NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1002 P 4.3796 0.0000 0.0000 62.1725 32.1717 175.4958 1003 S 4.5763 7.7261 115.8713 56.9447 65.0217 173.6736 1004 I 4.8280 7.9049 118.7261 58.9510 42.4044 173.3601 1005 K 5.3136 8.5811 122.2678 55.2274 35.0049 174.9366 1006 L 5.2407 9.0490 123.4460 54.0105 44.2904 174.8855 1007 Q 5.2321 8.8733 123.7597 54.4170 31.0446 175.3781 1008 S 4.7976 9.2497 122.4296 58.0568 64.6085 175.3978 1009 S 4.1082 9.4869 115.2270 61.7225 62.9816 176.4283 1010 D 4.3070 8.4109 119.4105 56.6329 40.6042 177.5844 1011 G 4.0763 7.8731 104.5485 44.8839 0.0000 172.6529 1012 E 4.3495 8.1980 122.5132 55.0015 30.5398 175.7795 1013 I 4.5047 8.3933 128.3670 61.3876 38.4314 175.5701 1014 F 4.6377 9.8558 125.3643 55.7987 41.9712 174.5540 1015 E 4.6423 9.0612 124.5426 55.6954 29.1557 175.7024 1016 V 4.5284 8.7052 117.9676 58.8819 35.0412 175.2662 1017 D 4.7289 9.2412 124.0810 53.7383 41.2080 177.1389 1018 V 3.9017 8.1330 122.7829 63.1542 32.3550 175.3615 1019 E 4.3239 9.0281 123.4412 57.1498 27.5251 177.3792 1020 I 3.7347 7.6730 116.6931 64.0277 37.5053 177.2495 1021 A 4.3090 8.0808 122.8407 54.1689 18.9872 179.0597 1022 K 4.3145 7.5009 110.9708 57.8331 31.6427 177.9800 1023 Q 4.0705 7.9386 118.2385 57.3719 28.9134 176.5712 1024 S 4.6863 8.0274 113.9512 56.2407 62.3067 174.1793 1025 V 3.2719 8.0975 130.7079 64.7962 30.8154 178.4712 1026 T 4.1591 7.6740 116.4652 66.6430 68.2795 176.4713 1027 I 3.6401 7.5501 121.5383 64.2174 37.0668 178.2826 1028 K 3.8515 8.9940 121.2771 60.0051 31.9922 178.7129 1029 T 3.7899 8.8474 116.7094 67.1784 68.3342 176.4756 1030 M 4.1715 8.4653 120.3577 57.6329 31.6910 178.7442 1031 L 4.0661 7.7637 118.8201 57.2351 42.2400 178.3214 1032 E 4.3361 8.8810 117.0790 57.2652 29.8846 176.1963 1033 D 4.7841 8.0676 116.5599 55.9472 42.7994 177.8642 1034 L 4.0407 7.9204 118.0245 55.4605 42.2548 176.8716 1035 G 3.8107 7.8559 107.8156 46.1424 0.0000 171.1218 1036 M 4.3899 7.8188 119.2119 54.1858 33.3936 175.8279 1037 D 4.4215 8.9627 124.9697 56.6620 41.1726 174.9819 *1044 P 5.3177 0.0000 0.0000 62.7326 32.5727 175.9849 1045 V 4.0048 8.4942 125.2360 61.3127 31.9854 173.0786 1046 P 4.7069 0.0000 0.0000 62.3791 31.7511 177.2421 1047 L 5.0545 8.7979 126.3679 51.8893 41.6611 175.1017 1048 P 4.1240 0.0000 0.0000 66.1511 31.4317 178.1664 1049 N 4.1585 7.1089 113.1322 53.7441 38.7341 174.7953 1050 V 4.2820 8.1570 119.6609 60.2754 33.7500 174.6342 1051 N 5.3707 8.7979 126.2206 51.3596 39.7846 175.4747 1052 A 4.2617 9.1218 124.1476 55.8982 18.2222 179.6231 1053 A 4.0431 8.4572 118.1843 56.1003 18.3307 179.8643 1054 I 3.8199 9.3626 118.3185 64.2858 37.3527 178.3845 1055 L 3.9213 8.7441 122.2085 58.1319 41.7595 179.0408 1056 K 4.1549 8.6919 119.8145 59.0547 32.0269 178.8136 1057 K 4.2409 7.7170 118.8607 59.3991 32.0640 179.2289 1058 V 3.7867 8.4342 113.0705 64.5010 30.9560 178.3983 1059 I 4.0712 7.8993 119.4738 64.6462 36.8099 177.8619 1060 Q 4.3493 7.9784 118.6870 59.3820 29.2150 178.5280 1061 W 3.9550 8.5653 129.1171 60.5415 30.6209 177.8735 1062 C 4.1075 9.3904 118.0733 63.1643 27.6745 175.8223 1063 T 4.0056 9.0683 106.2446 63.2916 67.9501 173.7633 1064 H 4.3633 7.4101 120.0080 56.0765 30.0813 173.0540 1065 H 4.1298 8.2579 115.1524 54.7473 32.1099 171.4387 *1084 D 4.2771 8.4484 118.4619 54.5914 41.6905 175.7409 1085 I 3.9739 8.4633 127.2225 60.4913 36.9248 173.7899 1086 P 4.3119 0.0000 0.0000 62.8647 32.3799 177.2346 1087 V 4.3199 8.1969 114.6133 59.8635 31.1301 174.9463 1088 W 4.3027 7.7824 135.0000 57.2650 35.5972 175.6936 1089 D 4.8993 8.4306 118.2790 57.6555 39.9961 178.4596 1090 Q 4.0647 7.8857 119.3935 58.9784 29.2198 177.8442 1091 E 3.9591 7.8648 119.8551 59.3109 29.7203 178.1909 1092 F 3.2097 7.9823 119.3397 60.5558 39.3157 176.0111 1093 L 4.3982 7.7429 116.5772 54.0809 41.6262 177.7920 1094 K 3.9101 8.5063 122.1547 58.0148 32.2306 176.8605 1095 V 3.6278 6.8501 118.3083 63.1540 32.0265 175.2650 1096 D 4.6105 8.1935 122.2291 52.5921 41.3931 177.0452 1097 Q 4.1032 8.6696 119.0977 59.2725 28.5838 179.4011 