NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1001 A 4.4041 8.2644 123.5854 51.5510 21.3670 176.5197 1002 S 4.6263 7.8243 111.7962 57.2580 65.6552 170.0504 1003 G 4.8359 8.7311 105.9173 42.8420 0.0000 171.9803 1004 L 4.2351 8.4357 121.1074 55.4739 43.2129 175.9218 1005 V 4.8050 8.3540 124.1122 61.0439 34.2350 174.1943 1006 A 4.9183 9.2983 129.7985 50.0722 21.9227 174.8738 1007 S 5.6887 8.2437 115.2293 55.6322 66.8120 172.9156 1008 N 4.3063 8.8614 113.7269 54.4271 35.4990 176.2788 1009 L 3.8590 8.1149 120.2464 56.1747 42.0791 176.9978 1010 N 4.0828 8.0557 114.9117 54.1189 37.4366 173.8300 1011 L 4.3870 8.2636 119.5371 54.5751 42.8901 176.1239 1012 K 4.9344 9.0664 125.9654 53.9687 33.9126 174.2795 1013 P 4.2989 0.0000 0.0000 64.5645 31.4473 177.1180 1014 G 3.9840 9.7656 112.5368 45.3953 0.0000 173.5140 1015 E 4.2691 7.8315 119.3126 55.2493 31.9162 173.9659 *1017 L 4.3557 8.2127 120.5230 55.7932 43.7237 176.5103 1018 R 4.9047 8.6059 126.9709 54.5295 32.4154 174.5571 1019 V 4.7655 8.9547 126.7305 61.0847 34.3998 173.9163 1020 R 5.1768 9.0078 128.8088 54.7908 32.9136 174.6958 1021 G 3.3388 9.0205 111.5302 45.3012 0.0000 171.0770 1022 E 4.8601 8.3215 119.9804 54.5387 31.4818 175.9665 1023 V 4.4381 8.7562 125.4238 61.9322 33.0927 175.2995 1024 A 4.2499 8.5649 129.9704 51.7583 18.8953 176.7118 1025 P 4.3083 0.0000 0.0000 64.8167 31.6098 177.0297 1026 D 4.8686 7.6181 116.6240 52.1364 39.8343 175.9950 1027 A 4.1097 7.3911 122.1256 53.9284 18.9583 178.2806 1028 K 4.6790 9.4004 121.1092 56.4781 35.0552 176.5936 1029 S 5.7037 7.8909 114.5680 58.4460 65.1184 176.1768 1030 F 5.4794 7.9783 115.2913 55.7029 41.8473 173.2260 1031 V 4.7214 9.4431 118.5761 61.1996 35.4555 174.1210 1032 L 5.2500 9.0462 125.7364 53.3082 44.8009 175.0089 1033 N 5.6156 9.7543 122.4370 51.5678 41.3188 174.2051 1034 L 5.0226 9.6655 122.7942 52.5619 46.0407 177.0762 1035 G 4.1820 8.1308 108.2702 46.5850 0.0000 173.3991 1036 K 3.9470 8.7072 121.3507 58.8921 32.7821 177.0241 1037 D 4.0092 7.2313 115.7643 52.1618 41.5269 175.5800 1038 S 3.7315 7.7331 112.8596 60.7309 62.8353 174.6086 1039 N 4.5839 8.1548 116.7865 53.0324 39.1319 173.7226 1040 N 5.1944 7.8556 116.2407 51.0977 40.7814 171.7791 1041 L 5.2179 8.8775 123.4110 52.9969 43.6922 176.9994 1042 C 4.4203 8.9890 118.9467 59.9690 31.0159 173.8149 1043 L 4.3198 7.8761 122.2902 54.4633 45.0594 173.6116 1044 H 5.2731 9.4072 128.4067 53.8822 31.2377 172.7437 1045 F 4.6864 9.1726 129.9603 57.0485 40.4325 173.6375 1046 N 5.0851 8.2080 126.4694 49.4698 39.8395 169.7837 1047 P 4.1426 0.0000 0.0000 61.6368 32.8914 174.9666 1048 R 4.3851 8.6804 124.6956 54.6514 31.7688 177.0359 1049 F 3.7627 8.9196 123.5285 59.6871 40.2109 175.3763 1050 N 5.4383 8.5136 118.6550 52.6457 40.3560 172.7349 1051 A 4.3456 9.3123 125.0889 52.2820 22.7355 176.2826 1052 H 4.1530 9.7724 117.6009 56.7632 26.3720 176.2822 1053 G 3.9280 8.5342 106.8796 45.2865 0.0000 173.7774 1054 D 4.6155 7.9604 120.1620 52.4757 42.3221 175.4274 1055 A 4.6818 7.9943 125.4332 51.0588 21.3875 176.0797 1056 N 3.1400 8.1277 122.3690 54.1688 36.4561 174.0364 1057 T 4.6390 7.3444 111.9283 60.3063 72.1520 173.4620 1058 I 4.1133 8.4190 129.1323 60.6136 38.6311 174.5977 1059 V 4.6682 8.1881 127.5956 61.1683 33.8055 174.1728 1060 C 5.6763 8.9204 124.7997 57.3165 32.0139 172.4319 1061 N 5.5504 8.2092 119.0275 52.9899 42.6884 172.5967 1062 S 5.5304 9.1272 115.2281 56.4857 66.9928 173.0285 1063 K 4.7393 9.1555 121.3857 54.9903 35.1875 174.3320 1064 D 4.8393 9.1361 128.8495 52.3651 42.9227 175.7731 1065 D 4.2451 9.8672 128.5462 55.2432 40.1352 174.4529 1066 G 3.6738 8.4559 106.3461 44.8591 0.0000 173.3674 1067 A 4.4558 7.6469 123.9255 49.9875 20.1411 176.5098 1068 W 4.7927 8.5829 123.6963 57.2265 29.7934 177.1563 1069 G 4.2631 8.9837 112.7307 46.2307 0.0000 172.4164 1070 T 4.5515 8.5397 118.7001 62.6732 69.2614 175.2037 1071 E 4.4899 8.9324 126.2402 56.5777 30.6190 176.0559 1072 Q 4.7988 9.3021 123.5419 54.4413 32.4774 174.3245 1073 R 5.0803 8.5250 