NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1005 R 4.2304 8.2549 121.1171 55.1025 31.4575 174.9555 1006 P 4.3607 0.0000 0.0000 61.5820 31.6513 172.3217 1007 E 4.9362 9.3670 122.8619 53.6975 33.5473 172.8330 1008 P 5.2352 0.0000 0.0000 62.6237 32.7292 175.2182 1009 R 4.6244 8.8436 118.2271 55.0682 33.3541 173.4684 1010 L 4.8553 8.4772 123.1174 54.7628 42.8584 175.5763 1011 I 5.5664 8.7433 118.9793 58.8738 42.2434 173.7135 1012 T 5.0860 8.6329 117.6013 61.8496 71.8046 173.4322 1013 I 4.8778 9.3642 127.7496 59.3492 40.1013 174.2212 1014 L 5.2209 8.8210 128.8483 53.2281 44.9422 174.8448 1015 F 5.3158 9.6165 124.8025 55.7856 42.1011 174.0384 1016 S 5.2718 9.0092 118.4074 56.7331 65.7081 172.5870 1017 D 4.8616 8.9616 125.1205 53.0768 44.6285 174.4273 1018 I 4.4600 8.1659 128.5921 61.5069 37.6293 176.3917 1019 V 3.7251 9.1323 128.2349 61.7391 31.9481 176.6670 1020 G 4.0100 8.6776 113.1210 46.6148 0.0000 174.4225 1021 F 4.3301 8.1298 118.6833 60.4539 40.2346 175.4479 1022 T 3.9845 7.7947 115.2020 66.4921 68.5904 176.8011 1023 R 3.8768 7.8311 119.7998 59.3096 30.0418 178.3015 1024 M 4.2409 7.2584 112.4481 56.5417 31.6955 177.8116 1025 S 3.7190 7.2058 113.7259 59.6727 62.7257 173.2562 1026 N 4.3756 7.0629 118.8126 53.4592 39.8128 174.1865 1027 A 3.5645 9.2672 126.9847 52.3407 15.3263 177.2218 1028 L 4.2446 7.7716 120.2675 54.8435 48.2613 174.7388 1029 Q 2.9095 8.1582 114.0826 56.7135 29.9780 173.9090 1030 S 3.9953 8.4606 110.3948 62.2542 62.0501 176.2496 1031 Q 4.0315 8.0423 121.2669 59.0939 28.9091 177.8263 1032 G 4.1208 8.0224 107.5605 47.3192 0.0000 175.2011 1033 V 3.6279 7.8364 120.9564 65.4640 31.5017 177.7165 1034 A 3.9885 7.8301 119.6814 55.6952 18.2600 179.5443 1035 E 4.0404 8.2984 116.4237 58.8943 29.5910 179.3544 1036 L 3.8837 8.2048 121.1077 58.0010 42.0280 179.0915 1037 L 3.9663 8.0267 118.9006 57.9246 41.6320 179.1265 1038 N 4.1413 8.2677 116.4162 56.3610 38.4405 177.4005 1039 E 4.0355 8.5040 119.9611 59.4710 29.6311 178.6110 1040 Y 4.1941 8.1975 119.5141 61.0058 38.9926 178.2887 1041 L 3.7669 8.9025 120.9611 57.3128 41.4681 179.9578 1042 G 3.5114 7.9868 105.8250 47.9860 0.0000 175.7930 1043 E 3.9724 8.1855 121.7035 58.9366 29.3673 179.5323 1044 M 3.8335 7.8248 119.1610 58.4610 32.0046 178.8999 1045 T 3.5206 7.6984 109.8087 64.4273 68.5942 176.5156 1046 R 3.8015 7.5087 121.2416 59.1956 29.7085 178.3194 1047 A 3.9604 7.6005 120.3007 54.9817 18.2422 179.8739 1048 V 3.4725 7.6377 116.7267 66.2494 31.7522 178.2822 1049 F 4.5210 8.3158 117.9642 60.7724 38.6159 177.1500 1050 E 4.3741 8.5564 115.8484 57.7553 29.2282 177.2094 1051 N 4.9218 7.2181 115.6513 52.8648 39.1623 174.8216 1052 Q 3.5918 8.0997 114.3011 56.7220 26.7426 173.8929 1053 G 3.5137 8.1829 105.9320 45.6342 0.0000 173.6892 1054 T 4.7033 7.6414 115.6974 61.4357 71.7915 174.1072 1055 V 3.8980 8.6049 126.5979 62.1118 31.2857 175.0568 1056 D 4.5853 9.3619 129.6720 55.9246 42.0713 175.9637 1057 K 4.1643 7.0479 114.5683 56.6771 35.4122 172.5558 1058 F 5.3768 8.6440 118.3743 55.8751 41.5312 176.7319 1059 V 4.3684 9.0682 122.6098 60.6708 32.8224 177.9319 1060 G 3.8280 8.9376 118.4689 45.9614 0.0000 171.4066 1061 D 4.7303 9.2935 117.4785 52.7418 40.7533 176.2431 1062 A 5.0491 7.9590 121.4259 50.9166 21.7434 176.5191 1063 I 4.8569 8.8326 121.4301 59.6462 40.8283 174.5501 1064 M 4.6306 8.7717 125.7895 53.8081 34.3460 173.8739 1065 A 5.1127 8.5557 128.5163 50.0378 22.4452 175.0009 1066 L 5.1536 8.5393 120.3745 53.0486 45.8279 175.3707 1067 Y 4.5588 9.1088 120.0971 58.2207 40.7520 175.8573 1068 G 4.0045 9.2003 111.6583 45.1087 0.0000 172.8304 1069 A 4.6641 7.4394 120.1179 50.4060 21.8157 175.3058 