1098 G 3.8895 8.1827 105.9752 48.4407 0.0000 175.4942 1099 T 3.8586 7.8185 117.9391 66.1340 68.5969 175.8716 1100 L 3.9813 7.9303 122.0535 58.5275 41.9869 178.5044 1101 F 3.9703 9.0512 120.3247 61.6870 39.2658 177.0574 1102 E 4.1585 8.7015 118.1728 59.7023 28.7070 179.5244 1103 L 3.9975 8.7119 119.4744 57.5902 41.6993 179.2838 1104 I 3.8043 8.1797 120.1972 64.4792 36.8117 178.4645 1105 L 3.8382 7.8075 119.1234 57.6362 41.4871 178.9639 1106 A 4.0893 8.4638 120.9058 55.3962 18.2182 179.4296 1107 A 3.8756 9.1234 119.2091 55.2919 18.2762 179.0497 1108 N 4.1227 8.2120 114.4205 57.0909 39.0383 176.0990 1109 Y 4.2469 9.3710 119.0783 60.8071 39.4188 177.6897 1110 L 3.7865 8.7208 119.3350 54.5081 42.8870 175.4037 1111 D 4.5748 8.1182 118.9285 55.1191 39.5975 172.4482 1112 I 4.7912 6.7633 121.4358 57.6603 38.2541 176.2527 1113 K 3.9764 8.4041 124.3375 60.2463 32.2602 177.2388 1114 G 3.9013 8.4851 104.1825 47.6958 0.0000 174.5558 1115 L 2.6343 6.6035 120.0948 56.9112 42.0927 179.3676 1116 L 3.8687 7.8404 121.4377 57.6238 41.9489 178.6741 1117 D 4.3135 8.4556 118.9725 57.3914 40.8073 178.7071 1118 V 3.6720 7.9226 118.8815 66.3227 31.5607 177.8906 1119 T 3.8383 8.1650 109.4536 65.2223 68.5716 175.7042 1120 C 4.0934 8.3318 120.8217 62.0181 28.1082 176.1241 1121 K 3.8738 8.3883 121.2216 60.0211 31.5798 178.5527 1122 T 3.7964 8.0924 114.8807 66.8900 68.6396 176.3531 1123 V 3.8180 8.0267 119.5201 65.9712 31.6004 177.5379 1124 A 4.0036 8.4117 120.9491 55.7688 17.2881 179.2747 1125 N 4.1059 9.1205 115.6351 56.9599 38.3562 177.5079 1126 M 4.2943 8.4032 119.4241 57.7468 31.9230 178.1660 1127 I 4.5149 7.2515 120.3614 62.6332 38.1373 174.4810 1128 K 4.2973 8.4925 121.4993 56.9041 31.7042 175.9741 1129 G 4.3643 8.4913 115.6266 44.0953 0.0000 172.5265 1130 K 3.3643 8.0502 121.8772 57.5713 32.6602 172.1032 1131 T 3.2752 8.4049 117.5416 63.2254 66.2311 170.8360 1132 P 4.2630 0.0000 0.0000 65.7080 31.4672 178.1624 1133 E 3.9998 8.3286 116.6710 59.8720 28.9155 179.4215 1134 E 4.0234 8.1305 117.7132 59.4508 29.5115 179.1637 1135 I 3.8928 8.0927 120.1748 64.3907 37.0952 178.8351 1136 R 4.0293 8.2008 118.9386 59.3415 29.8981 179.0198 1137 K 4.0744 7.8389 116.3758 59.2744 32.1433 178.3055 1138 T 4.2114 7.3299 114.0010 63.9095 69.1524 175.3929 1139 F 4.6768 7.3809 117.0684 56.5205 40.1815 175.4413 1140 N 4.0107 8.8875 121.0146 51.0876 38.5381 173.2943 1141 I 3.0513 8.4510 119.8829 61.6096 36.6073 173.7343 1142 K 4.2391 8.3122 123.9383 55.4486 32.8571 177.5020 1143 N 4.5193 8.4429 122.1437 53.4137 37.1071 173.5261 1144 D 4.6519 7.7523 125.4572 53.1227 40.1974 176.6003 1145 F 5.0922 7.9603 119.2025 57.1144 40.3583 176.9625 1146 T 4.2456 8.4588 116.7686 61.7871 70.5614 174.0348 1147 E 3.8439 8.9708 118.6729 60.3585 29.1081 179.2259 1148 E 3.9962 8.1090 117.1629 60.5956 29.9628 178.6003 1149 E 3.8025 8.1665 116.6141 59.5691 29.3842 178.8589 1150 E 3.3949 8.7014 118.2658 59.7083 29.9418 179.1812 1151 A 3.9060 7.6242 120.1428 55.4741 18.3236 178.9904 1152 Q 3.8270 8.4307 117.4966 59.6317 29.0667 179.5256 1153 V 3.4356 7.9653 119.2128 65.9457 31.2067 178.2881 1154 R 3.9011 7.8640 117.4525 58.9739 29.9945 178.5689 1155 K 4.0880 8.4327 118.9452 59.5523 32.2683 178.5026 1156 E 4.1927 8.4530 118.4326 58.1639 29.4887 177.7989 1157 N 5.0810 7.7944 115.7590 51.7918 40.4344 174.7208 1158 Q 4.3013 7.7115 120.8063 56.5359 29.9862 175.7744 1159 W 4.4073 8.3502 128.9379 57.9253 30.5530 173.7454 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 1002 P 0.00 4.38 0.00 2.06 1.92 0.00 3.69 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 1.92 2.08 0.00 1003 S 7.73 4.58 0.00 3.99 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 1004 I 7.90 4.83 1.90 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 1.30 0.72 0.93 0.00 0.00 1005 K 8.58 5.31 0.00 1.89 2.28 0.00 1.47 0.00 0.00 2.04 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.62 7.81 1006 L 9.05 5.24 0.00 1.94 1.80 0.90 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 1007 Q 8.87 5.23 