NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 878 Y 4.8141 8.1449 121.7039 57.8478 39.8707 174.4282 879 H 4.7939 8.0404 123.2701 54.1951 31.1243 172.3843 880 Q 4.3560 8.7507 119.2741 55.0974 32.9756 172.8893 881 S 5.1638 8.4904 120.0228 57.6048 64.0130 172.4516 882 Y 4.7650 8.7478 121.4666 56.7064 41.8186 175.7556 883 D 4.7113 9.0221 119.8507 55.6482 42.7474 176.6842 884 C 4.8736 7.8541 118.1039 57.5102 32.2389 171.9615 885 V 4.5700 9.0116 122.9272 60.5932 34.4113 173.3659 886 C 4.7966 8.7562 128.3766 58.1613 33.0958 172.1328 887 V 4.7448 8.5631 127.1701 61.4395 33.5490 174.0870 888 M 5.2521 8.8150 126.9530 53.7321 35.7117 173.8155 889 F 5.1794 9.3235 124.0802 55.5813 42.3291 174.0197 890 A 5.1616 9.3412 126.1175 50.4710 21.5195 175.4435 891 S 4.9130 9.0550 118.5645 57.3701 66.3484 174.0120 892 I 5.2719 7.7528 120.0276 58.4717 36.4764 174.3073 893 P 4.2547 0.0000 0.0000 65.7806 31.8523 177.7654 894 D 4.6632 8.2216 116.4228 56.1890 41.6058 178.0761 895 F 4.0679 8.7906 122.3034 61.2113 39.0716 176.5610 896 K 3.9041 8.3488 117.4617 59.8120 31.8741 177.7362 897 E 4.1108 8.1379 117.9504 59.2744 29.8189 178.0559 898 F 4.3043 7.8194 119.5450 60.1490 39.7043 174.9977 899 Y 3.7898 7.2671 120.1937 57.3016 38.9196 174.7842 900 T 4.2683 7.0436 115.2662 60.0616 71.7206 172.5012 901 E 4.4989 8.3669 123.0417 54.7138 30.7647 175.2227 902 S 4.7091 8.1720 117.5903 56.3546 66.4574 174.4204 903 D 4.3253 8.4959 118.9910 56.9652 40.9597 178.6312 904 V 3.7000 7.8099 118.4408 65.7426 31.8906 176.2114 905 N 4.6755 8.1128 115.8275 52.1681 37.5686 175.1196 906 K 3.9414 8.6381 115.6052 58.4511 29.5094 174.8831 907 E 3.6007 9.2907 110.3423 57.6222 27.8889 176.5278 908 G 3.7424 8.8879 106.6216 45.1625 0.0000 176.0193 909 L 4.0743 7.6028 122.3261 58.1345 41.6067 178.7191 910 E 4.1023 8.3610 118.6387 59.3037 29.4018 179.2067 911 C 4.5006 8.0205 116.5698 62.9857 28.4112 175.8466 912 L 4.2643 8.1475 120.1309 57.7604 41.0620 179.6510 913 R 3.9427 8.0378 118.8518 59.3640 30.1447 178.3644 914 L 4.0862 7.8952 119.0029 57.9971 42.0092 178.6882 915 L 3.7126 8.0498 120.3106 57.7953 41.9108 178.4500 916 N 4.2423 8.1100 117.3336 56.5543 38.7947 176.8040 917 E 3.9401 7.9277 119.7541 59.2561 29.5472 179.3698 918 I 3.3223 7.4282 119.5113 64.4374 37.0872 178.6274 919 I 3.4857 7.6690 120.5557 64.0451 36.9146 178.5131 920 A 3.9882 7.9048 121.7386 55.3645 18.0594 179.4281 921 D 4.3903 7.9834 116.2296 57.3788 41.1028 179.0184 922 F 4.3465 8.1167 118.3669 60.8193 38.8326 177.2675 923 D 4.6959 8.6044 119.1118 57.5411 40.6090 178.0752 924 D 4.7411 8.1560 117.1169 54.4464 39.8105 178.0849 925 L 4.2880 8.1920 121.3559 57.5042 41.4340 178.8367 926 L 4.2815 7.7191 118.4309 57.3195 41.5933 178.7615 927 S 4.4542 7.7247 113.3492 58.7353 63.4221 174.6095 928 K 4.2168 7.8321 123.2561 55.3916 32.8284 175.9820 929 P 4.2414 0.0000 0.0000 65.5946 31.3707 178.5881 930 K 3.9468 7.8264 115.1523 58.8105 32.6855 177.2794 931 F 5.2580 8.0529 118.7330 57.4346 39.2991 177.5703 932 S 4.1544 8.1104 120.0816 61.6696 62.3635 175.8959 933 G 3.7832 8.0367 106.7754 46.0640 0.0000 172.6639 934 V 4.1442 7.4909 121.1945 62.0662 32.4523 174.9306 935 E 4.5683 9.1249 127.9515 54.1815 31.7367 175.3007 936 K 4.1505 8.6097 126.7504 56.7914 32.5546 176.1177 937 I 4.2145 7.9787 128.3983 61.8891 38.4619 175.7113 938 K 4.1588 6.7390 118.9369 56.9079 34.9812 172.8492 939 T 4.7393 8.4034 110.2636 59.9770 70.9982 174.4277 940 I 4.2565 8.8794 127.0535 59.9642 38.7714 178.2788 941 G 4.0113 8.6067 119.5893 46.7584 0.0000 172.6488 942 S 4.4586 9.1830 114.6775 57.8851 63.6988 173.5845 943 T 4.7443 8.0609 119.0620 62.9302 70.3469 172.8887 944 Y 4.8374 