1070 P 4.5282 0.0000 0.0000 65.2043 31.8264 177.1171 1071 E 4.0391 7.8715 118.8549 55.6969 29.9235 176.2337 1072 E 4.1122 8.5388 124.4344 56.6007 30.4256 175.6740 1073 M 4.7350 8.1635 123.6186 52.8855 35.5272 175.0794 1074 S 4.3214 8.6043 120.9128 57.7422 64.8281 173.3459 1075 P 4.2147 0.0000 0.0000 66.2186 31.1761 179.1133 1076 S 3.7858 8.0658 111.8911 60.9332 63.1921 176.1616 1077 E 3.9271 7.7182 121.6765 59.0877 29.2235 178.8842 1078 Q 3.9916 8.0859 118.3032 59.1304 28.7773 179.4431 1079 V 3.2494 6.8721 117.5359 65.6830 31.4742 177.7605 1080 R 3.7788 7.5642 118.4608 59.7812 29.8696 178.7453 1081 R 3.8724 7.9670 117.3573 58.9176 29.9550 178.9592 1082 A 2.9317 7.1855 120.4660 54.9231 18.3073 179.8223 1083 I 3.5815 7.8724 118.4940 64.3102 37.0146 178.5919 1084 A 4.0060 8.0071 121.8045 55.2486 18.0895 179.7795 1085 T 3.7929 8.2159 114.4455 66.7860 68.7399 176.5141 1086 A 4.0774 8.1173 122.6424 55.4135 18.5068 179.9252 1087 R 3.9147 8.0627 116.3759 59.5756 30.1260 179.1962 1088 Q 4.0537 8.4941 119.5542 59.2657 28.9516 178.1647 1089 M 4.1001 8.3995 120.4441 58.3153 31.7495 178.6599 1090 L 4.1234 7.8861 117.9768 57.6158 42.0885 179.4344 1091 V 3.7155 7.8035 117.5907 66.0387 31.5504 177.9369 1092 A 3.9863 8.2594 120.6947 55.1518 18.1572 179.3755 1093 L 4.1156 8.2314 119.0723 57.9073 42.0790 179.1058 1094 E 3.9337 8.0441 118.0258 59.2925 29.6612 179.1002 1095 K 3.8427 7.8714 120.3358 58.7639 32.0721 178.6484 1096 L 3.1765 7.4008 118.4404 57.6465 41.7877 178.8755 1097 N 4.6959 7.6619 116.2382 56.4888 38.2544 177.3340 1098 Q 4.1086 8.0188 120.2460 58.5413 29.2115 177.5185 1099 G 3.7822 7.7356 104.8832 44.8702 0.0000 174.4215 1100 W 5.0929 7.6636 120.5124 56.6924 29.3783 177.5674 1101 Q 4.0226 7.9195 120.3965 58.4645 28.7851 177.8115 1102 E 4.1283 8.1503 115.4072 58.2628 29.8451 177.4339 1103 R 4.3095 7.4633 116.1080 55.5736 30.6202 176.8063 1104 G 4.1508 6.8535 111.9841 47.2453 0.0000 177.6542 1105 L 3.2610 6.3743 116.9950 55.7462 42.9078 176.9339 1106 V 4.0130 7.4360 118.9781 63.4321 33.0602 175.9930 1107 G 3.6386 7.8902 111.1023 46.2000 0.0000 173.7539 *1110 E 4.1799 7.4097 112.0841 55.6828 31.2720 178.6833 1111 V 4.4074 7.1621 116.5880 61.2221 32.7536 170.7707 1112 P 4.5119 0.0000 0.0000 60.7006 32.5137 175.0506 1113 P 4.5050 0.0000 0.0000 62.6200 31.5247 176.4031 1114 V 3.8377 8.6425 120.9705 63.4163 32.2645 175.4743 1115 R 4.9642 8.3093 123.6399 54.6576 34.8385 173.7691 1116 F 5.5588 8.1767 115.0815 55.4436 42.2897 173.1882 1117 R 5.0081 9.3397 119.3427 54.8126 32.5004 174.8091 1118 C 5.5958 8.9067 123.7016 57.5769 34.8139 172.6954 1119 G 4.6708 9.6722 113.0496 44.5324 0.0000 171.6037 1120 I 5.3563 8.5522 124.1589 59.8934 41.3203 173.9868 1121 H 5.1389 9.1687 124.1312 55.0395 33.7455 171.6973 1122 Q 4.9400 8.2050 124.7124 53.9183 31.7571 174.6205 1123 G 4.0177 8.4279 112.2004 46.3044 0.0000 171.7204 1124 M 4.9442 8.7100 119.2431 55.5689 32.7163 176.2166 1125 A 4.6466 8.6243 121.9127 50.9984 23.6669 175.4235 1126 V 4.3995 8.8064 121.2900 62.2787 32.9493 175.1832 1127 V 4.7153 10.6914 128.8112 60.7933 34.9579 176.3639 1128 G 3.6407 6.9609 112.3717 45.1148 0.0000 170.9668 1129 L 4.8138 8.0095 122.1361 53.9721 42.1204 176.1514 1130 F 4.7660 9.3023 122.6005 56.0334 41.9490 174.9417 1131 G 3.9713 8.2526 108.8337 44.7296 0.0000 173.2116 1132 S 4.7639 8.2189 116.1900 56.7136 65.0709 175.2881 1133 Q 4.3732 8.5192 116.5649 56.5482 27.0527 176.5451 1134 E 4.3726 7.9390 115.4246 55.9745 32.8865 175.7629 1135 R 4.4132 8.3720 125.4901 55.1532 30.4828 175.7406 1136 S 5.2871 8.3303 119.2743 56.8426 66.3329 173.0624 1137 D 4.9674 8.7305 120.0400 52.5643 45.5978 174.2756 1138 F 