NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 999 E 4.1052 8.4449 118.7692 56.1855 30.6752 174.4155 1000 F 4.6489 8.6314 116.5103 56.0382 41.5132 173.5027 1001 M 4.5275 8.6798 122.5981 55.2756 35.2224 178.2840 1002 G 3.8420 8.4288 108.3878 46.3593 0.0000 175.3804 1003 E 4.1420 8.8692 125.7432 56.3034 29.6609 176.5277 1004 Q 4.3469 8.6716 123.9624 54.5873 29.6172 174.3766 1005 P 4.7802 0.0000 0.0000 63.0475 32.1851 176.1497 1006 I 4.2950 8.5111 119.7508 63.5867 38.1316 176.7932 1007 F 5.0577 8.1847 123.0415 56.9436 42.7832 173.4807 1008 S 5.2851 8.0233 120.5622 57.2689 66.9283 172.6707 1009 T 4.6618 9.1613 116.5821 61.0982 71.7079 172.0168 1010 R 5.1811 8.3402 121.7015 54.4670 32.2895 175.7271 1011 A 4.5663 8.4678 122.9427 51.0506 23.3725 175.0569 1012 H 4.4108 9.1114 118.2448 55.6119 30.2852 174.6939 1013 V 4.7372 8.3735 123.1325 61.4906 33.4473 174.6306 1014 F 5.6152 9.5509 125.7065 56.0658 43.5768 173.6476 1015 Q 5.2762 9.7689 117.6258 55.2058 32.6692 173.3894 1016 I 4.4603 8.4686 121.4161 59.6077 39.9977 174.1973 1017 D 5.0485 8.3670 127.2456 51.8673 42.0479 176.1231 1018 P 4.1420 0.0000 0.0000 65.2469 31.5269 176.7631 1019 N 4.7997 8.0263 114.3101 52.7547 38.7344 174.2605 1020 T 4.6977 7.2127 108.2877 59.5046 71.2326 174.6962 1021 K 4.0791 8.4704 121.8486 58.6772 32.4914 178.0332 1022 K 4.3192 7.7668 117.4292 56.5726 33.8234 178.4459 1023 N 4.7955 7.9570 119.1486 52.4395 36.9416 179.2844 1024 W 4.5683 8.9276 127.2222 58.0049 29.5070 175.2677 1025 V 4.8723 8.9744 116.1136 58.5548 35.2337 173.3215 1026 P 4.2339 0.0000 0.0000 63.6670 31.1879 175.9945 1027 T 4.4256 8.7263 121.4110 64.6142 69.7027 175.4821 1028 S 4.6975 7.6894 116.5105 56.6442 65.2596 174.9418 1029 K 4.0227 8.7918 127.3100 57.6483 31.7910 175.4563 *1030 H 5.1167 7.5805 114.7818 52.3237 31.9795 176.0865 1031 A 3.9980 8.2443 118.3295 53.6677 18.8774 177.3161 1032 V 4.4923 8.5075 114.0401 59.4289 36.4368 174.8362 1033 T 4.7263 8.2893 118.1610 63.3717 69.9660 174.1410 1034 V 4.6468 9.1497 126.0717 61.2630 34.4395 174.4700 1035 S 5.3007 9.0259 122.8509 57.0370 67.5652 172.4093 1036 Y 4.7584 9.0701 121.0588 56.8312 39.4946 174.5088 1037 F 5.0743 9.3494 126.3260 56.5187 42.8830 172.7258 1038 Y 4.4866 7.7621 127.0903 56.2641 40.0920 173.9504 1039 D 4.5075 8.2562 129.0884 53.0122 41.0657 177.0599 1040 S 3.5224 8.0971 122.2462 60.9896 63.5486 176.0662 1041 T 3.9358 7.8120 110.3614 64.2058 68.6239 175.3220 1042 R 4.0720 7.7984 118.4747 55.5398 30.8998 175.4535 1043 N 4.1206 7.4045 115.2688 53.3481 37.9204 173.3723 1044 V 4.6621 6.7587 108.3814 59.9660 37.2249 175.1013 1045 Y 5.1195 8.6428 119.6669 56.8253 40.1439 174.9719 1046 R 5.1754 9.4288 122.4213 54.4020 34.4989 174.7456 1047 I 4.4231 9.0360 124.4929 60.7583 38.4473 174.8151 1048 I 4.9059 8.8433 129.0117 59.4054 40.0699 174.8010 1049 S 5.0428 8.8589 121.0232 55.2817 65.5319 172.2855 1050 L 5.0935 8.7098 126.5840 53.0205 43.9853 175.6450 1051 D 4.6648 8.9817 123.8057 53.0404 42.3265 176.7249 1052 G 3.9155 8.0838 119.5589 47.0368 0.0000 174.2897 1053 S 4.5467 8.8651 119.6192 57.5921 63.8138 173.6598 1054 K 4.5265 7.4132 119.8044 54.7146 34.4883 175.2812 1055 A 4.5594 8.4706 124.7368 52.2183 18.8398 177.2383 1056 I 4.4163 8.7243 116.7115 60.8802 39.7629 175.9450 1057 I 4.2450 7.5937 123.7916 59.4721 40.4005 174.2941 1058 N 5.4991 8.6931 125.0056 51.4873 39.4771 170.9206 1059 S 5.0722 9.0073 116.5470 55.2862 65.2412 172.5417 1060 T 4.7192 8.7050 124.7899 62.9539 68.9560 174.8020 1061 I 4.0109 8.8880 129.5690 61.5248 37.6707 175.9873 1062 T 4.7752 8.4679 116.0633 58.8703 71.5302 173.3056 1063 P 4.2930 0.0000 0.0000 65.2957 31.4152 177.2416 1064 N 4.7706 8.0340 112.6239 52.9627 38.0697 175.2352 1065 M 4.4456 7.7877 119.0938 56.2229 32.6196 175.6219 1066 T 4.7718 8.6433 117.6112 61.8448 72.2479 172.4034 1067 F 4.7541 8.6597 128.9447 56.9901 40.7130 174.6677 1068 T 4.6026 8.2036 123.4167 61.5224 71.1569 173.6148 1069 K 4.7839 8.7021 126.3639 56.3166 32.3744 176.9305 1070 T 4.5829 8.4396 113.3467 61.1123 70.4879 173.1866 1071 S 4.4659 7.6255 115.3044 57.2566 65.3176 173.6552 1072 Q 4.0966 8.6950 121.6875 