9.2535 127.3181 56.0707 41.2581 173.7424 945 M 4.8286 8.1982 126.1744 53.6769 34.9553 174.2963 946 A 4.9694 8.5017 125.8270 51.0422 23.8081 174.2085 947 A 5.0780 8.6469 119.2944 51.1174 23.1612 175.6005 948 T 4.8681 8.1583 109.0476 59.4294 72.6588 174.9895 949 G 3.7492 8.9218 109.5863 45.6919 0.0000 174.9395 950 L 3.8111 7.4879 118.3782 55.8185 42.0707 177.8472 951 S 4.3657 7.9107 113.1488 59.6715 63.5760 174.4821 952 A 4.3449 7.2628 122.9648 52.9140 20.0378 176.4335 953 I 3.1098 8.1393 111.4738 62.7997 34.7321 175.0868 *964 R 4.3899 8.0757 120.2310 56.5496 31.7395 176.2952 965 Q 4.0037 8.0618 115.2248 58.3209 28.8697 176.4877 966 Y 5.0663 7.6865 113.0249 57.5838 39.1368 177.1872 967 M 4.2187 8.1971 121.0986 58.4482 31.1036 177.9081 968 H 4.3617 8.3932 115.9281 58.4642 28.6080 177.5181 969 I 3.7596 7.4523 123.3133 64.0779 37.0121 178.4252 970 G 3.8457 7.9755 106.1028 47.8029 0.0000 175.8889 971 T 4.1448 7.9905 118.1820 66.6419 68.5240 176.4458 972 M 4.0306 7.8638 120.4857 58.6347 32.3839 178.4945 973 V 3.4554 7.4394 117.0223 65.9873 31.6112 177.9208 974 E 4.4323 8.3220 118.0432 59.2752 29.3023 179.0631 975 F 3.6466 8.3427 120.9087 60.7391 39.2936 177.1923 976 A 3.6761 7.7620 120.3668 55.1119 18.1137 179.2009 977 Y 4.0782 7.6544 114.6210 61.0768 38.0503 178.5710 978 A 3.9780 7.7931 121.3053 55.2094 18.3927 179.5807 979 L 3.1456 7.0817 117.2567 57.6699 41.4935 179.8930 980 V 3.6103 7.4196 117.8422 66.0396 31.0744 178.3641 981 G 3.6627 7.8640 104.8095 47.3636 0.0000 175.9523 982 K 4.0883 7.8053 120.7109 59.2423 32.1543 179.1611 983 L 4.1710 8.3849 120.9039 58.0643 41.9879 178.7435 984 D 4.3760 8.2971 119.0256 57.0806 40.3451 178.4946 985 A 4.0024 7.7950 121.0727 55.1583 18.3609 179.7731 986 I 3.7109 7.6926 117.8534 64.6291 37.0022 178.4064 987 N 4.2480 8.3130 117.3518 56.1912 38.1249 177.3483 988 K 3.6976 7.8044 120.0491 59.3527 32.2670 177.8249 989 H 4.4058 7.6410 114.8126 56.5056 29.1727 176.6171 990 S 4.7588 7.7641 113.7901 56.8363 63.4189 173.7419 991 F 3.6512 6.9858 118.8160 59.1246 36.9276 174.1049 992 N 4.8748 7.8024 117.8448 51.9155 41.8824 172.6092 993 D 4.6979 7.3960 114.9183 53.1455 41.2316 175.6334 994 F 4.6895 8.3032 118.0888 57.5052 39.9790 175.8345 995 K 4.7324 8.5189 122.5726 54.4873 35.6348 175.4176 996 L 4.7784 8.2276 123.4445 54.1069 44.4081 175.2755 997 R 4.7374 8.8001 124.5333 54.7775 32.7709 174.0107 998 V 4.8505 8.4679 126.5256 61.2271 34.4648 174.7097 999 G 4.5451 9.0068 112.7211 44.7143 0.0000 171.4873 1000 I 5.3034 8.7190 124.6555 59.8930 41.8153 173.8703 1001 N 5.3758 8.9921 122.0411 53.6832 42.9889 172.3386 1002 H 5.8490 8.1666 115.8486 53.3003 32.1080 174.0126 1003 G 3.9520 8.3643 104.4882 44.8357 0.0000 169.6593 1004 P 5.0048 0.0000 0.0000 62.5668 32.6567 175.9098 1005 V 4.7644 8.2232 113.3352 60.4132 37.0780 173.3465 1006 I 5.1717 8.7591 120.7916 59.8701 40.5110 174.9634 1007 A 4.8924 10.0754 128.7221 49.4054 22.0552 177.0576 1008 G 4.0556 6.4515 105.5553 46.0564 0.0000 171.6045 1009 V 4.9835 7.9281 118.6319 60.5404 34.3773 175.5496 1010 I 4.4229 8.1833 121.4632 60.7530 40.6988 175.3994 1011 G 4.0597 8.8193 110.2960 45.7711 0.0000 173.1042 1012 A 4.2683 8.1673 120.7322 53.4676 18.8167 178.1470 1013 Q 4.0022 7.5639 116.9566 57.7120 29.6348 175.9361 1014 K 4.7830 7.4465 117.6376 53.8635 36.5839 175.4930 1015 P 4.5733 0.0000 0.0000 61.6398 30.0218 173.9327 1016 Q 4.5104 7.8252 122.7020 54.8073 30.2047 174.4766 1017 Y 4.4504 8.5277 125.3988 57.7703 39.8200 174.0427 1018 D 4.3739 8.1947 125.1129 52.8146 45.6525 173.2695 1019 I 4.7359 7.0646 113.0356 58.6504 40.4763 174.5946 1020 W 4.9285 10.0627 123.4929 54.7982 33.8156 174.0583 1021 G 4.6410 