NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *987 H 4.7388 8.4449 117.3740 54.2359 30.0724 173.8699 988 M 3.8706 8.3254 121.1946 55.2418 32.3387 174.0782 989 R 4.5984 9.1066 122.7219 54.8121 34.7263 174.8123 990 D 4.2670 8.6177 117.1921 55.4493 38.8049 174.4297 991 V 4.5083 7.9325 119.1604 62.0578 33.4751 175.4797 992 V 4.8867 8.9149 128.9620 61.2411 33.7667 174.6063 993 S 4.8416 8.7121 120.9263 56.9925 66.9138 173.2990 994 F 4.8934 8.6784 119.5071 57.3031 38.8437 176.1569 995 E 4.2076 9.2798 123.0050 58.7208 29.8125 177.1572 996 Q 4.5167 7.7692 115.1562 53.1287 32.7709 173.1644 997 P 4.4824 0.0000 0.0000 64.7997 32.6349 175.5695 998 E 5.0965 7.4417 118.7248 54.7118 33.6601 174.6400 999 F 4.8669 9.1223 121.4507 55.7772 43.1861 173.9418 1000 S 5.3017 8.7935 117.8359 57.0785 65.0065 173.7233 1001 V 4.6421 8.9287 116.4210 59.9149 36.5666 174.3367 1002 S 5.1241 9.0523 117.7654 56.9555 64.3234 175.8657 1003 R 3.8224 8.8844 124.3494 59.2599 29.5983 177.5122 1004 G 4.0367 7.9454 104.2844 45.3898 0.0000 174.6832 1005 D 4.0963 8.0689 120.2793 55.1677 41.2265 177.3416 1006 Q 4.2509 8.2738 122.6848 56.1231 28.3065 173.7651 1007 V 5.0292 7.3091 107.1058 59.5794 36.1154 174.6835 1008 A 4.6043 9.2589 126.3066 50.7342 20.8334 176.1747 1009 R 4.8823 8.5481 121.8884 54.6225 32.0610 175.9421 1010 I 3.9204 8.7397 126.2976 58.3961 40.1878 173.2697 1011 P 5.1997 0.0000 0.0000 62.5024 33.0531 175.2120 1012 V 4.9779 9.3067 123.9596 61.1138 34.0879 174.2569 1013 I 5.1891 9.0181 121.7794 59.3331 40.5598 174.3627 1014 R 4.9236 8.8427 124.0182 54.6908 32.2718 174.7664 1015 R 4.5416 8.8496 124.5823 53.7036 34.3839 175.2721 1016 V 3.4714 7.9906 117.2410 64.0555 29.5558 172.7493 1017 L 4.6003 7.5299 119.2070 55.0930 42.5156 177.4790 1018 D 4.4691 9.0414 122.9014 54.5425 41.6144 176.3540 1019 G 3.8076 8.0341 104.8965 45.1049 0.0000 173.0242 1020 G 4.4895 7.6646 107.4342 44.0980 0.0000 173.0878 1021 K 4.7810 8.4986 118.6157 56.9233 34.0801 176.5574 1022 S 4.9998 9.1547 115.9498 57.2440 67.7458 173.0313 1023 Q 5.3382 9.1067 122.9699 54.7614 32.7986 174.1904 1024 V 5.0191 8.8490 116.8256 59.9432 36.6256 174.7837 1025 S 5.3129 9.1360 118.8528 57.7806 65.2640 172.9928 1026 Y 5.6570 8.6297 119.6102 55.8532 41.7547 174.1154 1027 R 5.2936 9.0139 116.1244 55.1100 33.1752 174.6545 1028 T 4.8753 8.7583 111.9374 62.2094 70.2253 173.5340 1029 Q 4.7408 9.2214 123.0390 54.5341 32.8706 173.6546 1030 D 5.1455 9.2436 125.8964 53.8775 41.6280 176.5136 1031 G 4.3046 8.6812 110.0571 46.0590 0.0000 176.3547 1032 T 4.0110 8.8472 114.4624 63.5818 69.2148 174.6429 1033 A 4.6686 8.3633 126.2745 51.4277 19.6752 176.1232 1034 Q 5.2889 9.4722 121.2427 53.4547 32.2768 175.6797 1035 G 2.9818 8.8936 111.1587 46.8127 0.0000 173.9054 1036 N 4.2644 8.4650 120.1579 53.6735 38.6667 173.8479 1037 R 4.3904 7.5295 113.3224 58.2590 32.0245 175.9646 1038 D 5.0785 8.1945 116.4799 54.9938 43.6029 175.3918 1039 Y 4.9568 7.2520 114.5894 56.0624 41.5122 173.4434 1040 I 4.3404 8.3533 121.7479 59.0503 38.1869 174.5541 1041 P 4.8057 0.0000 0.0000 62.8673 32.1648 176.1555 1042 V 4.7447 8.6679 121.1369 60.8772 34.9835 172.9073 1043 E 4.6760 8.4590 118.9356 54.5719 33.1442 175.5017 1044 G 3.7362 6.2317 104.7236 46.0004 0.0000 171.6723 1045 E 5.2606 8.7735 118.8913 54.5376 33.2586 175.7269 1046 L 4.6803 9.1907 121.8831 52.9773 44.8849 175.3502 1047 L 5.1658 8.5168 126.5210 53.3635 43.8626 175.3475 1048 F 4.7713 9.4900 126.9123 56.9277 40.5687 176.2497 1049 Q 4.7806 9.1839 123.0874 53.6782 31.0598 173.5227 1050 P 4.3957 