NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1040 D 4.6154 8.3649 120.5322 53.0163 42.3125 174.7330 1041 P 4.1754 0.0000 0.0000 62.2864 31.7409 174.6452 1042 I 4.2457 8.7963 122.0386 60.7142 40.2651 174.7185 1043 R 4.6952 8.7263 125.6281 54.3545 33.5972 174.3852 1044 L 5.0179 8.5760 123.5433 53.4496 43.2454 175.8414 1045 R 4.9022 9.0817 122.3546 55.3081 35.8420 173.5634 1046 H 5.3803 9.2924 117.1071 53.2779 31.6659 173.6680 1047 L 4.8402 8.7879 124.1923 54.3758 42.7085 174.9856 1048 Y 4.6339 9.0492 126.2998 56.3470 40.7022 174.3824 1049 T 4.5121 7.7853 119.8491 61.2459 71.7989 171.5501 1050 S 4.6513 7.1454 116.2982 58.4365 65.3708 175.0616 1051 G 3.9734 8.1337 108.3144 44.1799 0.0000 173.1186 1052 P 4.2601 0.0000 0.0000 66.6038 31.3085 178.2141 *1053 H 4.1521 8.1353 114.6342 55.8484 28.4154 177.0701 1054 G 4.2085 8.2570 109.8584 46.3001 0.0000 176.2035 1055 L 4.1316 7.8595 120.4507 57.1678 41.3221 181.3843 1056 S 4.7399 7.3766 115.7086 57.9232 61.4147 176.8317 1057 S 4.5842 8.1800 119.1746 57.7214 63.5296 172.4043 1058 C 4.9814 8.8004 127.6167 57.6330 34.6164 172.2337 1059 F 5.2827 9.0557 125.1406 55.2117 40.9679 174.7516 1060 L 4.2893 9.1020 126.7826 55.6750 43.0801 175.4781 1061 R 4.9298 9.1972 127.3147 54.5890 32.9085 174.4243 1062 I 4.4503 8.0739 126.9278 59.6288 38.5271 176.0220 1063 R 4.1987 8.8637 126.8832 55.2337 30.8028 178.1811 1064 A 4.0777 8.4558 122.5706 54.9135 18.5313 178.2010 1065 D 4.6488 8.1186 113.9572 53.2305 39.7080 177.6983 1066 G 3.9727 8.1859 109.0964 44.8209 0.0000 174.2405 1067 V 3.9639 7.8187 120.3478 62.3511 32.1851 174.7907 1068 V 4.7504 8.2514 125.8661 61.1625 33.0999 173.9991 1069 D 4.7875 8.6070 126.9067 52.7605 43.0510 172.9120 1070 C 5.1317 8.7751 115.3473 58.8170 29.7555 173.2962 1071 A 4.7744 9.1323 128.4250 50.9338 20.3592 179.1127 1072 R 4.0194 8.9196 119.9208 58.9304 29.8198 175.3442 1073 G 4.2694 7.6234 103.5515 44.0847 0.0000 172.0980 1074 Q 3.3900 7.5950 118.4831 55.9668 28.9795 176.4399 1075 S 4.4211 8.7783 115.8666 56.8791 66.6259 174.8481 1076 A 4.0059 8.2282 122.1343 55.3788 18.3503 179.3104 1077 H 4.4676 7.5421 112.4919 57.6987 29.4604 176.6603 1078 S 4.7972 7.5892 112.0505 57.2766 63.8035 173.2231 1079 L 3.8014 7.4857 124.3225 55.0982 42.5099 175.4395 1080 L 5.1572 9.0798 126.9749 52.8986 45.2375 175.2948 1081 E 4.8508 9.2426 123.4717 54.8483 31.6149 174.6253 1082 I 4.9105 9.1339 129.6422 59.5994 39.2964 174.8595 1083 K 5.0105 9.1090 127.1539 54.6212 35.2434 175.7478 1084 A 4.6166 8.7251 126.9506 52.2729 19.0886 177.3538 1085 V 4.2068 8.6332 115.0313 61.9987 34.0962 175.2524 1086 A 4.6307 7.8019 120.2053 51.2407 22.8563 176.5846 1087 L 3.1036 7.9643 114.9356 55.4325 41.9434 178.6294 1088 R 4.6410 8.9936 121.5704 57.5731 31.8001 178.6319 1089 T 5.0841 7.6779 117.1601 63.5288 70.3840 174.5082 1090 V 5.1797 9.3574 118.0511 59.6176 36.7382 174.1193 1091 A 5.2953 9.2712 123.7650 50.3296 22.1221 175.3081 1092 I 4.9658 8.6004 121.6369 59.3420 40.5187 174.4347 1093 K 4.7947 9.0664 128.4190 54.1447 35.5302 175.2376 1094 G 3.8660 9.1780 115.5044 46.2068 0.0000 174.2302 1095 V 3.5625 8.5257 127.0092 66.6491 31.4254 177.1339 1096 H 4.2984 8.3530 118.5637 59.0780 29.9135 176.2925 1097 S 4.2558 8.0812 111.7897 58.7385 63.4251 173.8989 1098 V 3.2743 7.6956 119.6652 64.0715 30.3671 171.7668 1099 R 4.7723 7.4086 115.4130 54.0835 33.3686 175.2496 1100 Y 4.7253 9.0840 121.2866 57.3635 39.8430 174.6545 1101 L 4.4766 9.6125 126.9305 55.4145 43.1036 175.0317 1102 C 5.6110 9.6156 123.8934 55.4281 44.6550 172.5560 1103 M 4.8794 9.3409 121.8749 53.8595 33.4508 175.9159 1104 G 4.2192 8.8255 115.8234 44.5833 0.0000 172.2345 1105 A 4.1240 8.5048 124.7362 53.7283 18.9250 177.6340 1106 D 4.4841 9.6643 119.6592 54.8819 38.5943 174.9268 1107 G 3.8107 7.9920 105.8194 45.0558 0.0000 173.9342 1108 K 4.0425 7.9604 122.5215 56.7572 33.0020 175.9079 1109 M 5.0655 8.5925 127.1494 54.9207 33.4935 175.2430 1110 Q 4.5645 9.1521 119.1939 55.1847 32.9022 173.2540 1111 G 4.4051 9.3532 108.0641 44.7891 0.0000 172.5914 1112 L 5.0164 