4.9087 8.9130 124.2350 58.4016 40.1648 174.2890 1139 T 5.1140 8.3025 118.8378 62.0262 71.4661 171.2649 1140 A 4.9970 8.3211 124.0637 50.0752 21.5957 175.9818 1141 I 4.4141 9.2892 120.9195 59.5168 41.9667 174.7290 1142 G 4.6008 8.9285 110.4608 42.4497 0.0000 172.5017 1143 P 4.2774 0.0000 0.0000 65.6907 31.0078 179.1520 1144 S 4.2251 8.1142 113.5343 61.6054 62.7988 176.7483 1145 V 3.7270 7.7624 120.3703 66.1077 31.2904 177.6329 1146 N 4.2892 8.2363 115.7277 56.6299 38.4243 177.2166 1147 I 3.7017 7.9906 120.7595 64.1932 37.1557 178.3737 1148 A 4.0848 8.0092 121.1007 55.1665 18.2921 179.5770 1149 A 3.3049 8.0748 119.2301 55.2477 18.3884 180.1609 1150 R 3.8702 8.3308 117.0007 59.1456 29.9314 179.3313 1151 L 3.9833 8.4207 119.2979 57.8628 41.4309 179.2604 1152 Q 4.0486 7.9685 118.2369 59.3585 29.0852 177.9779 1153 E 4.1202 8.1423 118.1445 58.4323 29.6235 178.1048 1154 A 4.3674 7.6392 118.8031 51.9239 19.5778 177.0786 1155 T 4.2491 6.8815 111.8701 60.4820 68.5612 174.3193 1156 A 4.2838 8.2298 129.0421 50.7955 19.2103 175.8396 1157 P 4.2871 0.0000 0.0000 64.1762 31.6996 175.8640 1158 N 3.8768 8.7055 117.3977 54.3873 36.3770 173.7911 1159 S 4.8163 7.6939 110.5511 56.6148 67.6746 172.5140 1160 I 4.8777 8.2119 119.2546 59.9694 40.2004 174.1178 1161 M 5.0037 8.8466 128.0817 53.9018 34.1992 175.2441 1162 V 5.5501 9.1783 118.7737 58.2480 36.4636 175.5658 1163 S 4.7520 8.5754 116.7221 57.4432 64.3932 175.0907 1164 A 3.9381 8.5226 122.3362 55.6696 17.6655 179.7941 1165 M 4.1639 8.0833 115.6931 58.3156 32.1859 178.8204 1166 V 3.9452 7.4267 117.3574 65.9711 31.9756 177.8550 1167 A 4.0297 8.2197 120.7745 55.2168 17.8680 179.3206 1168 Q 4.1833 7.9533 115.1218 58.7638 28.5108 176.9373 1169 Y 4.4326 8.0311 116.7101 57.7193 38.6944 175.3218 1170 V 4.3248 7.8523 120.9260 60.1179 33.2761 173.7687 1171 P 4.3836 0.0000 0.0000 62.5464 31.9590 177.1196 1172 D 4.6544 8.8852 122.3030 57.3321 41.0431 178.5844 1173 E 3.9204 8.2717 118.8326 58.7721 29.7781 176.9905 1174 E 4.3607 8.6864 116.5248 56.0257 29.7967 175.4880 1175 I 4.3947 7.3354 121.3811 60.1740 36.7060 175.7080 1176 I 3.9810 8.3517 127.9172 63.9121 37.6493 177.0889 1177 K 4.6232 7.8574 121.2993 55.0493 35.8019 174.6396 1178 R 5.0502 8.4649 125.3786 54.4394 32.4557 174.9226 1179 E 4.7287 8.6322 123.3882 54.8787 33.6446 173.7803 1180 F 4.7980 8.8759 129.0015 58.1413 40.5879 174.3725 1181 L 4.9795 9.3876 124.1468 53.2828 46.5684 174.8020 1182 E 4.9272 8.8350 120.9102 54.8728 30.6364 175.6992 1183 L 4.6933 8.3748 123.9220 52.5354 44.3370 175.5900 1184 K 4.0980 8.3079 121.8899 57.4365 32.7323 177.4979 1185 G 3.9843 9.0958 113.5587 45.2100 0.0000 173.0500 1186 I 4.4970 7.0169 119.3537 59.2483 39.4711 174.0982 1187 D 4.3647 8.3760 127.6017 55.4046 40.8763 176.4697 1188 E 3.8704 8.4253 120.7106 56.7790 30.5872 175.5354 1189 P 4.6557 0.0000 0.0000 63.1469 32.5488 175.4896 1190 V 4.5213 9.3446 119.7312 61.4568 35.1294 173.9465 1191 M 3.8883 8.6335 127.9634 55.5969 32.9892 174.7824 1192 T 5.0930 8.3859 116.8834 60.3253 72.5828 173.2577 1193 C 5.2046 9.0748 119.9410 58.4268 33.0755 173.2591 1194 V 4.5749 8.6359 124.7707 62.0733 32.2633 174.8818 1195 I 4.8941 8.3798 122.1152 58.9562 39.8064 175.1077 1196 N 4.5711 9.2046 124.0302 53.1212 38.9331 173.4664 1197 P 4.4694 0.0000 0.0000 64.2678 31.6857 175.5992 1198 N 5.0714 8.5879 116.3981 51.6726 42.0855 174.0160 1199 M 5.1497 8.4385 117.9417 55.3804 32.3556 175.9427 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 1005 R 8.25 4.23 0.00 1.79 1.86 0.00 3.19 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.57 0.00 1006 P 0.00 4.36 0.00 1.76 1.58 0.00 3.41 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.31 