57.6192 28.8561 175.7361 1073 K 4.1021 9.1451 122.4542 57.0286 30.1725 173.9434 1074 F 5.8691 7.8374 120.8084 55.4728 42.6334 173.9830 1075 G 4.3658 7.7578 111.1248 44.8567 0.0000 170.7901 1076 Q 5.3136 7.7996 117.0035 54.4807 32.4955 173.6008 1077 W 5.8506 9.3268 116.5612 54.0870 32.0286 173.6985 1078 A 4.4970 8.8809 123.9999 51.3842 19.6662 176.4596 1079 D 4.9160 8.8829 122.1745 52.5440 42.5322 176.7765 1080 S 4.2756 8.9411 123.1837 61.5115 63.3648 176.4046 1081 R 4.0076 8.2898 119.2083 59.2927 29.9273 177.1417 1082 A 4.2084 8.6956 118.3420 52.4620 19.1068 176.4886 1083 N 4.2115 7.7237 112.3714 53.7869 36.8502 174.2766 1084 T 4.5895 7.1233 111.6758 62.1761 73.8882 174.1764 1085 V 4.2469 8.1008 125.0181 61.5503 33.5624 174.0977 1086 Y 5.0881 8.0738 125.5773 56.2937 40.3816 174.9549 1087 G 4.2238 9.5949 109.8728 44.2800 0.0000 171.3422 1088 L 5.1653 8.4282 123.3476 52.5159 45.1206 175.6391 1089 G 4.3668 9.3166 112.1243 45.0748 0.0000 173.3581 1090 F 5.2177 9.6128 125.8582 56.0838 40.5717 176.5438 1091 S 4.4909 9.0280 114.2220 60.3799 63.8620 174.5886 1092 S 4.7357 7.8514 114.8612 55.8928 66.9238 174.3068 1093 E 3.9754 8.8201 122.5743 59.5813 29.3032 178.1979 1094 H 4.0654 8.2785 117.8865 59.8212 29.9003 176.8178 1095 H 4.2902 7.9433 117.7781 58.4518 28.5189 177.3995 1096 L 2.4933 7.4809 121.7519 58.0926 41.8461 179.4283 1097 S 4.1291 8.0543 114.9113 61.2209 62.6405 176.6321 1098 K 3.7825 8.0390 122.4723 59.3702 31.9259 178.5567 1099 F 3.9530 8.2078 120.6802 61.2605 39.1415 176.9008 1100 A 3.5955 7.8983 120.2682 55.0265 18.1740 179.4281 1101 E 3.8003 8.2069 117.1395 59.5195 29.5450 179.6967 1102 K 3.4426 7.7320 118.5184 59.0787 31.8448 178.8997 1103 F 3.6069 7.8102 120.9043 61.5094 39.2087 177.2985 1104 Q 3.9991 7.8626 117.4221 58.7722 28.4592 178.2895 1105 E 3.5763 7.7904 120.3159 59.3706 29.5532 179.0390 1106 F 3.5009 8.0429 117.8232 59.6836 38.8074 177.9476 1107 K 3.8389 8.0444 118.8541 59.4879 31.8763 179.1299 1108 E 3.8538 7.9647 118.4855 59.2969 29.3594 179.2424 1109 A 3.8126 7.5968 120.5561 55.0208 18.3089 179.5472 1110 A 4.2195 8.2552 119.7187 55.1781 18.4852 179.8096 1111 R 3.9072 8.1102 119.7347 60.2843 30.1805 179.4580 1112 L 4.0121 8.0497 121.8539 59.2552 40.8394 180.6960 1113 A 4.2563 8.5492 122.1481 55.2008 18.1380 179.9445 1114 K 4.0169 8.1588 118.0498 60.1748 32.1832 179.6640 1115 E 4.1598 7.8975 117.4552 61.3038 29.7349 181.1729 1116 K 4.5059 8.0737 118.1858 58.0587 33.1995 179.1982 1117 S 4.5626 7.8465 118.4858 57.5104 60.1479 172.3507 *1120 K 4.0575 7.6576 123.2388 54.4328 32.9462 175.3895 1121 M 4.5725 8.4445 123.8184 52.5548 34.0340 175.4699 1122 E 4.3930 8.4613 122.8184 54.6350 30.1175 175.8111 1123 L 4.3875 8.2290 126.4379 54.8582 42.7598 176.2268 1124 T 4.6177 7.8062 113.6684 60.6650 70.2258 173.6728 1125 S 4.3806 8.3602 122.2463 58.2864 63.5919 174.4478 1126 T 3.9360 8.2198 119.0538 62.8488 68.6681 172.7970 1127 P 4.1602 0.0000 0.0000 63.3022 31.9470 177.4633 1128 S 4.3246 8.5544 121.1159 59.1255 60.3465 174.4608 *1134 G 3.8735 7.8044 106.4441 44.9104 0.0000 170.6814 1135 D 4.5536 7.9016 118.7095 53.5294 41.6125 175.5213 1136 L 4.4133 8.2059 123.3702 54.4976 42.9796 176.5011 1137 Q 4.5116 8.5345 122.5618 55.8338 29.9834 175.8728 1138 S 4.6224 7.6751 113.9226 56.4168 64.2917 172.2156 1139 P 4.4350 0.0000 0.0000 62.8160 31.5865 177.1281 1140 L 4.1930 8.3620 120.7242 57.0951 42.0445 177.1953 1141 T 4.7396 7.4009 110.9470 59.2495 70.5954 171.6697 1142 P 4.3446 0.0000 0.0000 66.1287 31.8147 176.8765 1143 E 4.5908 7.8656 118.2969 56.4472 30.4762 177.8885 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 999 E 8.44 4.11 0.00 2.14 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 2.15 2.32 0.00 1000 F 8.63 4.65 0.00 3.13 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 1001 M 8.68 4.53 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.54 0.00 1002 G 8.43 3.84 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 1003 E 8.87 4.14 0.00 2.26 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 0.00 2.40 2.43 0.00 1004 Q 8.67 4.35 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.04 