123.2580 54.5382 33.5476 174.9474 1074 E 4.4394 8.4018 121.9368 55.1190 31.3938 176.0320 1075 A 4.3983 8.3680 121.7876 52.3062 19.4306 177.1889 1076 V 4.4764 6.9531 108.0576 59.8371 35.7705 175.9198 1077 F 4.7220 8.0549 122.2817 56.6931 39.8129 172.6467 1078 P 4.5137 0.0000 0.0000 62.2091 31.3787 177.4605 1079 F 4.9355 7.3981 115.1436 56.5512 42.9430 174.8371 1080 Q 4.8203 8.7379 124.3627 53.3898 31.7837 172.6138 1081 P 4.2729 0.0000 0.0000 64.2269 31.7849 176.1863 1082 G 3.9230 9.0755 110.6765 46.1864 0.0000 173.2235 1083 S 4.7914 7.6367 111.1456 56.0867 66.9400 173.1587 1084 V 4.4194 8.4322 120.8630 62.8694 32.3800 175.0762 1085 A 4.9495 9.4691 128.2865 50.2599 22.7751 174.3694 1086 E 5.2697 8.9989 121.5785 54.3900 32.6945 175.1154 1087 V 4.7004 9.0437 125.8115 61.2604 35.4725 173.7150 1088 C 5.2514 8.8448 124.0778 57.9920 31.0714 172.8193 1089 I 4.8567 8.8823 125.1480 59.7729 39.1369 175.1260 1090 T 4.7945 9.0042 124.3078 61.7912 71.0119 173.1634 1091 F 5.4144 8.8048 128.2969 56.9981 41.7220 174.5356 1092 D 4.5051 8.4029 124.5309 52.0741 45.0504 176.2896 1093 Q 3.6140 8.4979 121.7150 59.2538 29.3975 177.4580 1094 A 4.3645 7.9236 118.8500 54.2739 20.0773 176.8713 1095 N 5.4788 7.8007 109.1434 52.1513 44.0396 173.6634 1096 L 5.0346 9.2214 120.3481 53.6212 44.7103 175.8160 1097 T 4.8136 8.8762 119.4302 61.7168 71.4863 173.2330 1098 V 4.4515 8.3693 126.5797 60.7320 34.1132 173.9217 1099 K 4.9252 8.9061 129.8118 54.6582 34.1648 176.0201 1100 L 4.7079 9.2379 128.1227 53.0261 42.8359 175.9307 1101 P 4.1363 0.0000 0.0000 65.6943 31.1192 177.2037 1102 D 4.6267 8.0067 114.3907 52.9764 39.5433 177.1996 1103 G 3.9687 8.3214 109.7202 45.3310 0.0000 173.6735 1104 Y 4.2343 8.1791 122.1126 57.8459 39.7538 174.6435 1105 E 5.3888 8.0527 124.9566 54.7196 33.2321 174.8612 1106 F 5.0334 8.6153 116.2582 55.7619 41.9124 173.0761 1107 K 5.1557 8.8943 118.0668 54.6701 35.5451 175.4693 1108 F 5.1221 9.0964 124.4111 55.5412 42.5435 172.3651 1109 P 5.1050 0.0000 0.0000 62.2287 31.8169 176.7743 1110 N 4.7934 8.7440 122.8976 52.0286 37.4150 175.5203 1111 R 3.9151 7.9097 120.0457 59.1514 30.7641 178.2092 1112 L 4.2375 7.9697 114.4896 54.7137 42.0432 176.1066 1113 N 4.2938 8.2164 115.3243 53.9660 36.6011 174.7000 1114 L 4.2617 8.3809 116.3335 55.2612 42.3463 177.3463 1115 E 4.6081 8.5870 119.7755 56.4431 30.5494 175.5721 1116 A 5.0174 7.5865 117.7122 51.3229 22.2703 175.6376 1117 I 4.2099 8.4463 121.5646 59.9060 39.0054 176.0254 1118 N 5.1148 8.9777 123.0849 53.0496 40.9883 173.4830 1119 Y 5.2812 8.4442 120.8323 55.9392 42.5233 173.7554 1120 M 5.2126 8.4820 124.8484 53.9448 36.3201 173.4559 1121 A 5.0596 9.0817 126.3356 50.3661 23.2868 174.6023 1122 A 5.3481 9.1570 123.7125 50.5781 22.2694 175.0623 1123 D 4.7012 9.4521 119.5354 54.3703 45.5987 175.8366 1124 G 3.7945 8.7525 108.1228 44.8630 0.0000 172.8339 1125 D 4.7963 8.4227 115.9012 52.9981 39.2046 177.3743 1126 F 4.7729 7.6699 119.7381 56.8661 42.7294 174.3900 1127 K 4.2087 8.5409 129.7295 54.6193 33.0841 175.7271 1128 I 3.7899 8.0971 129.1251 61.7727 36.9272 176.2186 1129 K 4.4791 8.6868 126.1161 57.2798 34.1506 176.3492 1130 C 4.7603 7.3044 111.1268 57.4400 32.1988 173.1884 1131 V 4.7540 8.4361 119.8046 61.0685 34.3826 174.0975 1132 A 4.5937 8.7672 129.2708 50.0830 21.6958 174.8961 1133 F 4.8723 9.0366 121.8219 55.9426 40.3455 175.7868 1134 D 4.5464 8.4960 122.7804 54.3617 41.4894 176.1888 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1001 A 8.26 4.40 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 1002 S 7.82 4.63 0.00 3.97 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1003 G 8.73 4.84 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 0.00 0.00 0.00 1004 L 8.44 4.24 0.00 1.79 1.57 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 1005 V 8.35 4.80 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.97 0.00 0.00 1006 A 9.30 4.92 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1007 S 8.24 5.69 0.00 3.91 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 