8.8151 126.2201 52.8436 44.0511 178.2339 1113 L 4.2553 8.8259 122.3307 56.8779 42.0359 177.3445 1114 Q 4.6959 7.9201 117.3749 53.9779 30.3625 174.5353 1115 Y 3.8965 8.3024 124.4595 56.9062 39.7019 174.3392 1116 S 4.1386 7.1350 120.0188 56.2379 65.9882 173.7422 1117 E 3.5712 8.9467 126.3373 58.0709 29.3402 178.7260 1118 E 3.9073 8.0079 114.3920 58.5763 29.7111 177.0926 1119 D 4.8412 7.4356 117.4696 54.3380 42.3619 176.6399 1120 C 4.9828 8.1644 113.6722 54.8246 41.3815 172.9901 1121 A 4.8295 7.0413 121.4598 49.9743 20.7559 176.5179 1122 F 5.2434 8.8632 120.3270 55.5512 43.7640 174.1689 1123 E 4.7315 9.4279 122.7311 56.0803 30.4669 175.4523 1124 E 4.3537 9.6349 128.1601 55.3066 30.4939 175.1598 1125 E 4.6661 8.7958 128.0838 54.2266 33.0398 174.2337 1126 I 4.5862 8.4006 127.0230 60.7684 39.1112 175.2824 1127 R 4.5362 8.9977 128.4730 53.9848 32.2007 175.7402 1128 P 4.2252 0.0000 0.0000 65.8073 31.3193 177.5867 1129 D 4.5212 8.0723 114.7788 53.8504 39.4686 177.0945 1130 G 3.9737 8.4256 108.8176 45.7721 0.0000 173.1177 1131 Y 4.6004 8.7916 118.0609 57.0525 40.4724 174.2206 1132 N 5.3489 9.4009 118.2087 51.7948 41.7166 174.3061 1133 V 4.8523 8.4545 121.1017 61.3733 35.0287 173.8932 1134 Y 4.9095 8.7395 124.8061 56.6165 39.9532 174.6223 1135 R 5.0383 9.0496 124.4132 54.7363 33.0485 175.5191 1136 S 5.0610 8.8576 118.0315 56.8239 63.7367 174.2066 1137 E 3.9029 9.1940 128.6723 59.3678 29.8373 177.6667 1138 K 4.0015 8.1445 117.9603 59.7041 32.2135 177.1695 1139 H 4.5216 8.0535 112.4324 55.5782 29.0411 175.2994 1140 R 3.9795 7.8582 117.3515 56.6542 28.2845 175.6770 1141 L 4.5772 7.4734 114.2178 52.6575 46.5034 173.8560 1142 P 5.0932 0.0000 0.0000 61.4838 32.8898 175.7328 1143 V 3.6018 8.7573 121.8266 63.6056 32.3641 174.7877 1144 S 4.9522 8.4007 119.8217 57.1997 65.3764 173.4215 1145 L 4.8105 8.4377 123.6963 54.7789 42.0390 177.3775 1146 S 4.4068 8.2358 115.4456 58.4237 63.5232 175.1207 1147 S 4.5203 8.6226 118.8207 57.1608 65.2465 175.2694 1148 A 3.9762 8.4035 123.2018 55.5238 18.0963 179.6253 1149 K 4.0611 7.9718 116.2849 59.7443 32.2084 179.4868 1150 Q 4.1143 7.9482 117.6412 58.5578 28.7433 178.6424 1151 R 3.9728 8.0875 119.0766 58.6799 29.8832 178.3754 1152 Q 4.1028 7.7149 117.8756 58.2965 29.0314 177.5473 1153 L 3.9279 7.8045 119.5532 57.0880 41.5643 178.3109 1154 Y 4.5854 7.8274 121.1856 59.0369 38.4991 176.7805 1155 K 4.4516 8.0096 118.1523 56.7283 33.6117 177.3728 1156 N 4.7275 7.6221 119.1915 55.5070 38.1720 181.2473 1157 R 4.7632 7.8929 112.6958 55.9203 34.1979 175.8232 1158 G 4.1163 9.4870 105.7910 46.1646 0.0000 172.6376 1159 F 5.0641 7.2409 112.8959 55.4023 40.7576 172.6916 1160 L 4.8883 8.5012 120.0147 52.0272 44.5000 175.3387 1161 P 4.4365 0.0000 0.0000 63.6295 32.4577 175.7813 1162 L 3.4631 8.5946 117.8145 55.4691 38.8704 175.4909 1163 S 5.0007 7.5984 108.9702 57.1608 65.1817 174.4279 1164 H 4.9853 7.7965 118.3594 54.5774 29.8341 174.3477 1165 F 5.2806 9.7222 122.6463 55.5802 42.6714 173.9438 1166 L 4.6985 9.1253 126.1130 52.7265 43.5626 173.6454 1167 P 4.9269 0.0000 0.0000 63.0556 31.8975 175.7544 1168 M 4.6098 9.5350 126.1300 53.8238 33.8608 176.2642 1169 L 4.6433 8.5047 123.0721 53.5914 43.0888 175.3275 1170 P 4.6164 0.0000 0.0000 63.2075 31.8170 177.1384 1171 M 4.2575 8.4216 119.3656 56.6618 32.1134 176.7489 1172 V 4.4223 7.1442 117.7219 59.9564 34.7281 173.1247 1173 P 4.3016 0.0000 0.0000 64.0447 31.7970 175.9725 1174 E 4.8163 7.9634 113.9050 55.7957 33.1417 175.9567 1175 E 4.5439 8.6394 117.3313 57.3860 28.9615 175.8135 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 1040 D 8.36 4.62 0.00 2.70 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 1041 P 0.00 4.18 0.00 2.13 2.01 0.00 3.68 0.00 0.00 3.63 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 1042 I 8.80 4.25 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.76 0.91 0.00 0.00 1043 R 8.73 4.70 0.00 1.80 1.79 0.00 3.19 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 1044 L 8.58 5.02 0.00 1.50 1.58 0.91 0.85 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 