0.00 0.00 0.00 0.00 0.00 2.45 2.37 0.00 1005 P 0.00 4.78 0.00 2.26 2.07 0.00 3.88 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 2.08 1.53 0.00 1006 I 8.51 4.29 2.29 0.00 0.00 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 1.25 0.72 1.11 0.00 0.00 1007 F 8.18 5.06 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 1008 S 8.02 5.29 0.00 3.73 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 1009 T 9.16 4.66 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 1.64 0.00 0.00 1010 R 8.34 5.18 0.00 1.69 1.78 0.00 3.43 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.52 0.00 1011 A 8.47 4.57 0.62 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 0.00 0.00 1012 H 9.11 4.41 0.00 3.21 3.02 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1013 V 8.37 4.74 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 1.01 0.00 0.00 0.87 0.00 0.00 1014 F 9.55 5.62 0.00 3.04 3.16 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 0.00 0.00 0.00 1015 Q 9.77 5.28 0.00 1.98 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 1016 I 8.47 4.46 1.30 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 -0.36 0.57 0.00 0.00 1017 D 8.37 5.05 0.00 2.52 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 1018 P 0.00 4.14 0.00 2.11 2.10 0.00 3.63 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.00 0.00 1019 N 8.03 4.80 0.00 2.69 2.84 0.00 0.00 6.70 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 1020 T 7.21 4.70 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 1.19 0.00 0.00 1021 K 8.47 4.08 0.00 1.75 1.89 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.38 7.81 1022 K 7.77 4.32 0.00 1.73 1.74 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.45 7.81 1023 N 7.96 4.80 0.00 2.67 1.64 0.00 0.00 6.97 7.68 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 1024 W 8.93 4.57 0.00 3.19 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 1025 V 8.97 4.87 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 0.82 0.00 0.00 1.10 0.00 0.00 1026 P 0.00 4.23 0.00 1.97 1.94 0.00 3.86 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 1027 T 8.73 4.43 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 1.31 0.00 0.00 1028 S 7.69 4.70 0.00 3.93 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.79 4.02 0.00 1.80 1.76 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.00 7.81 *1030 H 7.58 5.12 0.00 2.64 2.84 0.00 7.18 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 1031 A 8.24 4.00 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 1032 V 8.51 4.49 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 0.75 0.00 0.00 0.85 0.00 0.00 1033 T 8.29 4.73 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 1.45 0.00 0.00 1034 V 9.15 4.65 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 1.02 0.00 0.00 0.85 0.00 0.00 1035 S 9.03 5.30 0.00 3.63 3.65 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 1036 Y 9.07 4.76 0.00 2.44 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 1037 F 9.35 5.07 0.00 2.96 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 1038 Y 7.76 4.49 0.00 2.97 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 1039 D 8.26 4.51 0.00 2.77 2.45 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 0.00 1040 S 8.10 3.52 0.00 3.99 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 1041 T 7.81 3.94 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 1.18 0.00 0.00 1042 R 7.80 4.07 0.00 1.70 1.97 0.00 3.44 0.00 0.00 3.13 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 1043 N 7.40 4.12 0.00 2.84 2.82 0.00 0.00 6.91 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 1044 V 6.76 4.66 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 0.78 0.00 0.00 0.88 0.00 0.00 1045 Y 8.64 5.12 0.00 3.00 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 1046 R 9.43 5.18 0.00 1.78 1.81 0.00 3.16 0.00 0.00 3.37 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 1047 I 9.04 4.42 1.93 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.36 0.90 0.00 0.00 1048 I 8.84 4.91 1.70 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 1.07 0.76 0.75 