0.00 1007 E 9.37 4.94 0.00 1.96 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 2.21 2.24 0.00 1008 P 0.00 5.24 0.00 2.12 2.12 0.00 3.82 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 1009 R 8.84 4.62 0.00 1.89 2.05 0.00 2.93 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 1010 L 8.48 4.86 0.00 1.69 1.65 0.97 0.98 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 1011 I 8.74 5.57 1.90 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 1.25 1.53 0.94 0.00 0.00 1012 T 8.63 5.09 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 1.16 0.00 0.00 1013 I 9.36 4.88 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.69 0.58 0.00 0.00 1014 L 8.82 5.22 0.00 1.74 1.60 0.96 0.98 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 1015 F 9.62 5.32 0.00 3.06 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 1016 S 9.01 5.27 0.00 3.67 3.54 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.96 4.86 0.00 2.99 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 1018 I 8.17 4.46 1.99 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.30 0.92 0.00 0.00 1019 V 9.13 3.73 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 0.68 0.00 0.00 0.96 0.00 0.00 1020 G 8.68 4.01 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 1021 F 8.13 4.33 0.00 2.94 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 1022 T 7.79 3.98 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 1.17 0.00 0.00 1023 R 7.83 3.88 0.00 1.88 1.93 0.00 3.25 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.61 0.00 1024 M 7.26 4.24 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.47 0.00 1025 S 7.21 3.72 0.00 3.68 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 1026 N 7.06 4.38 0.00 2.68 2.62 0.00 0.00 7.19 7.84 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 1027 A 9.27 3.56 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 1028 L 7.77 4.24 0.00 1.69 1.44 0.78 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 1029 Q 8.16 2.91 0.00 2.31 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.52 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 1030 S 8.46 4.00 0.00 3.89 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 1031 Q 8.04 4.03 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.63 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 1032 G 8.02 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1033 V 7.84 3.63 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 1.22 0.00 0.00 0.84 0.00 0.00 1034 A 7.83 3.99 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 1035 E 8.30 4.04 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 1036 L 8.20 3.88 0.00 1.52 1.64 0.50 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 1037 L 8.03 3.97 0.00 2.04 1.63 0.72 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 1038 N 8.27 4.14 0.00 2.76 2.88 0.00 0.00 7.09 7.24 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 1039 E 8.50 4.04 0.00 2.35 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 3.39 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 1116 F 8.18 5.56 0.00 3.15 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 1117 R 9.34 5.01 0.00 1.85 2.12 0.00 3.11 0.00 0.00 3.42 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 1118 C 8.91 5.60 0.00 3.46 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 1119 G 9.67 4.67 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 0.00 0.00 0.00 0.00 1120 I 8.55 5.36 1.89 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 1.12 1.29 0.86 0.00 0.00 1121 H 9.17 5.14 0.00 3.28 3.17 0.00 5.72 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1122 