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.85 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 1008 S 9.25 4.80 0.00 4.12 4.19 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 1009 S 9.49 4.11 0.00 3.82 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 0.00 1010 D 8.41 4.31 0.00 2.78 2.86 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 1011 G 7.87 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 0.00 0.00 0.00 1012 E 8.20 4.35 0.00 2.08 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 1.84 2.12 0.00 1013 I 8.39 4.50 1.88 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 1.38 0.59 0.94 0.00 0.00 1014 F 9.86 4.64 0.00 3.02 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 1015 E 9.06 4.64 0.00 1.89 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 2.32 2.30 0.00 1016 V 8.71 4.53 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 0.95 0.00 0.00 1.09 0.00 0.00 1017 D 9.24 4.73 0.00 2.74 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 1018 V 8.13 3.90 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 0.72 0.00 0.00 0.94 0.00 0.00 1019 E 9.03 4.32 0.00 2.20 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 2.26 2.25 0.00 1020 I 7.67 3.73 2.09 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 1.32 0.62 0.92 0.00 0.00 1021 A 8.08 4.31 1.32 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 1022 K 7.50 4.31 0.00 2.06 1.86 0.00 1.96 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.46 7.81 1023 Q 7.94 4.07 0.00 2.14 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.03 0.00 0.00 0.00 0.00 0.00 2.40 2.68 0.00 1024 S 8.03 4.69 0.00 3.83 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 1025 V 8.10 3.27 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 0.86 0.00 0.00 0.90 0.00 0.00 1026 T 7.67 4.16 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 0.78 0.00 0.00 1027 I 7.55 3.64 2.10 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 1.38 0.51 0.91 0.00 0.00 1028 K 8.99 3.85 0.00 1.86 1.87 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.47 7.81 1029 T 8.85 3.79 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1030 M 8.47 4.17 0.00 2.04 2.20 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.57 0.00 1031 L 7.76 4.07 0.00 1.83 1.72 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 1032 E 8.88 4.34 0.00 1.88 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 2.44 0.00 1033 D 8.07 4.78 0.00 2.84 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 1034 L 7.92 4.04 0.00 1.78 1.73 0.92 0.91 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 1035 G 7.86 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1036 M 7.82 4.39 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.69 0.00 1037 D 8.96 4.42 0.00 2.82 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *1044 P 0.00 5.32 0.00 2.12 2.15 0.00 3.13 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.96 0.00 1045 V 8.49 4.00 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 1.05 0.00 0.00 1.01 0.00 0.00 1046 P 0.00 4.71 0.00 2.16 2.10 0.00 3.79 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 1047 L 8.80 5.05 0.00 1.72 1.85 0.94 0.92 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 1048 P 0.00 4.12 0.00 2.07 2.21 0.00 4.01 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.07 0.00 1049 N 7.11 4.16 0.00 1.44 2.29 0.00 0.00 6.58 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 1050 V 8.16 4.28 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 1.03 0.00 0.00 1.09 0.00 0.00 1051 N 8.80 5.37 0.00 3.51 2.93 0.00 0.00 6.58 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1052 A 9.12 4.26 1.67 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 1053 A 8.46 4.04 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1054 I 9.36 3.82 1.89 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 1.59 0.81 0.99 0.00 0.00 1055 L 8.74 3.92 0.00 1.57 1.04 0.66 -1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 1056 K 8.69 4.15 0.00 2.38 2.19 0.00 1.83 