0.00 0.00 1049 S 8.86 5.04 0.00 3.84 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 1050 L 8.71 5.09 0.00 1.60 1.71 1.02 0.99 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 1051 D 8.98 4.66 0.00 2.62 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 1052 G 8.08 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 1053 S 8.87 4.55 0.00 3.97 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 1054 K 7.41 4.53 0.00 1.98 1.93 0.00 1.31 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.34 7.81 1055 A 8.47 4.56 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 1056 I 8.72 4.42 1.89 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 1.31 0.71 0.91 0.00 0.00 1057 I 7.59 4.24 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 0.77 0.81 0.79 0.00 0.00 1058 N 8.69 5.50 0.00 2.66 2.68 0.00 0.00 6.93 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 1059 S 9.01 5.07 0.00 4.13 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 1060 T 8.71 4.72 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 1.28 0.00 0.00 1061 I 8.89 4.01 1.92 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 0.96 0.49 0.71 0.00 0.00 1062 T 8.47 4.78 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 1.35 0.00 0.00 1063 P 0.00 4.29 0.00 2.10 2.18 0.00 3.72 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.19 0.00 1064 N 8.03 4.77 0.00 3.15 2.98 0.00 0.00 6.04 7.66 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 1065 M 7.79 4.45 0.00 2.58 2.48 0.00 0.00 0.00 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.88 0.00 1066 T 8.64 4.77 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 1.27 0.00 0.00 1067 F 8.66 4.75 0.00 1.51 2.40 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.20 4.60 4.16 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 0.00 0.00 1.21 0.00 0.00 1069 K 8.70 4.78 0.00 1.69 1.81 0.00 1.76 0.00 0.00 1.85 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.64 1.62 7.81 1070 T 8.44 4.58 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 1.33 0.00 0.00 1071 S 7.63 4.47 0.00 3.93 3.96 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 1072 Q 8.69 4.10 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.76 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 1073 K 9.15 4.10 0.00 2.15 2.23 0.00 1.99 0.00 0.00 1.84 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.49 7.81 1074 F 7.84 5.87 0.00 3.02 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 1075 G 7.76 4.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1076 Q 7.80 5.31 0.00 2.46 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.69 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 1077 W 9.33 5.85 0.00 3.63 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 1078 A 8.88 4.50 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 1079 D 8.88 4.92 0.00 3.04 2.85 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 0.00 0.00 0.00 0.00 1080 S 8.94 4.28 0.00 3.97 3.96 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 1081 R 8.29 4.01 0.00 1.85 2.23 0.00 3.29 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 1082 A 8.70 4.21 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.72 4.21 0.00 2.87 2.83 0.00 0.00 6.74 7.00 0.00 0.00 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 T 7.12 4.59 3.61 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 0.62 0.00 0.00 1085 V 8.10 4.25 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 0.95 0.00 0.00 0.71 0.00 0.00 1086 Y 8.07 5.09 0.00 1.43 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 0.00 0.00 0.00 0.00 1087 G 9.59 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 1088 L 8.43 5.17 0.00 1.27 0.64 0.40 0.58 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 1089 G 9.32 4.