NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1001 A 4.2082 8.3645 123.5825 52.3306 19.2897 176.1187 1002 S 4.1644 7.8064 119.2924 56.3548 64.2657 171.6690 1003 R 3.5512 9.3155 119.0797 58.4450 28.8934 171.8892 1004 G 3.8845 8.6494 113.8780 44.2131 0.0000 172.1476 1005 V 4.1948 8.1430 117.7432 60.6607 33.4322 174.4201 1006 N 4.8055 8.6205 125.8675 52.0273 39.4342 173.3405 1007 K 4.8767 8.2709 126.3383 55.2709 35.4289 175.0088 1008 V 4.6007 8.8324 126.7278 59.8859 34.8543 174.4882 1009 I 4.8557 8.2469 122.2069 59.6248 39.8642 174.7841 1010 L 4.8221 9.3045 127.3250 52.8389 45.8557 175.8599 1011 V 4.9176 7.9772 120.8609 61.7555 34.5629 174.7584 1012 G 3.9962 7.9787 113.1950 46.4650 0.0000 171.2836 1013 N 5.6617 7.8734 116.2173 51.1682 42.1915 174.3181 1014 L 4.6581 8.6883 122.8857 54.7379 41.7767 177.8124 1015 G 4.2619 9.2183 111.7230 48.6911 0.0000 173.9154 1016 Q 4.7136 8.3146 115.0495 55.2800 30.9233 173.0117 1017 D 4.3301 8.4024 120.5695 50.5376 42.1067 174.9505 1018 P 4.2272 0.0000 0.0000 63.9601 31.8484 176.9657 1019 E 4.3308 8.8939 124.1970 55.5850 29.4514 171.6124 1020 V 4.2388 8.0351 125.6421 61.7342 32.9950 174.9213 1021 R 4.8151 9.1951 126.5148 55.0696 34.1911 173.0747 1022 Y 4.6944 8.7113 122.3634 56.1368 39.4652 175.5405 1023 M 4.5119 8.7372 122.5116 53.0737 32.7464 176.8485 1024 P 4.3389 0.0000 0.0000 64.1957 30.2323 179.8546 1025 N 4.2324 9.0561 117.7948 54.6820 37.4147 175.0236 1026 G 3.7668 8.8031 113.9270 44.8263 0.0000 172.1228 1027 G 3.8846 7.8760 104.8106 47.2564 0.0000 172.5254 1028 A 4.3921 8.2724 125.5184 50.8438 21.3658 173.1688 1029 V 4.4967 8.3295 119.4402 61.3478 35.3947 173.1288 1030 A 4.9538 8.4478 129.2512 50.0573 22.4426 174.5547 1031 N 5.3665 8.6232 118.2598 51.3984 41.9112 173.5925 1032 I 4.8808 9.0136 118.2471 59.0478 41.2535 174.5306 1033 T 5.0537 8.5233 114.8645 60.2914 70.9303 172.8990 1034 L 5.1585 9.4027 127.4196 53.0124 44.2709 175.3267 1035 A 4.4613 8.7132 125.4313 49.9453 21.4881 175.4311 1036 T 4.8447 8.2412 112.6322 59.7233 71.7896 173.3411 1037 S 5.2560 8.8298 121.2683 57.0956 66.9660 173.6090 1038 E 4.8126 8.9822 117.6039 55.2771 33.4436 176.4179 1039 S 5.1831 9.0268 121.0592 55.4577 65.4992 173.7074 1040 W 4.7288 8.2553 130.1100 58.5699 27.2927 174.7953 *1050 E 4.0060 7.9572 116.1626 56.6107 30.7129 180.4873 1051 Q 4.5623 8.3960 114.1520 56.9306 31.8274 173.0903 1052 T 4.8138 8.6269 120.2426 60.3056 69.6698 173.3529 1053 E 4.7850 8.5243 124.4805 54.4935 33.3402 173.6577 1054 W 5.0834 8.9585 126.0065 55.4259 31.4360 175.0952 1055 H 5.0597 9.6284 123.0417 54.6828 32.2475 173.3725 1056 R 4.7708 8.5831 122.4858 55.6890 31.3542 173.8731 1057 V 4.9639 9.2272 124.3015 59.9571 35.3481 174.3883 1058 V 4.6749 8.1704 126.4248 59.8667 33.8965 174.9428 1059 L 4.8114 8.5117 124.4733 53.1031 45.1043 174.8248 1060 F 5.5033 7.7407 117.4848 54.2262 44.2502 178.1478 1061 G 4.1992 8.9665 109.0512 45.6648 0.0000 177.1942 1062 K 3.8783 8.9956 132.7438 59.9844 31.2263 177.6911 1063 L 4.2110 8.0886 119.4280 57.6157 41.4589 179.2812 1064 A 3.9568 8.4522 123.7348 55.6716 18.2983 179.5841 1065 E 3.8602 8.3024 115.9732 61.5042 29.7192 181.7942 1066 V 3.7845 8.0418 119.1062 64.9074 31.1989 177.8442 1067 A 3.9692 7.9262 121.8245 54.9757 17.9151 179.0029 1068 S 4.0748 7.9452 112.0520 62.6836 62.4290 176.7184 1069 E 4.1764 8.3865 122.1462 62.0562 29.6410 180.9638 *1070 Y 4.4577 8.3797 120.5953 59.8319 37.8847 178.5963 1071 L 4.4176 7.7330 121.9793 55.3727 42.5095 177.0152 1072 R 4.8012 8.4376 120.8648 55.7353 35.2638 179.4663 1073 K 4.4227 9.3447 112.2880 55.2169 32.5504 178.0885 1074 G 3.9278 9.5575 108.6099 47.8577 0.0000 173.9713 1075 S 4.3031 8.2957 115.8576 58.7393 64.4251 172.9745 1076 Q 5.0598 8.6151 122.2858 54.7497 31.4998 174.6064 1077 V 4.9677 