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.77 1.82 7.81 1057 K 7.72 4.24 0.00 2.18 2.02 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.13 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.32 1.67 7.81 1058 V 8.43 3.79 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 0.82 0.00 0.00 0.99 0.00 0.00 1059 I 7.90 4.07 2.12 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 1.66 1.06 1.02 0.00 0.00 1060 Q 7.98 4.35 0.00 2.43 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.96 0.00 0.00 0.00 0.00 0.00 2.91 2.73 0.00 1061 W 8.57 3.96 0.00 2.58 3.27 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 1062 C 9.39 4.11 0.00 3.15 3.25 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 1063 T 9.07 4.01 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 1.28 0.00 0.00 1064 H 7.41 4.36 0.00 2.55 2.64 0.00 5.94 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1065 H 8.26 4.13 0.00 2.74 2.88 0.00 5.93 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *1084 D 8.45 4.28 0.00 2.67 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 1085 I 8.46 3.97 2.03 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 1.50 0.71 1.09 0.00 0.00 1086 P 0.00 4.31 0.00 2.55 2.13 0.00 3.77 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 2.32 2.26 0.00 1087 V 8.20 4.32 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 0.72 0.00 0.00 1.00 0.00 0.00 1088 W 7.78 4.30 0.00 3.33 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 1089 D 8.43 4.90 0.00 3.12 3.14 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 1090 Q 7.89 4.06 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.97 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 1091 E 7.86 3.96 0.00 2.01 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 2.20 2.25 0.00 1092 F 7.98 3.21 0.00 1.73 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 1093 L 7.74 4.40 0.00 1.84 1.69 1.07 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 1094 K 8.51 3.91 0.00 1.67 1.76 0.00 1.93 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.33 7.81 1095 V 6.85 3.63 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 0.73 0.00 0.00 0.67 0.00 0.00 1096 D 8.19 4.61 0.00 2.87 2.74 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 0.00 0.00 0.00 1097 Q 8.67 4.10 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 1098 G 8.18 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 1099 T 7.82 3.86 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1100 L 7.93 3.98 0.00 1.92 1.94 1.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 1101 F 9.05 3.97 0.00 3.17 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 1102 E 8.70 4.16 0.00 2.24 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 2.61 2.54 0.00 1103 L 8.71 4.00 0.00 1.84 1.69 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 1104 I 8.18 3.80 1.73 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 1.65 0.71 0.73 0.00 0.00 1105 L 7.81 3.84 0.00 1.86 1.69 1.13 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 1106 A 8.46 4.09 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 1107 A 9.12 3.88 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1108 N 8.21 4.12 0.00 2.64 3.02 0.00 0.00 7.30 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 1109 Y 9.37 4.25 0.00 2.94 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 1110 L 8.72 3.79 0.00 1.66 1.61 0.94 0.68 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 1111 D 8.12 4.57 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 1112 I 6.76 4.79 1.66 0.00 0.00 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 1.59 0.49 0.67 0.00 0.00 1113 K 8.40 3.98 0.00 1.84 1.91 0.00 1.59 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.60 7.81 1114 G 8.49 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 1115 L 6.60 2.63 0.00 0.27 1.11 0.60 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 1116 L 7.84 3.87 0.00 1.70 1.73 0.88 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 1117 D 8.46 4.31 0.00 2.93 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 