0.0000 0.0000 64.6798 31.6200 176.9266 1051 G 4.0711 8.9630 110.9764 45.4304 0.0000 173.5805 1052 E 4.1305 7.9774 119.6031 56.4917 29.8306 176.3895 1053 A 4.9399 8.6517 124.3608 51.9015 21.3248 175.6185 1054 W 5.6679 7.9265 109.9006 55.7198 30.8388 174.0406 1055 K 4.2074 9.4337 120.1915 54.5484 36.3860 174.6577 1056 E 5.0455 8.2610 123.0429 54.5763 31.4003 175.0791 1057 L 4.3771 8.9261 127.7359 53.9047 43.5892 175.5601 1058 Q 5.1499 8.5237 121.5634 54.0993 31.3255 175.0065 1059 V 4.5198 8.4815 123.4278 60.7864 34.5246 174.8405 1060 K 4.6809 8.8008 127.2634 56.5810 33.1738 176.0822 1061 L 5.0889 8.6194 124.2882 53.2323 44.1138 175.8211 1062 L 4.8595 8.2569 120.4850 53.0892 44.4493 176.7364 1063 E 4.5082 8.8312 122.1125 55.9193 32.2159 178.1969 1064 L 4.3521 8.2039 119.9240 55.3894 40.7883 178.9057 *1069 S 4.4232 8.9970 128.5625 58.8710 64.6049 174.6736 1070 L 4.2581 7.9002 119.1183 55.9627 41.9293 177.2121 1071 L 4.4918 7.6164 117.7901 54.4159 42.5767 176.4113 1072 R 4.1987 7.2820 118.7691 57.5738 30.1620 176.9856 1073 G 4.0864 9.7634 112.2359 45.4320 0.0000 174.0798 1074 R 4.6203 7.8381 116.7846 55.6979 31.5867 174.2110 1075 Q 4.5865 8.2029 119.8696 54.8730 30.8516 174.5018 1076 V 4.8342 8.2228 125.0299 61.5716 34.7348 174.1858 1077 R 5.0061 8.9118 125.2459 54.8408 35.2321 174.0735 1078 R 5.1786 9.2252 116.8331 54.8252 33.4559 173.9357 1079 F 5.2662 8.4152 115.7417 55.3985 41.8362 172.9845 1080 H 5.2682 9.1629 114.2419 54.0213 32.9759 173.2385 1081 V 4.9825 8.5162 119.7382 61.3692 34.9926 174.2298 1082 Q 5.3475 9.4954 126.1722 54.2962 32.1206 174.6151 1083 L 5.3808 8.9672 123.5012 54.1627 43.8755 175.8272 1084 S 4.3606 9.1316 115.3103 57.5420 66.7915 173.0375 1085 N 4.0742 8.5387 115.1903 54.0407 36.6363 172.5212 1086 P 4.5870 0.0000 0.0000 62.9083 32.8249 176.1510 1087 K 4.3519 8.4586 119.9819 55.5453 35.8821 176.0250 1088 F 3.9321 9.0345 115.8228 58.9223 35.8159 176.6246 1089 G 3.9050 8.4948 107.8004 44.8038 0.0000 174.3285 1090 A 4.4345 7.3270 120.5090 52.3207 19.4880 176.6105 1091 H 4.9163 8.8460 115.1718 54.0058 33.6078 172.6540 1092 L 4.7759 8.6118 120.9457 54.2086 42.7169 176.8194 1093 G 4.2407 8.7236 112.5547 44.9815 0.0000 171.8721 1094 Q 4.9856 8.5510 118.4432 53.3918 31.1748 174.1042 1095 P 4.5891 0.0000 0.0000 62.5719 32.7465 175.8234 1096 H 5.0214 8.4985 115.2519 55.7008 29.9062 173.8632 1097 S 5.4358 8.0197 113.1920 57.1809 65.5469 172.4855 1098 T 4.8063 8.5976 118.6769 60.7539 71.5597 172.2031 1099 T 4.7882 8.5030 121.2021 61.6607 71.8312 173.2155 1100 I 4.4379 8.1891 127.4750 59.6986 39.1999 174.6648 1101 I 4.6249 8.6964 129.4281 59.8005 39.1978 174.9427 1102 I 4.8233 9.0627 129.5168 60.0348 38.5981 175.2983 1103 R 5.1115 8.7851 126.4995 54.0790 33.3747 175.7543 1104 D 4.8390 8.1828 120.9118 53.3636 41.7839 174.8975 1105 P 4.1558 0.0000 0.0000 63.4268 31.6862 176.6747 1106 D 4.6367 8.5159 123.0358 53.2857 39.9129 176.4325 1107 E 4.2598 8.4363 122.3889 56.2340 29.7276 176.4053 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 *987 H 8.44 4.74 0.00 2.67 2.91 0.00 5.81 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 988 M 8.33 3.87 0.00 1.91 1.96 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 989 R 9.11 4.60 0.00 1.79 1.96 0.00 3.39 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 990 D 8.62 4.27 0.00 2.80 2.61 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 0.00 991 V 7.93 4.51 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 0.98 0.00 0.00 0.92 0.00 0.00 992 V 8.91 4.89 