8.70 5.05 0.00 2.94 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 0.00 1108 K 8.46 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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 1.16 0.00 0.00 *1117 E 8.85 5.02 0.00 1.65 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 1118 L 8.29 5.14 0.00 1.68 1.47 1.06 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 1119 F 9.42 5.36 0.00 3.22 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 1120 V 9.07 5.11 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 1.02 0.00 0.00 1121 K 8.13 3.77 0.00 0.79 0.86 0.00 1.49 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.87 0.44 7.81 1122 L 8.24 4.33 0.00 1.45 1.56 0.89 1.05 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 1123 N 8.38 4.46 0.00 2.63 2.69 0.00 0.00 6.93 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 1124 V 8.11 4.18 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 0.80 0.00 0.00 0.88 0.00 0.00 1125 E 8.42 4.28 0.00 2.28 1.85 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 2.39 2.38 0.00 1126 D 8.64 4.45 0.00 2.75 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 1127 E 8.20 4.01 0.00 2.02 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 2.42 2.43 0.00 1128 D 8.05 4.43 0.00 2.79 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 1129 L 8.09 4.09 0.00 2.01 1.99 1.02 0.89 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 1130 E 8.55 4.17 0.00 2.27 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 0.00 2.43 2.54 0.00 1131 K 8.10 3.94 0.00 2.09 1.99 0.00 1.54 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.51 7.81 1132 F 8.34 4.03 0.00 2.94 2.95 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 1133 W 8.37 4.05 0.00 3.50 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 1134 K 8.41 3.95 0.00 1.86 1.95 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.46 7.81 1135 L 7.79 3.90 0.00 1.81 1.70 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 1136 T 7.71 3.65 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 1.12 0.00 0.00 1137 E 8.31 3.97 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 1138 D 8.34 4.43 0.00 2.80 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 1139 K 7.88 4.37 0.00 1.69 1.80 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.54 7.81 1140 G 7.78 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 1141 I 7.49 4.27 1.99 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 1.18 0.78 0.95 0.00 0.00 1142 D 8.49 4.58 0.00 2.73 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 1143 K 8.89 4.32 0.00 1.86 1.89 0.00 1.57 0.00 0.00 1.58 0.00 0.00 2.68 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.43 1.42 7.81 1144 K 8.28 4.26 0.00 1.88 1.96 0.00 1.57 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.48 7.81 1145 N 8.43 4.96 0.00 2.85 2.90 0.00 0.00 6.65 7.56 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 1146 V 7.51 4.48 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 0.94 0.00 0.00 1.21 0.00 0.00 1147 V 8.44 4.20 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 0.22 0.00 0.00 0.89 0.00 0.00 1148 N 8.51 4.73 0.00 2.75 2.69 0.00 0.00 7.06 7.02 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 1149 F 8.86 4.46 0.00 2.94 3.07 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 1150 L 8.39 4.26 0.00 1.75 1.72 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 1151 E 8.09 4.59 0.00 1.98 1.90 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 2.30 2.22 0.00 1152 N 7.85 4.89 0.00 2.68 2.57 0.00 0.00 7.31 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 1153 E 9.01 3.99 0.00 2.07 2.04 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 0.00 2.23 2.24 0.00 1154 N 7.78 4.47 0.00 2.63 2.71 0.00 0.00 6.71 7.89 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 1155 H 7.54 4.96 0.00 3.10 3.15 0.00 5.78 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1156 P 0.00 4.23 0.00 1.98 1.96 0.00 3.62 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 2.00 2.07 0.00 1157 H 8.16 4.45 0.00 3.15 3.25 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1158 P 0.00 4.27 0.00 1.88 1.78 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.53 0.00 1159 E 7.84 4.55 0.00 2.24 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 0.00 2.48 2.64 0.00 * Residues marked with a * may have inaccurate shift predictions.