8.9629 106.7692 43.1850 0.0000 174.1518 1022 N 4.3468 8.5743 118.7203 56.8039 38.3720 177.0579 1023 T 3.8488 7.9058 116.8970 66.6156 68.6162 176.5492 1024 V 3.7783 7.6440 119.6433 65.9112 31.5484 177.6644 1025 N 4.2414 8.1205 116.2001 56.4056 38.4274 177.5732 1026 V 3.5487 8.1086 119.6165 65.7632 31.4574 177.7638 1027 A 4.0270 7.9678 120.4336 55.4297 18.2992 179.5634 1028 S 3.1850 7.7536 111.3069 61.2120 62.3626 176.5751 1029 R 4.2281 7.5043 121.8968 58.4885 29.6117 178.6364 1030 M 4.1630 7.8110 117.6149 57.3879 32.0436 177.7045 1031 D 4.5710 7.5075 117.4487 56.6527 41.8184 178.4700 1032 S 4.1148 8.1343 114.0410 60.5999 63.0436 175.5214 1033 T 4.6177 7.6672 109.3348 61.1952 68.8136 174.8674 1034 G 4.0974 7.8983 112.2346 45.0953 0.0000 173.3730 1035 V 4.5071 8.0408 116.8484 60.3470 34.6162 175.5608 1036 L 4.0098 8.3771 125.1528 56.4069 41.9001 176.8762 1037 D 4.5515 9.0324 121.4637 54.8694 39.2059 173.6393 1038 K 4.6708 7.6784 117.8694 54.6105 36.7175 175.5125 1039 I 4.5985 8.3168 123.1267 59.8781 39.3556 174.2046 1040 Q 5.0175 9.1719 130.1014 55.1143 30.6171 174.9879 1041 V 5.4864 9.1502 118.8523 58.4071 36.5817 175.3958 1042 T 4.5144 8.2802 112.2487 60.8126 70.3402 175.3838 1043 E 3.9354 8.9669 122.0078 59.6248 29.0064 178.6319 1044 E 3.9561 8.1132 116.9486 59.7978 29.4205 179.0133 1045 T 3.9681 7.5713 115.7332 66.1440 68.2419 176.8027 1046 S 3.9379 7.7749 114.7263 61.0695 62.6527 175.9119 1047 L 4.0115 7.5920 121.3630 57.9533 41.4532 179.5642 1048 I 3.5864 7.2096 118.7404 64.3506 36.8523 178.5606 1049 L 4.1531 7.8693 119.6916 57.6186 41.3432 179.5215 1050 Q 4.5333 8.1294 119.5358 58.3403 28.5110 178.3337 1051 T 4.0580 7.4521 108.8697 63.8363 68.9306 175.6957 1052 L 4.4813 7.6174 120.0083 54.3254 42.3015 176.8965 1053 G 4.0724 7.5588 107.1322 45.2172 0.0000 172.9938 1054 Y 4.7133 8.4922 117.9910 56.8862 40.1093 174.8642 1055 T 4.8361 8.5702 118.8039 62.5289 71.1500 173.4557 1056 C 5.4237 8.5901 120.9141 58.4767 32.5610 173.3326 1057 T 4.7720 9.0195 119.0483 61.7843 71.0260 173.1978 1058 C 3.9303 8.6998 126.8473 59.2223 31.4713 173.3075 1059 R 3.8702 7.9812 127.6931 58.0617 30.5711 174.4428 1060 G 3.5770 7.3815 103.0764 43.8093 0.0000 171.5593 1061 I 4.5694 8.2107 122.2280 59.7423 38.4894 175.2840 1062 I 4.4417 8.2855 121.4393 58.7637 40.3585 174.6573 1063 N 4.8018 8.7267 124.3441 53.2095 39.1356 174.0503 1064 V 4.0558 8.6754 128.1017 61.1903 33.3630 175.0858 1065 K 3.9509 8.6215 128.8085 58.8372 32.0346 176.5278 1066 G 4.0540 9.1615 115.7541 45.0178 0.0000 173.3647 1067 K 4.3315 7.9960 116.6149 55.4218 35.0191 177.1436 1068 G 3.7693 8.2661 106.0781 44.1351 0.0000 171.2865 1069 D 4.9163 8.5140 120.6423 54.6305 41.4681 176.1564 1070 L 4.7838 8.9522 123.6442 52.6417 45.7394 175.5574 1071 K 4.8423 8.7189 124.8314 55.6227 33.1441 175.5959 1072 T 4.8461 8.1876 117.4347 60.2783 72.3793 172.3889 1073 Y 4.9983 8.6658 117.6131 56.4580 43.0636 174.3167 1074 F 5.6242 9.1946 120.0583 55.7147 41.8719 175.4231 1075 V 4.1658 8.5624 124.1142 63.0716 31.9961 175.3306 1076 N 5.0062 8.9972 124.7211 52.7652 40.2362 175.5739 1077 T 4.2661 8.2006 116.3762 64.0250 69.6835 174.0812 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 878 Y 8.14 4.81 0.00 2.87 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 879 H 8.04 4.79 0.00 2.95 3.11 0.00 5.78 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 880 Q 8.75 4.36 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.82 0.00 0.00 0.00 0.00 0.00 1.87 2.12 0.00 881 S 8.49 5.16 0.00 3.92 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 882 Y 8.75 4.77 0.00 2.98 2.81 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 0.00 