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 0.88 0.00 0.00 0.70 0.00 0.00 993 S 8.71 4.84 0.00 4.11 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 0.00 994 F 8.68 4.89 0.00 3.09 3.24 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 0.00 995 E 9.28 4.21 0.00 2.13 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 996 Q 7.77 4.52 0.00 0.93 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.35 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 997 P 0.00 4.48 0.00 2.03 2.24 0.00 3.46 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 1.94 1.92 0.00 998 E 7.44 5.10 0.00 1.62 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 999 F 9.12 4.87 0.00 2.77 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 1000 S 8.79 5.30 0.00 3.73 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1001 V 8.93 4.64 2.24 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 0.77 0.00 0.00 1.02 0.00 0.00 1002 S 9.05 5.12 0.00 4.01 3.78 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 0.00 0.00 0.00 1003 R 8.88 3.82 0.00 1.91 2.01 0.00 3.45 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 1004 G 7.95 4.04 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 0.00 0.00 0.00 1005 D 8.07 4.10 0.00 2.84 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 1006 Q 8.27 4.25 0.00 2.16 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.47 0.00 1007 V 7.31 5.03 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 0.70 0.00 0.00 0.95 0.00 0.00 1008 A 9.26 4.60 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 1009 R 8.55 4.88 0.00 1.68 2.04 0.00 3.17 0.00 0.00 3.50 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 1010 I 8.74 3.92 1.77 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.56 0.62 0.00 0.00 1011 P 0.00 5.20 0.00 2.28 2.34 0.00 2.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.06 0.00 1012 V 9.31 4.98 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 1.13 0.00 0.00 0.86 0.00 0.00 1013 I 9.02 5.19 1.95 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.78 1.01 0.00 0.00 1014 R 8.84 4.92 0.00 0.73 1.47 0.00 2.96 0.00 0.00 2.42 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.24 0.00 1015 R 8.85 4.54 0.00 1.72 1.77 0.00 3.33 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 1016 V 7.99 3.47 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 0.89 0.00 0.00 0.92 0.00 0.00 1017 L 7.53 4.60 0.00 1.66 1.60 0.93 1.17 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 1018 D 9.04 4.47 0.00 2.64 2.78 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 0.00 0.00 0.00 1019 G 8.03 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 1020 G 7.66 4.49 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 0.00 0.00 0.00 1021 K 8.50 4.78 0.00 1.87 1.76 0.00 1.06 0.00 0.00 1.38 0.00 0.00 2.23 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.19 1.21 7.81 1022 S 9.15 5.00 0.00 3.77 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 1023 Q 9.11 5.34 0.00 2.46 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.66 0.00 0.00 0.00 0.00 0.00 2.30 2.60 0.00 1024 V 8.85 5.02 2.14 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 0.70 0.00 0.00 1.07 0.00 0.00 1025 S 9.14 5.31 0.00 3.83 3.73 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 1026 Y 8.63 5.66 0.00 3.18 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1027 R 9.01 5.29 0.00 1.91 1.99 0.00 2.81 0.00 0.00 3.