1118 V 7.92 3.67 2.28 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 1.20 0.00 0.00 1.27 0.00 0.00 1119 T 8.16 3.84 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 1.24 0.00 0.00 1120 C 8.33 4.09 0.00 2.98 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 1121 K 8.39 3.87 0.00 1.98 2.02 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.52 7.81 1122 T 8.09 3.80 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 1123 V 8.03 3.82 2.31 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 1.26 0.00 0.00 1.07 0.00 0.00 1124 A 8.41 4.00 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 1125 N 9.12 4.11 0.00 2.87 2.92 0.00 0.00 7.12 7.54 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 1126 M 8.40 4.29 0.00 1.77 2.53 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.00 2.55 0.00 1127 I 7.25 4.51 1.98 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.39 0.89 0.00 0.00 1128 K 8.49 4.30 0.00 1.84 1.82 0.00 2.00 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.68 7.81 1129 G 8.49 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 0.00 0.00 0.00 0.00 1130 K 8.05 3.36 0.00 1.86 1.78 0.00 1.83 0.00 0.00 1.49 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.28 7.81 1131 T 8.40 3.28 4.35 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 1.37 0.00 0.00 1132 P 0.00 4.26 0.00 2.20 2.17 0.00 3.64 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 1133 E 8.33 4.00 0.00 2.07 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 2.43 2.52 0.00 1134 E 8.13 4.02 0.00 2.19 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 1135 I 8.09 3.89 2.12 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 1.60 1.64 1.04 0.00 0.00 1136 R 8.20 4.03 0.00 2.07 2.44 0.00 3.19 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.03 0.00 1137 K 7.84 4.07 0.00 1.89 1.89 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.77 1.66 7.81 1138 T 7.33 4.21 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 0.44 0.00 0.00 1139 F 7.38 4.68 0.00 2.96 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1140 N 8.89 4.01 0.00 2.82 2.75 0.00 0.00 7.20 7.96 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 1141 I 8.45 3.05 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 1.45 0.81 0.89 0.00 0.00 1142 K 8.31 4.24 0.00 1.67 1.68 0.00 1.62 0.00 0.00 1.61 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.46 7.81 1143 N 8.44 4.52 0.00 2.73 2.79 0.00 0.00 7.08 8.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1144 D 7.75 4.65 0.00 2.66 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 1145 F 7.96 5.09 0.00 3.31 3.04 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 0.00 0.00 0.00 1146 T 8.46 4.25 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 1.26 0.00 0.00 1147 E 8.97 3.84 0.00 2.01 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 2.43 2.39 0.00 1148 E 8.11 4.00 0.00 2.06 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 2.41 2.49 0.00 1149 E 8.17 3.80 0.00 2.42 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 2.40 2.41 0.00 1150 E 8.70 3.39 0.00 2.17 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 2.31 2.31 0.00 1151 A 7.62 3.91 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 1152 Q 8.43 3.83 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 1153 V 7.97 3.44 1.66 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 0.66 0.00 0.00 0.25 0.00 0.00 1154 R 7.86 3.90 0.00 1.91 1.95 0.00 3.20 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 1155 K 8.43 4.09 0.00 1.78 1.94 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.47 7.81 1156 E 8.45 4.19 0.00 2.13 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.65 0.00 1157 N 7.79 5.08 0.00 2.76 2.82 0.00 0.00 6.96 7.80 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 1158 Q 7.71 4.30 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 1159 W 8.35 4.41 0.00 3.38 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 * Residues marked with a * may have inaccurate shift predictions.