883 D 9.02 4.71 0.00 2.71 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 0.00 884 C 7.85 4.87 0.00 3.09 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 0.00 885 V 9.01 4.57 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 0.84 0.00 0.00 0.84 0.00 0.00 886 C 8.76 4.80 0.00 3.04 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 0.00 887 V 8.56 4.74 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 0.73 0.00 0.00 0.88 0.00 0.00 888 M 8.81 5.25 0.00 2.03 1.81 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 889 F 9.32 5.18 0.00 3.05 3.10 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 0.00 890 A 9.34 5.16 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 0.00 891 S 9.06 4.91 0.00 3.92 3.83 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 0.00 892 I 7.75 5.27 1.77 0.00 0.00 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 1.37 0.86 0.72 0.00 0.00 893 P 0.00 4.25 0.00 2.10 2.20 0.00 3.86 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 2.09 2.19 0.00 894 D 8.22 4.66 0.00 3.07 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 895 F 8.79 4.07 0.00 2.91 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 0.00 896 K 8.35 3.90 0.00 1.88 1.93 0.00 1.88 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.57 7.81 897 E 8.14 4.11 0.00 2.07 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 0.00 2.35 2.40 0.00 898 F 7.82 4.30 0.00 3.13 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 0.00 899 Y 7.27 3.79 0.00 2.64 2.89 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 0.00 900 T 7.04 4.27 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 1.03 0.00 0.00 901 E 8.37 4.50 0.00 1.85 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 902 S 8.17 4.71 0.00 3.86 3.83 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 0.00 903 D 8.50 4.33 0.00 2.66 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 0.00 904 V 7.81 3.70 2.03 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 0.79 0.00 0.00 0.90 0.00 0.00 905 N 8.11 4.68 0.00 2.94 2.91 0.00 0.00 7.12 6.43 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 0.00 906 K 8.64 3.94 0.00 1.97 1.88 0.00 1.82 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.43 7.81 907 E 9.29 3.60 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 2.24 2.27 0.00 908 G 8.89 3.74 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 0.00 0.00 0.00 909 L 7.60 4.07 0.00 1.83 1.70 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 910 E 8.36 4.10 0.00 2.03 2.03 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 2.47 2.51 0.00 911 C 8.02 4.50 0.00 3.32 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 912 L 8.15 4.26 0.00 2.01 1.82 1.02 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 913 R 8.04 3.94 0.00 2.11 2.16 0.00 3.15 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 914 L 7.90 4.09 0.00 2.06 2.15 1.00 0.62 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 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0.00 0.00 0.00 0.00 1.10 0.00 0.00 940 I 8.88 4.26 1.93 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.78 0.93 0.00 0.00 941 G 8.61 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 0.00 942 S 9.18 4.46 0.00 3.65 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 943 T 8.06 4.74 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 1.44 0.00 0.00 944 Y 9.25 4.84 0.00 3.16 2.81 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 0.00 945 M 8.20 4.83 0.00 1.92 1.40 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.97 0.00 946 A 8.50 4.97 1.17 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 0.00 0.00 947 A 8.65 5.08 1.05 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 0.00 0.