8.9139 118.5900 59.8352 37.0631 173.2977 1078 Y 5.1277 8.6117 121.3904 56.1097 41.5503 174.3301 1079 I 4.7552 8.6955 127.1607 59.3579 41.8331 174.0637 1080 E 4.9467 8.6741 126.1179 54.9746 32.7589 174.0808 1081 G 4.1477 8.4444 114.8311 45.9866 0.0000 171.2032 1082 Q 5.2388 8.6556 118.5439 54.0167 33.3574 174.5195 1083 L 5.1231 9.1336 123.6366 54.5015 43.2317 177.6693 1084 R 4.5710 9.0782 123.7598 55.7272 33.4488 171.0912 1085 T 5.1227 8.7019 122.1665 61.0202 70.1884 174.4443 1086 R 4.7873 9.1147 126.1209 54.8570 32.1533 176.0521 1087 K 5.1594 8.7705 126.0004 54.7300 33.4078 174.2436 1088 W 5.0649 8.6838 119.4369 55.4653 31.8818 173.6407 1089 T 4.2296 8.6229 115.1158 60.5357 69.2976 174.3870 1090 D 4.8642 8.0624 128.9781 53.8507 43.2061 177.2469 1091 Q 4.2457 10.6216 117.1364 55.2612 27.3175 171.5637 *1095 D 4.2878 8.0244 118.2544 54.9877 42.1109 175.3742 1096 R 4.5586 7.8755 123.5653 55.0136 34.5883 174.4297 *1097 Y 5.3003 8.3452 120.4106 56.0660 40.9533 175.9751 1098 T 4.7760 8.9910 118.3596 61.9130 72.2190 173.0157 1099 T 4.9853 8.6913 123.0600 62.3566 70.3547 173.8331 1100 E 4.7579 8.9041 123.7701 55.0569 35.2299 174.1619 1101 V 4.6725 8.4658 121.3102 61.4860 33.4041 174.6516 1102 V 4.5239 9.2242 129.8019 60.0901 33.5449 175.4341 1103 V 4.2718 8.3752 128.9189 63.7626 30.6025 175.9260 1104 N 4.8502 8.9544 127.5265 52.4390 39.7943 176.6216 1105 V 3.9772 9.6949 112.4202 62.9142 31.0990 180.5197 1106 G 3.9332 9.3658 104.4873 46.6285 0.0000 173.7601 1107 G 4.1705 7.6216 106.5069 45.1087 0.0000 173.3327 1108 T 4.6615 8.4279 114.3596 63.0508 73.5184 172.6540 1109 M 5.2792 8.5201 122.0091 54.3759 35.9725 174.4109 1110 Q 4.7297 8.7952 123.7995 55.5751 33.9779 174.2625 1111 M 4.6280 8.7251 123.6692 54.6261 32.7052 174.3556 1112 L 4.4149 8.3877 122.1698 54.1554 41.8382 176.4696 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 8.36 4.21 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 1002 S 7.81 4.16 0.00 3.73 3.70 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 1003 R 9.32 3.55 0.00 1.95 1.81 0.00 3.38 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.17 0.00 1004 G 8.65 3.88 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 0.00 0.00 0.00 1005 V 8.14 4.19 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 0.85 0.00 0.00 0.93 0.00 0.00 1006 N 8.62 4.81 0.00 2.69 2.71 0.00 0.00 6.92 6.68 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 1007 K 8.27 4.88 0.00 1.76 1.62 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.44 7.81 1008 V 8.83 4.60 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 0.70 0.00 0.00 0.88 0.00 0.00 1009 I 8.25 4.86 1.88 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.68 1.04 0.00 0.00 1010 L 9.30 4.82 0.00 1.21 1.33 0.70 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 1011 V 7.98 4.92 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 0.84 0.00 0.00 1.11 0.00 0.00 1012 G 7.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.87 5.66 0.00 2.62 2.67 0.00 0.00 7.48 6.75 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 1014 L 8.69 4.66 0.00 1.88 1.64 0.93 1.17 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 1015 G 9.22 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 1016 Q 8.31 4.71 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.63 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 1017 D 8.40 4.33 0.00 2.69 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 P 0.00 4.23 0.00 2.05 2.06 0.00 3.82 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.18 0.00 1019 E 8.89 4.33 0.00 1.72 1.92 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 2.23 2.12 0.00 1020 V 8.04 4.24 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.91 0.00 0.00 1021 R 9.20 4.82 0.00 1.79 1.64 0.00 3.26 0.00 