1008 N 8.86 4.31 0.00 2.84 2.95 0.00 0.00 6.94 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 1009 L 8.11 3.86 0.00 1.79 1.78 1.03 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 1010 N 8.06 4.08 0.00 2.77 2.82 0.00 0.00 6.92 7.78 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 1011 L 8.26 4.39 0.00 1.83 1.67 1.12 0.69 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 1012 K 9.07 4.93 0.00 1.96 1.76 0.00 1.74 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.44 1.51 7.81 1013 P 0.00 4.30 0.00 1.91 1.68 0.00 3.68 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.64 0.00 1014 G 9.77 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 1015 E 7.83 4.27 0.00 2.28 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 2.35 2.41 0.00 *1017 L 8.21 4.36 0.00 1.78 1.66 0.59 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 1018 R 8.61 4.90 0.00 1.84 1.66 0.00 3.04 0.00 0.00 3.37 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.50 0.00 1019 V 8.95 4.77 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 1.14 0.00 0.00 0.86 0.00 0.00 1020 R 9.01 5.18 0.00 1.88 1.69 0.00 3.15 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 1021 G 9.02 3.34 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 0.00 0.00 0.00 0.00 1022 E 8.32 4.86 0.00 1.72 1.79 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 2.18 2.09 0.00 1023 V 8.76 4.44 2.44 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 1.05 0.00 0.00 1.26 0.00 0.00 1024 A 8.56 4.25 1.26 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 0.00 0.00 0.00 1025 P 0.00 4.31 0.00 2.02 2.11 0.00 3.59 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 2.00 2.06 0.00 1026 D 7.62 4.87 0.00 2.68 2.67 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 1027 A 7.39 4.11 0.69 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 0.00 0.00 1028 K 9.40 4.68 0.00 1.70 2.01 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.48 7.81 1029 S 7.89 5.70 0.00 4.00 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 1030 F 7.98 5.48 0.00 3.33 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 1031 V 9.44 4.72 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 1.19 0.00 0.00 0.89 0.00 0.00 1032 L 9.05 5.25 0.00 1.83 1.64 1.02 0.74 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 1033 N 9.75 5.62 0.00 2.79 2.97 0.00 0.00 6.34 7.30 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 1034 L 9.67 5.02 0.00 1.55 1.49 0.89 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 1035 G 8.13 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 0.00 0.00 0.00 0.00 1036 K 8.71 3.95 0.00 1.70 1.79 0.00 1.82 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.36 7.81 1037 D 7.23 4.01 0.00 2.60 2.57 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 1038 S 7.73 3.73 0.00 3.90 3.79 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 1039 N 8.15 4.58 0.00 2.64 2.71 0.00 0.00 6.59 6.91 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 1040 N 7.86 5.19 0.00 2.63 2.65 0.00 0.00 6.80 6.73 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 1041 L 8.88 5.22 0.00 1.67 1.80 1.04 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 1042 C 8.99 4.42 0.00 3.13 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1043 L 7.88 4.32 0.00 1.86 1.58 0.69 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 1044 H 9.41 5.27 0.00 3.61 3.51 0.00 5.86 0.00 0.00 0.00 0.00 6.