0.00 1045 R 9.08 4.90 0.00 1.68 1.95 0.00 3.27 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.80 0.00 1046 H 9.29 5.38 0.00 3.14 3.38 0.00 5.62 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1047 L 8.79 4.84 0.00 1.58 1.67 0.47 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 1048 Y 9.05 4.63 0.00 2.56 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 1049 T 7.79 4.51 3.53 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 0.97 0.00 0.00 1050 S 7.15 4.65 0.00 3.82 3.46 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 0.00 1051 G 8.13 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 1052 P 0.00 4.26 0.00 2.14 2.13 0.00 3.74 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 *1053 H 8.14 4.15 0.00 2.95 3.03 0.00 7.16 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 1054 G 8.26 4.21 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 0.00 0.00 0.00 1055 L 7.86 4.13 0.00 1.68 1.61 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 1056 S 7.38 4.74 0.00 3.48 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 1057 S 8.18 4.58 0.00 4.02 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 1058 C 8.80 4.98 0.00 2.91 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 1059 F 9.06 5.28 0.00 3.28 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 1060 L 9.10 4.29 0.00 1.67 1.50 0.45 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 1061 R 9.20 4.93 0.00 1.97 2.09 0.00 3.13 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 1062 I 8.07 4.45 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.74 0.91 0.00 0.00 1063 R 8.86 4.20 0.00 2.07 1.89 0.00 3.19 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 1064 A 8.46 4.08 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 D 8.12 4.65 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 1066 G 8.19 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 1067 V 7.82 3.96 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 0.99 0.00 0.00 0.93 0.00 0.00 1068 V 8.25 4.75 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 0.90 0.00 0.00 0.93 0.00 0.00 1069 D 8.61 4.79 0.00 2.77 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 1070 C 8.78 5.13 0.00 2.91 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 1071 A 9.13 4.77 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 1072 R 8.92 4.02 0.00 1.84 1.86 0.00 3.27 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 1073 G 7.62 4.27 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 0.00 1074 Q 7.60 3.39 0.00 1.62 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.67 0.00 0.00 0.00 0.00 0.00 1.42 1.35 0.00 1075 S 8.78 4.42 0.00 3.64 3.82 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 0.00 0.00 0.00 1076 A 8.23 4.01 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 1077 H 7.54 4.47 0.00 3.19 3.27 0.00 5.61 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1078 S 7.59 4.80 0.00 4.13 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 1079 L 7.49 3.80 0.00 1.82 1.68 0.81 0.51 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 1080 L 9.08 5.16 0.00 1.50 1.46 0.82 0.54 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 1081 E 9.24 4.85 0.00 1.94 1.91 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 2.21 2.25 0.00 1082 I 9.13 4.91 1.91 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 1.24 0.80 0.99 0.00 0.00 1083 K 9.11 5.01 0.00 1.74 1.88 0.00 1.25 0.00 0.00 1.79 0.00 0.00 2.56 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.48 1.33 7.81 1084 A 8.73 4.62 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 1085 V 8.63 4.21 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 0.70 0.00 0.00 0.99 0.00 0.00 1086 A 7.80 4.63 1.24 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 1087 L 7.96 3.10 0.00 1.68 1.46 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 1088 R 8.99 4.64 0.00 1.49 1.88 0.00 3.23 0.00 0.00 3.34 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.21 0.00 1089 T 7.68 5.08 4.27 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 