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 1028 T 8.76 4.88 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 1.41 0.00 0.00 1029 Q 9.22 4.74 0.00 2.19 2.04 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 2.35 2.44 0.00 1030 D 9.24 5.15 0.00 2.71 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 1031 G 8.68 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 0.00 0.00 0.00 0.00 1032 T 8.85 4.01 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 1.25 0.00 0.00 1033 A 8.36 4.67 1.58 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 1034 Q 9.47 5.29 0.00 2.06 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.95 0.00 0.00 0.00 0.00 0.00 2.46 2.34 0.00 1035 G 8.89 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1036 N 8.47 4.26 0.00 2.71 2.84 0.00 0.00 6.87 8.45 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 1037 R 7.53 4.39 0.00 1.78 1.98 0.00 3.28 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 1038 D 8.19 5.08 0.00 2.87 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 1039 Y 7.25 4.96 0.00 2.72 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 1040 I 8.35 4.34 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.57 0.87 0.00 0.00 1041 P 0.00 4.81 0.00 1.91 2.01 0.00 3.51 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 1.87 1.72 0.00 1042 V 8.67 4.74 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 0.91 0.00 0.00 1.06 0.00 0.00 1043 E 8.46 4.68 0.00 1.97 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 1044 G 6.23 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 1045 E 8.77 5.26 0.00 1.85 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.35 0.00 1046 L 9.19 4.68 0.00 1.61 1.37 0.84 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 1047 L 8.52 5.17 0.00 1.67 1.57 1.19 0.84 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 1048 F 9.49 4.77 0.00 3.04 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 1049 Q 9.18 4.78 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.90 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 1050 P 0.00 4.40 0.00 2.04 2.21 0.00 3.68 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 2.02 2.10 0.00 1051 G 8.96 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 1052 E 7.98 4.13 0.00 2.32 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 2.35 2.38 0.00 1053 A 8.65 4.94 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 1054 W 7.93 5.67 0.00 3.68 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1055 K 9.43 4.21 0.00 1.37 1.34 0.00 0.61 0.00 0.00 1.06 0.00 0.00 2.13 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.83 0.47 7.81 1056 E 8.26 5.05 0.00 1.92 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 0.00 2.16 2.35 0.00 1057 L 8.93 4.38 0.00 1.62 1.35 0.70 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 1058 Q 8.52 5.15 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 1059 V 8.48 4.52 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 0.99 0.00 0.00 1.09 0.00 0.00 1060 K 8.80 4.68 0.00 1.78 1.73 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.55 1.50 7.81 1061 L 8.62 5.09 0.00 1.55 1.65 0.99 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 1062 L 8.26 4.86 0.00 1.62 1.51 0.82 0.84 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 1063 E 8.83 4.51 0.00 1.96 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 2.48 2.34 0.00 1064 L 8.20 4.35 0.00 1.63 0.94 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 *1069 S 9.00 4.42 0.00 3.91 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1070 L 7.90 4.26 0.00 1.64 1.72 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 1071 L 7.62 4.49 0.00 1.70 1.69 