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1045 F 9.17 4.69 0.00 3.09 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 1046 N 8.21 5.09 0.00 2.25 2.43 0.00 0.00 7.07 7.59 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 1047 P 0.00 4.14 0.00 0.53 0.65 0.00 2.20 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.49 0.00 1048 R 8.68 4.39 0.00 1.65 1.71 0.00 3.08 0.00 0.00 3.30 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.57 0.00 1049 F 8.92 3.76 0.00 3.18 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 1050 N 8.51 5.44 0.00 2.70 2.71 0.00 0.00 7.07 7.74 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 1051 A 9.31 4.35 1.15 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 0.00 0.00 0.00 1052 H 9.77 4.15 0.00 3.23 3.30 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1053 G 8.53 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 0.00 0.00 0.00 1054 D 7.96 4.62 0.00 2.76 2.42 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 1055 A 7.99 4.68 1.10 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 1056 N 8.13 3.14 0.00 2.54 2.05 0.00 0.00 5.97 6.67 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 1057 T 7.34 4.64 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 1.13 0.00 0.00 1058 I 8.42 4.11 1.69 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.94 0.57 0.00 0.00 1059 V 8.19 4.67 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 0.89 0.00 0.00 0.77 0.00 0.00 1060 C 8.92 5.68 0.00 2.63 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 0.00 0.00 0.00 1061 N 8.21 5.55 0.00 2.66 2.71 0.00 0.00 6.65 7.63 0.00 0.00 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 S 9.13 5.53 0.00 4.12 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 0.00 1063 K 9.16 4.74 0.00 1.45 1.51 0.00 0.61 0.00 0.00 1.00 0.00 0.00 2.25 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.85 0.40 7.81 1064 D 9.14 4.84 0.00 2.74 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 1065 D 9.87 4.25 0.00 2.73 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 1066 G 8.46 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1067 A 7.65 4.46 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 1068 W 8.58 4.79 0.00 3.22 3.05 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 1069 G 8.98 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 0.00 0.00 0.00 0.00 1070 T 8.54 4.55 4.30 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 1.25 0.00 0.00 1071 E 8.93 4.49 0.00 1.83 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 2.19 2.25 0.00 1072 Q 9.30 4.80 0.00 2.39 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 1073 R 8.52 5.08 0.00 1.63 1.68 0.00 3.19 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.55 0.00 1074 E 8.40 4.44 0.00 1.64 1.64 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 1.64 1.47 0.00 1075 A 8.37 4.40 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1076 V 6.95 4.48 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 0.11 0.00 0.00 0.25 0.00 0.00 1077 F 8.05 4.72 0.00 2.94 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1078 P 0.00 4.51 0.00 1.89 2.07 0.00 3.45 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.87 0.00 1079 F 7.40 4.94 0.00 2.30 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 1080 Q 8.74 4.82 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 7.05 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 1081 P 0.00 4.27 0.00 2.06 2.00 0.00 3.94 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.78 0.00 1082 G 9.08 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 0.00 0.00 0.00 1083 S 7.64 4.79 0.00 3.96 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 1084 V 8.43 4.42 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 0.85 0.00 0.00 0.92 0.00 0.00 1085 A 9.47 4.95 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.00 5.27 0.00 1.99 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 0.00 2.18 2.42 0.00 1087 V 9.04 4.70 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 0.59 0.00 0.00 1.17 0.00 0.00 1088 C 8.84 5.25 0.00 2.82 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 1089 I 8.88 4.86 1.79 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.40 0.86 0.00 0.00 1090 T 9.00 4.79 4.23 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 1.26 0.00 0.00 1091 F 8.80 5.41 0.00 3.06 2.96 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 0.00 1092 D 8.40 4.51 0.00 2.88 2.34 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 0.00 1093 Q 8.50 3.61 0.00 1.84 