1.32 0.00 0.00 1090 V 9.36 5.18 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 0.85 0.00 0.00 1.27 0.00 0.00 1091 A 9.27 5.30 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 1092 I 8.60 4.97 1.91 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.03 0.81 0.00 0.00 1093 K 9.07 4.79 0.00 1.59 1.48 0.00 1.03 0.00 0.00 1.44 0.00 0.00 2.65 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.04 0.63 7.81 1094 G 9.18 3.87 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 0.00 0.00 0.00 1095 V 8.53 3.56 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 0.89 0.00 0.00 1096 H 8.35 4.30 0.00 3.23 3.36 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1097 S 8.08 4.26 0.00 4.12 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 1098 V 7.70 3.27 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 0.65 0.00 0.00 0.96 0.00 0.00 1099 R 7.41 4.77 0.00 1.71 1.77 0.00 3.34 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.72 0.00 1100 Y 9.08 4.73 0.00 3.06 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 1101 L 9.61 4.48 0.00 1.76 1.78 0.85 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 1102 C 9.62 5.61 0.00 2.88 2.93 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 1103 M 9.34 4.88 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.27 0.00 1104 G 8.83 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 0.00 0.00 0.00 0.00 1105 A 8.50 4.12 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 1106 D 9.66 4.48 0.00 2.83 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 1107 G 7.99 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 1108 K 7.96 4.04 0.00 1.88 1.74 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.42 7.81 1109 M 8.59 5.07 0.00 1.89 1.94 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 2.48 2.54 0.00 1110 Q 9.15 4.56 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 1111 G 9.35 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 0.00 0.00 0.00 0.00 1112 L 8.82 5.02 0.00 1.68 1.62 0.93 0.76 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 1113 L 8.83 4.26 0.00 1.69 1.79 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 1114 Q 7.92 4.70 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.96 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 1115 Y 8.30 3.90 0.00 1.43 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 0.00 0.00 0.00 0.00 1116 S 7.14 4.14 0.00 3.77 3.71 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 0.00 0.00 0.00 1117 E 8.95 3.57 0.00 2.02 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 2.29 2.21 0.00 1118 E 8.01 3.91 0.00 2.02 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 2.15 2.25 0.00 1119 D 7.44 4.84 0.00 2.58 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 1120 C 8.16 4.98 0.00 2.31 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 1121 A 7.04 4.83 1.12 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 0.00 0.00 1122 F 8.86 5.24 0.00 3.20 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 1123 E 9.43 4.73 0.00 1.94 1.94 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 2.56 2.45 0.00 1124 E 9.63 4.35 0.00 2.07 1.89 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 2.14 1.68 0.00 1125 E 8.80 4.67 0.00 2.01 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 2.16 2.20 0.00 1126 I 8.40 4.59 1.87 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 1.36 0.83 0.91 0.00 0.00 1127 R 9.00 4.54 0.00 1.98 1.83 0.00 3.32 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.40 0.00 1128 P 0.00 4.23 0.00 2.05 2.13 0.00 3.70 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 2.04 2.09 0.00 1129 D 8.07 4.52 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 1130 G 8.43 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 1131 Y 8.79 4.60 0.00 3.02 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 1132 N 9.40 5.35 0.00 2.73 2.20 0.00 0.00 6.80 7.99 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 1133 V 8.45 4.85 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 1.12 