0.00 3.15 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.76 0.00 1022 Y 8.71 4.69 0.00 2.86 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 1023 M 8.74 4.51 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.62 0.00 1024 P 0.00 4.34 0.00 2.21 1.27 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 1025 N 9.06 4.23 0.00 2.76 2.70 0.00 0.00 6.74 7.51 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 1026 G 8.80 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 1027 G 7.88 3.88 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 0.00 0.00 0.00 1028 A 8.27 4.39 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1029 V 8.33 4.50 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 0.82 0.00 0.00 1.11 0.00 0.00 1030 A 8.45 4.95 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 1031 N 8.62 5.37 0.00 2.68 2.64 0.00 0.00 6.44 8.13 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 1032 I 9.01 4.88 1.87 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 1.33 0.93 0.88 0.00 0.00 1033 T 8.52 5.05 4.48 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 0.00 0.00 0.00 1.25 0.00 0.00 1034 L 9.40 5.16 0.00 1.57 1.54 0.83 0.48 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 1035 A 8.71 4.46 -0.06 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 1036 T 8.24 4.84 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 1.12 0.00 0.00 1037 S 8.83 5.26 0.00 3.86 3.80 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 1038 E 8.98 4.81 0.00 1.64 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 2.13 2.13 0.00 1039 S 9.03 5.18 0.00 3.90 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 1040 W 8.26 4.73 0.00 3.38 3.29 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 *1050 E 7.96 4.01 0.00 2.04 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 2.13 1.88 0.00 1051 Q 8.40 4.56 0.00 1.71 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.71 0.00 0.00 0.00 0.00 0.00 2.16 2.14 0.00 1052 T 8.63 4.81 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 1.42 0.00 0.00 1053 E 8.52 4.79 0.00 2.09 1.65 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 2.08 2.16 0.00 1054 W 8.96 5.08 0.00 3.22 3.22 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 1055 H 9.63 5.06 0.00 3.02 3.15 0.00 5.80 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1056 R 8.58 4.77 0.00 1.50 1.80 0.00 3.19 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.18 0.00 1057 V 9.23 4.96 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.89 0.00 0.00 1058 V 8.17 4.67 1.87 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 0.37 0.00 0.00 0.44 0.00 0.00 1059 L 8.51 4.81 0.00 1.39 1.50 0.81 0.64 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 1060 F 7.74 5.50 0.00 2.92 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 1061 G 8.97 4.20 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 0.00 1062 K 9.00 3.88 0.00 1.77 1.86 0.00 1.81 0.00 0.00 1.82 0.00 0.00 3.11 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.13 7.81 1063 L 8.09 4.21 0.00 1.83 1.75 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 1064 A 8.45 3.96 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 1065 E 8.30 3.86 0.00 2.00 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 2.26 2.23 0.00 1066 V 8.04 3.78 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 0.83 0.00 0.00 0.94 0.00 0.00 1067 A 7.93 3.97 1.41 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 0.00 0.00 0.00 1068 S 7.95 4.07 0.00 3.89 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 1069 E 8.39 4.18 0.00 2.10 1.86 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 2.26 2.21 0.00 *1070 Y 8.38 4.46 0.00 2.36 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 0.00 0.00 0.00 0.00 1071 