Q 8.21 4.94 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.49 0.00 1123 G 8.43 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1124 M 8.71 4.94 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.52 0.00 1125 A 8.62 4.65 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 1126 V 8.81 4.40 2.25 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 1.22 0.00 0.00 1.00 0.00 0.00 1127 V 10.69 4.72 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 0.63 0.00 0.00 0.96 0.00 0.00 1128 G 6.96 3.64 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 0.00 0.00 0.00 1129 L 8.01 4.81 0.00 1.63 1.66 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 1130 F 9.30 4.77 0.00 3.04 2.94 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 1131 G 8.25 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 1132 S 8.22 4.76 0.00 4.33 4.01 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 1133 Q 8.52 4.37 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 1134 E 7.94 4.37 0.00 1.84 1.80 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 2.23 2.25 0.00 1135 R 8.37 4.41 0.00 1.92 1.84 0.00 3.11 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 1136 S 8.33 5.29 0.00 3.89 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 1137 D 8.73 4.97 0.00 2.60 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 1138 F 8.91 4.91 0.00 3.03 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1139 T 8.30 5.11 4.15 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 0.00 0.00 1.01 0.00 0.00 1140 A 8.32 5.00 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 1141 I 9.29 4.41 1.45 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.14 0.75 0.00 0.00 1142 G 8.93 4.60 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 0.00 1143 P 0.00 4.28 0.00 2.19 2.14 0.00 3.63 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 2.13 2.20 0.00 1144 S 8.11 4.23 0.00 3.95 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1145 V 7.76 3.73 2.26 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 1.23 0.00 0.00 1.01 0.00 0.00 1146 N 8.24 4.29 0.00 3.04 2.85 0.00 0.00 7.10 7.36 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 1147 I 7.99 3.70 1.89 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 1.43 0.79 0.77 0.00 0.00 1148 A 8.01 4.08 1.70 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 0.00 0.00 1149 A 8.07 3.30 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1150 R 8.33 3.87 0.00 1.97 1.97 0.00 3.47 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.87 0.00 1151 L 8.42 3.98 0.00 1.93 1.76 0.98 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 1152 Q 7.97 4.05 0.00 2.25 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.02 0.00 0.00 0.00 0.00 0.00 2.49 2.91 0.00 1153 E 8.14 4.12 0.00 2.10 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 2.30 2.51 0.00 1154 A 7.64 4.37 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 1155 T 6.88 4.25 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 1.42 0.00 0.00 1156 A 8.23 4.28 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 1157 P 0.00 4.29 0.00 2.17 2.08 0.00 3.92 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 1.98 1.99 0.00 1158 N 8.71 3.88 0.00 2.78 2.81 0.00 0.00 6.75 7.95 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 1159 S 7.69 4.82 0.00 3.84 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 1160 I 8.21 4.88 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.84 0.96 0.00 0.00 1161 M 8.85 5.00 0.00 2.14 1.94 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.51 0.00 1162 V 9.18 5.55 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 