0.00 0.00 0.94 0.00 0.00 1134 Y 8.74 4.91 0.00 2.77 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 1135 R 9.05 5.04 0.00 1.85 1.91 0.00 3.16 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 1136 S 8.86 5.06 0.00 4.33 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 0.00 1137 E 9.19 3.90 0.00 1.97 1.96 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 2.30 2.37 0.00 1138 K 8.14 4.00 0.00 1.68 1.84 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.12 1.35 7.81 1139 H 8.05 4.52 0.00 3.28 3.33 0.00 5.86 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1140 R 7.86 3.98 0.00 2.00 2.06 0.00 3.33 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.75 0.00 1141 L 7.47 4.58 0.00 1.43 1.21 0.84 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 1142 P 0.00 5.09 0.00 2.13 2.08 0.00 3.24 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.98 0.00 1143 V 8.76 3.60 1.94 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 0.55 0.00 0.00 -0.11 0.00 0.00 1144 S 8.40 4.95 0.00 3.94 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 1145 L 8.44 4.81 0.00 1.64 1.70 1.07 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 1146 S 8.24 4.41 0.00 3.83 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 1147 S 8.62 4.52 0.00 4.06 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 1148 A 8.40 3.98 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 1149 K 7.97 4.06 0.00 1.80 1.86 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.52 7.81 1150 Q 7.95 4.11 0.00 2.30 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 1151 R 8.09 3.97 0.00 2.02 1.96 0.00 3.10 0.00 0.00 3.24 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 1152 Q 7.71 4.10 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.83 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 1153 L 7.80 3.93 0.00 1.30 0.98 0.79 0.41 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 1154 Y 7.83 4.59 0.00 3.02 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 1155 K 8.01 4.45 0.00 1.73 1.77 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.31 1.56 7.81 1156 N 7.62 4.73 0.00 2.78 2.72 0.00 0.00 6.73 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 1157 R 7.89 4.76 0.00 1.85 2.21 0.00 3.46 0.00 0.00 3.44 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 1158 G 9.49 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 0.00 0.00 0.00 0.00 1159 F 7.24 5.06 0.00 3.26 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 1160 L 8.50 4.89 0.00 1.68 1.59 0.71 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 1161 P 0.00 4.44 0.00 2.05 2.05 0.00 3.76 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.36 0.00 1162 L 8.59 3.46 0.00 1.80 1.59 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 1163 S 7.60 5.00 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 1164 H 7.80 4.99 0.00 2.71 3.10 0.00 5.66 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1165 F 9.72 5.28 0.00 3.26 3.08 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 1166 L 9.13 4.70 0.00 0.92 1.52 0.69 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 1167 P 0.00 4.93 0.00 2.06 2.11 0.00 3.77 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.34 0.00 1168 M 9.54 4.61 0.00 2.02 2.26 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.02 3.04 0.00 1169 L 8.50 4.64 0.00 1.53 1.61 0.94 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 1170 P 0.00 4.62 0.00 2.42 2.25 0.00 3.71 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 1171 M 8.42 4.26 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.43 0.00 1172 V 7.14 4.42 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 0.78 0.00 0.00 0.91 0.00 0.00 1173 P 0.00 4.30 0.00 2.07 1.99 0.00 3.76 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 1174 E 7.96 4.82 0.00 1.92 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 2.03 1.75 0.00 1175 E 8.64 4.54 0.00 1.99 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 0.00 2.07 2.19 0.00 * Residues marked with a * may have inaccurate shift predictions.