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.02 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 1094 A 7.92 4.36 1.26 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 0.00 0.00 0.00 1095 N 7.80 5.48 0.00 2.66 2.70 0.00 0.00 6.91 6.62 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 1096 L 9.22 5.03 0.00 1.76 1.64 1.28 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 1097 T 8.88 4.81 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 1.11 0.00 0.00 1098 V 8.37 4.45 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 0.57 0.00 0.00 0.50 0.00 0.00 1099 K 8.91 4.93 0.00 1.73 1.57 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.36 7.81 1100 L 9.24 4.71 0.00 1.86 1.49 1.20 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 1101 P 0.00 4.14 0.00 1.90 2.06 0.00 3.16 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 2.27 0.00 1102 D 8.01 4.63 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 1103 G 8.32 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 1104 Y 8.18 4.23 0.00 3.23 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 1105 E 8.05 5.39 0.00 1.68 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 2.12 2.38 0.00 1106 F 8.62 5.03 0.00 3.15 3.20 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 1107 K 8.89 5.16 0.00 1.70 1.78 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.65 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.40 7.81 1108 F 9.10 5.12 0.00 3.29 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 1109 P 0.00 5.11 0.00 1.94 1.90 0.00 2.28 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.48 0.00 1110 N 8.74 4.79 0.00 2.97 3.04 0.00 0.00 7.09 8.21 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 1111 R 7.91 3.92 0.00 1.88 2.01 0.00 3.26 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 1112 L 7.97 4.24 0.00 1.68 1.75 1.04 1.10 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 1113 N 8.22 4.29 0.00 2.90 2.93 0.00 0.00 6.96 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1114 L 8.38 4.26 0.00 1.90 1.71 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 1115 E 8.59 4.61 0.00 2.03 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 2.28 2.34 0.00 1116 A 7.59 5.02 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 1117 I 8.45 4.21 1.68 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.36 0.93 0.00 0.00 1118 N 8.98 5.11 0.00 2.73 2.84 0.00 0.00 6.49 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 1119 Y 8.44 5.28 0.00 3.13 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 1120 M 8.48 5.21 0.00 2.04 1.81 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 2.47 2.44 0.00 1121 A 9.08 5.06 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 1122 A 9.16 5.35 1.34 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 0.00 0.00 0.00 1123 D 9.45 4.70 0.00 2.83 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 1124 G 8.75 3.79 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 0.00 0.00 0.00 1125 D 8.42 4.80 0.00 2.70 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 1126 F 7.67 4.77 0.00 2.01 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 1127 K 8.54 4.21 0.00 1.73 1.47 0.00 1.62 0.00 0.00 1.71 0.00 0.00 2.76 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.23 1.31 7.81 1128 I 8.10 3.79 1.78 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 1.28 0.58 0.91 0.00 0.00 1129 K 8.69 4.48 0.00 1.56 1.76 0.00 1.63 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.39 7.81 1130 C 7.30 4.76 0.00 2.90 2.92 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 1131 V 8.44 4.75 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 -0.10 0.00 0.00 0.86 0.00 0.00 1132 A 8.77 4.59 1.13 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 0.00 0.00 1133 F 9.04 4.87 0.00 2.87 3.05 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 1134 D 8.50 4.55 0.00 2.63 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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.