L 7.73 4.42 0.00 1.77 1.63 0.92 0.75 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 1072 R 8.44 4.80 0.00 1.67 1.72 0.00 3.27 0.00 0.00 3.37 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.18 0.00 1073 K 9.34 4.42 0.00 1.79 1.20 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.73 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.32 7.81 1074 G 9.56 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 1075 S 8.30 4.30 0.00 3.90 4.17 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 1076 Q 8.62 5.06 0.00 2.13 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 1077 V 8.91 4.97 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.90 0.00 0.00 1078 Y 8.61 5.13 0.00 3.10 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 1079 I 8.70 4.76 1.64 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 0.96 0.97 0.76 0.00 0.00 1080 E 8.67 4.95 0.00 1.90 1.71 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 0.00 2.19 2.25 0.00 1081 G 8.44 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1082 Q 8.66 5.24 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.81 0.00 0.00 0.00 0.00 0.00 2.47 2.31 0.00 1083 L 9.13 5.12 0.00 1.51 1.61 0.93 0.72 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 1084 R 9.08 4.57 0.00 1.42 1.74 0.00 3.25 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.46 0.00 1085 T 8.70 5.12 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 1.32 0.00 0.00 1086 R 9.11 4.79 0.00 1.93 2.07 0.00 2.78 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 1087 K 8.77 5.16 0.00 1.56 1.63 0.00 1.85 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.33 1.00 7.81 1088 W 8.68 5.06 0.00 3.49 3.18 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 1089 T 8.62 4.23 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 1.26 0.00 0.00 1090 D 8.06 4.86 0.00 2.66 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 1091 Q 10.62 4.25 0.00 2.12 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.17 0.00 0.00 0.00 0.00 0.00 2.31 2.20 0.00 *1095 D 8.02 4.29 0.00 2.57 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 1096 R 7.88 4.56 0.00 0.67 1.21 0.00 2.75 0.00 0.00 2.50 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.93 0.00 *1097 Y 8.35 5.30 0.00 2.04 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 0.00 0.00 0.00 1098 T 8.99 4.78 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 1.31 0.00 0.00 1099 T 8.69 4.99 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 1.24 0.00 0.00 1100 E 8.90 4.76 0.00 1.89 1.77 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 2.22 2.26 0.00 1101 V 8.47 4.67 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 0.92 0.00 0.00 0.92 0.00 0.00 1102 V 9.22 4.52 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.15 0.00 0.00 1103 V 8.38 4.27 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 0.79 0.00 0.00 0.86 0.00 0.00 1104 N 8.95 4.85 0.00 2.75 2.26 0.00 0.00 6.81 7.67 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 1105 V 9.69 3.98 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 0.88 0.00 0.00 0.93 0.00 0.00 1106 G 9.37 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 1107 G 7.62 4.17 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 0.00 1108 T 8.43 4.66 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 1.28 0.00 0.00 1109 M 8.52 5.28 0.00 1.96 1.84 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 2.43 2.45 0.00 1110 Q 8.80 4.73 0.00 2.23 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 1111 M 8.73 4.63 0.00 1.80 1.84 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.14 0.00 1112 L 8.39 4.41 0.00 1.62 1.57 0.98 0.74 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 * Residues marked with a * may have inaccurate shift predictions.