0.93 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 1072 R 7.28 4.20 0.00 1.93 1.89 0.00 3.13 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 1073 G 9.76 4.09 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 0.00 1074 R 7.84 4.62 0.00 1.88 1.88 0.00 3.16 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 1075 Q 8.20 4.59 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 1076 V 8.22 4.83 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 0.86 0.00 0.00 0.94 0.00 0.00 1077 R 8.91 5.01 0.00 1.85 1.90 0.00 3.30 0.00 0.00 3.40 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 1078 R 9.23 5.18 0.00 1.74 1.89 0.00 2.70 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 1079 F 8.42 5.27 0.00 2.93 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 1080 H 9.16 5.27 0.00 3.11 3.18 0.00 5.56 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 1081 V 8.52 4.98 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 1.39 0.00 0.00 0.92 0.00 0.00 1082 Q 9.50 5.35 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.53 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 1083 L 8.97 5.38 0.00 1.57 1.60 0.56 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 1084 S 9.13 4.36 0.00 3.87 3.99 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 1085 N 8.54 4.07 0.00 2.80 2.83 0.00 0.00 6.86 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1086 P 0.00 4.59 0.00 2.25 1.99 0.00 3.72 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.95 0.00 1087 K 8.46 4.35 0.00 1.03 0.74 0.00 1.44 0.00 0.00 1.19 0.00 0.00 2.74 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.05 1.33 7.81 1088 F 9.03 3.93 0.00 3.32 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 1089 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 1090 A 7.33 4.43 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1091 H 8.85 4.92 0.00 3.11 3.14 0.00 5.80 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 1092 L 8.61 4.78 0.00 1.51 1.61 0.89 0.86 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 1093 G 8.72 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 0.00 0.00 0.00 0.00 1094 Q 8.55 4.99 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.92 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 1095 P 0.00 4.59 0.00 2.55 2.18 0.00 3.93 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.05 0.00 1096 H 8.50 5.02 0.00 3.34 3.79 0.00 5.59 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1097 S 8.02 5.44 0.00 3.94 3.73 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 1098 T 8.60 4.81 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 1099 T 8.50 4.79 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 1.05 0.00 0.00 1100 I 8.19 4.44 0.56 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 0.51 0.62 0.64 0.00 0.00 1101 I 8.70 4.62 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.58 0.88 0.00 0.00 1102 I 9.06 4.82 1.95 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.22 0.98 0.00 0.00 1103 R 8.79 5.11 0.00 1.73 1.80 0.00 3.12 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 1104 D 8.18 4.84 0.00 2.56 2.61 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 1105 P 0.00 4.16 0.00 2.17 2.01 0.00 3.67 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 2.04 2.13 0.00 1106 D 8.52 4.64 0.00 2.66 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1107 E 8.44 4.26 0.00 1.95 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 2.24 2.28 0.00 * Residues marked with a * may have inaccurate shift predictions.