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1090 F 9.61 5.22 0.00 3.08 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 1091 S 9.03 4.49 0.00 4.08 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 1092 S 7.85 4.74 0.00 4.07 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 1093 E 8.82 3.98 0.00 2.06 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 0.00 2.41 2.35 0.00 1094 H 8.28 4.07 0.00 3.20 3.22 0.00 5.72 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1095 H 7.94 4.29 0.00 3.47 3.49 0.00 5.69 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1096 L 7.48 2.49 0.00 1.67 1.76 1.14 0.87 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 1097 S 8.05 4.13 0.00 3.85 3.86 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 1098 K 8.04 3.78 0.00 1.85 2.00 0.00 1.43 0.00 0.00 1.58 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.70 1.46 7.81 1099 F 8.21 3.95 0.00 3.28 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 1100 A 7.90 3.60 1.51 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 0.00 0.00 1101 E 8.21 3.80 0.00 2.01 1.85 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 0.00 2.26 2.52 0.00 1102 K 7.73 3.44 0.00 1.21 0.90 0.00 1.20 0.00 0.00 1.21 0.00 0.00 2.51 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.82 0.21 7.81 1103 F 7.81 3.61 0.00 2.74 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 1104 Q 7.86 4.00 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.57 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 1105 E 7.79 3.58 0.00 1.67 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.95 0.00 1106 F 8.04 3.50 0.00 2.48 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 1107 K 8.04 3.84 0.00 1.94 1.84 0.00 2.21 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.63 1.46 7.81 1108 E 7.96 3.85 0.00 2.06 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 2.33 2.20 0.00 1109 A 7.60 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 1110 A 8.26 4.22 1.46 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 0.00 0.00 1111 R 8.11 3.91 0.00 2.01 2.10 0.00 3.10 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 1112 L 8.05 4.01 0.00 1.71 1.66 0.92 0.57 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 1113 A 8.55 4.26 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 1114 K 8.16 4.02 0.00 2.20 1.92 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.48 1.33 7.81 1115 E 7.90 4.16 0.00 2.10 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 2.26 2.23 0.00 1116 K 8.07 4.51 0.00 1.88 1.91 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.67 7.81 1117 S 7.85 4.56 0.00 4.03 3.85 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 0.00 0.00 0.00 0.00 *1120 K 7.66 4.06 0.00 1.80 1.67 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.04 7.81 1121 M 8.44 4.57 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.44 0.00 1122 E 8.46 4.39 0.00 2.18 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 2.22 1.88 0.00 1123 L 8.23 4.39 0.00 1.68 1.58 0.92 0.85 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 1124 T 7.81 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 1.21 0.00 0.00 1125 S 8.36 4.38 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 1126 T 8.22 3.94 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 1.21 0.00 0.00 1127 P 0.00 4.16 0.00 2.03 2.04 0.00 3.69 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 1128 S 8.55 4.32 0.00 3.86 3.85 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 0.00 0.00 0.00 0.00 *1134 G 7.80 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 1135 D 7.90 4.55 0.00 2.68 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 1136 L 8.21 4.41 0.00 1.60 1.55 0.92 0.75 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 1137 Q 8.53 4.51 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 1138 S 7.68 4.62 0.00 3.85 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 1139 P 0.00 4.44 0.00 2.04 1.99 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 1140 L 8.36 4.19 0.00 1.64 1.73 0.92 0.76 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 1141 T 7.40 4.74 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 1.26 0.00 0.00 1142 P 0.00 4.34 0.00 2.22 2.16 0.00 3.87 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 1.99 1.96 0.00 1143 E 7.87 4.59 0.00 1.95 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 2.00 1.72 0.00 * Residues marked with a * may have inaccurate shift predictions.