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1000 I 8.72 5.30 1.84 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.01 0.92 0.00 0.00 1001 N 8.99 5.38 0.00 2.85 2.63 0.00 0.00 6.59 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1002 H 8.17 5.85 0.00 3.26 3.16 0.00 5.31 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1003 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 1004 P 0.00 5.00 0.00 2.14 2.12 0.00 3.35 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.87 0.00 1005 V 8.22 4.76 2.17 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 0.84 0.00 0.00 0.87 0.00 0.00 1006 I 8.76 5.17 2.05 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.04 0.95 0.00 0.00 1007 A 10.08 4.89 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 1008 G 6.45 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1009 V 7.93 4.98 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.09 0.00 0.00 1010 I 8.18 4.42 1.71 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.61 1.22 0.00 0.00 1011 G 8.82 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1012 A 8.17 4.27 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1013 Q 7.56 4.00 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 1014 K 7.45 4.78 0.00 1.75 1.67 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.40 7.81 1015 P 0.00 4.57 0.00 2.23 2.13 0.00 3.76 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 2.00 2.01 0.00 1016 Q 7.83 4.51 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 7.14 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 1017 Y 8.53 4.45 0.00 2.93 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 1018 D 8.19 4.37 0.00 2.32 1.54 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 1019 I 7.06 4.74 1.65 0.00 0.00 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 0.98 0.55 0.56 0.00 0.00 1020 W 10.06 4.93 0.00 3.27 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 1021 G 8.96 4.64 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 1022 N 8.57 4.35 0.00 2.86 2.84 0.00 0.00 6.88 7.22 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 1023 T 7.91 3.85 4.33 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 1.25 0.00 0.00 1024 V 7.64 3.78 2.22 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 1.18 0.00 0.00 0.96 0.00 0.00 1025 N 8.12 4.24 0.00 2.95 2.83 0.00 0.00 6.66 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1026 V 8.11 3.55 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 0.99 0.00 0.00 0.99 0.00 0.00 1027 A 7.97 4.03 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 1028 S 7.75 3.18 0.00 2.75 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1029 R 7.50 4.23 0.00 1.93 1.91 0.00 3.30 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.62 0.00 1030 M 7.81 4.16 0.00 2.19 2.31 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.85 0.00 1031 D 7.51 4.57 0.00 2.91 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 1032 S 8.13 4.11 0.00 4.02 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1033 T 7.67 4.62 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 1.24 0.00 0.00 1034 G 7.90 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 0.00 0.00 0.00 1035 V 8.04 4.51 1.83 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 0.91 0.00 0.00 1.03 0.00 0.00 1036 L 8.38 4.01 0.00 1.67 1.60 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 1037 D 9.03 4.55 0.00 2.80 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 1038 K 7.68 4.67 0.00 1.52 1.36 0.00 1.19 0.00 0.00 1.47 0.00 0.00 2.71 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.34 