0.95 0.00 0.00 1.02 0.00 0.00 1163 S 8.58 4.75 0.00 4.07 4.10 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 0.00 0.00 0.00 1164 A 8.52 3.94 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 1165 M 8.08 4.16 0.00 2.04 2.20 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 2.64 2.71 0.00 1166 V 7.43 3.95 2.29 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 1.10 0.00 0.00 0.97 0.00 0.00 1167 A 8.22 4.03 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 1168 Q 7.95 4.18 0.00 2.06 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.70 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 1169 Y 8.03 4.43 0.00 2.90 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1170 V 7.85 4.32 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 0.83 0.00 0.00 0.98 0.00 0.00 1171 P 0.00 4.38 0.00 2.22 1.96 0.00 3.89 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 2.12 2.12 0.00 1172 D 8.89 4.65 0.00 2.69 2.73 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 1173 E 8.27 3.92 0.00 1.92 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 2.29 2.34 0.00 1174 E 8.69 4.36 0.00 2.01 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 2.26 2.27 0.00 1175 I 7.34 4.39 2.00 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 1.49 0.77 0.90 0.00 0.00 1176 I 8.35 3.98 2.03 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 1.11 0.53 0.91 0.00 0.00 1177 K 7.86 4.62 0.00 1.79 1.58 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.48 7.81 1178 R 8.46 5.05 0.00 1.69 1.78 0.00 3.27 0.00 0.00 3.12 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 1179 E 8.63 4.73 0.00 2.06 1.74 0.00 0.00 0.00 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 2.31 0.00 1180 F 8.88 4.80 0.00 3.15 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1181 L 9.39 4.98 0.00 1.63 1.52 0.95 1.21 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 1182 E 8.84 4.93 0.00 1.84 1.88 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 2.22 2.30 0.00 1183 L 8.37 4.69 0.00 1.69 1.55 0.92 0.81 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 1184 K 8.31 4.10 0.00 1.71 1.68 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.37 7.81 1185 G 9.10 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 0.00 0.00 0.00 1186 I 7.02 4.50 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 1.46 0.99 0.92 0.00 0.00 1187 D 8.38 4.36 0.00 2.67 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 1188 E 8.43 3.87 0.00 1.98 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 2.33 2.32 0.00 1189 P 0.00 4.66 0.00 1.51 1.90 0.00 3.53 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.99 0.00 1190 V 9.34 4.52 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 1.02 0.00 0.00 1.03 0.00 0.00 1191 M 8.63 3.89 0.00 1.95 1.37 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 1192 T 8.39 5.09 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1193 C 9.07 5.20 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 1194 V 8.64 4.57 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 0.97 0.00 0.00 0.94 0.00 0.00 1195 I 8.38 4.89 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 1.31 0.80 0.93 0.00 0.00 1196 N 9.20 4.57 0.00 2.83 2.87 0.00 0.00 7.17 8.28 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 1197 P 0.00 4.47 0.00 2.21 2.15 0.00 3.75 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 1.98 1.97 0.00 1198 N 8.59 5.07 0.00 2.79 2.71 0.00 0.00 6.84 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 1199 M 8.44 5.15 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 * Residues marked with a * may have inaccurate shift predictions.