0.93 7.81 1039 I 8.32 4.60 1.82 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.48 0.82 0.00 0.00 1040 Q 9.17 5.02 0.00 2.31 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.65 0.00 0.00 0.00 0.00 0.00 2.21 2.12 0.00 1041 V 9.15 5.49 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 0.93 0.00 0.00 0.99 0.00 0.00 1042 T 8.28 4.51 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1043 E 8.97 3.94 0.00 2.39 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 2.39 2.37 0.00 1044 E 8.11 3.96 0.00 2.15 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 2.30 2.26 0.00 1045 T 7.57 3.97 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 1.15 0.00 0.00 1046 S 7.77 3.94 0.00 3.56 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.59 4.01 0.00 1.66 1.62 0.87 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 1048 I 7.21 3.59 1.70 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.41 0.53 0.00 0.00 1049 L 7.87 4.15 0.00 1.82 1.73 0.74 0.83 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 1050 Q 8.13 4.53 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 2.55 2.50 0.00 1051 T 7.45 4.06 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 1.30 0.00 0.00 1052 L 7.62 4.48 0.00 2.01 1.86 1.11 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 1053 G 7.56 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 0.00 0.00 0.00 0.00 1054 Y 8.49 4.71 0.00 3.02 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 1055 T 8.57 4.84 4.33 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 1.27 0.00 0.00 1056 C 8.59 5.42 0.00 2.80 2.91 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 1057 T 9.02 4.77 4.45 0.00 0.00 0.00 0.00 0.00 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 1058 C 8.70 3.93 0.00 2.86 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1059 R 7.98 3.87 0.00 0.90 1.55 0.00 3.36 0.00 0.00 3.07 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.28 0.00 1060 G 7.38 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1061 I 8.21 4.57 1.83 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 1.37 0.50 0.88 0.00 0.00 1062 I 8.29 4.44 1.84 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 1.03 0.80 0.87 0.00 0.00 1063 N 8.73 4.80 0.00 2.84 2.78 0.00 0.00 6.99 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1064 V 8.68 4.06 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 0.91 0.00 0.00 0.90 0.00 0.00 1065 K 8.62 3.95 0.00 1.71 1.72 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.49 7.81 1066 G 9.16 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 1067 K 8.00 4.33 0.00 1.70 1.82 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.31 7.81 1068 G 8.27 3.77 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 0.00 0.00 0.00 1069 D 8.51 4.92 0.00 2.56 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1070 L 8.95 4.78 0.00 1.50 1.48 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 1071 K 8.72 4.84 0.00 1.73 1.74 0.00 1.95 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.17 1.25 7.81 1072 T 8.19 4.85 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 1.13 0.00 0.00 1073 Y 8.67 5.00 0.00 2.85 2.81 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 1074 F 9.19 5.62 0.00 3.01 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1075 V 8.56 4.17 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 0.79 0.00 0.00 0.87 0.00 0.00 1076 N 9.00 5.01 0.00 2.87 2.81 0.00 0.00 6.75 7.91 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 1077 T 8.20 4.27 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 1.18 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.