NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1010 C 4.5616 8.3293 115.6541 57.4648 31.0461 173.5293 1011 P 4.4433 0.0000 0.0000 63.6114 32.5668 173.8839 1012 L 5.1305 7.8264 122.3742 53.7982 45.0519 175.9701 1013 M 4.9501 9.1853 125.9033 53.6422 36.1062 173.9930 1014 V 4.8359 8.2530 123.4854 60.8942 34.8727 174.0081 1015 K 5.0058 9.1115 128.7178 54.5634 35.4475 174.7535 1016 V 4.8165 8.8057 126.3858 61.1038 34.8119 174.0750 1017 L 5.0160 8.9155 126.8857 52.8936 46.0414 174.9125 1018 D 5.1400 9.1208 122.0210 52.8273 42.3699 176.5279 1019 A 4.3678 9.2652 128.3349 53.4010 18.6210 178.4311 1020 V 3.9097 8.5119 114.8045 65.0098 32.0835 177.0529 1021 R 4.2398 8.7931 117.1601 55.8380 31.0253 176.1181 1022 G 3.8533 8.3654 105.2112 45.6863 0.0000 172.5116 1023 S 4.8238 7.3552 111.7043 55.8070 67.1265 173.0318 1024 P 4.5666 0.0000 0.0000 63.1421 31.5880 175.8180 1025 A 4.3890 8.6453 124.0346 51.0312 19.6512 176.3100 1026 I 4.3029 8.3848 122.5180 61.0522 39.2992 175.5710 1027 N 4.1564 8.4140 120.6716 54.3879 36.6629 174.3877 1028 V 4.0957 7.7153 118.3806 61.8618 32.9456 174.9906 1029 A 4.6761 8.5619 129.9199 51.9331 20.0603 176.1326 1030 V 4.7828 8.8163 121.0609 61.4657 35.2656 173.8134 1031 H 5.0765 9.2991 124.6419 53.8592 32.0080 172.8409 1032 V 4.9011 8.7913 122.7248 61.1850 34.1761 174.3691 1033 F 5.5257 9.4559 125.1645 55.7302 43.4672 173.7190 1034 R 4.8311 9.2349 121.1112 54.0544 33.1096 174.5213 1035 K 3.9765 8.6784 128.3331 56.2648 32.6652 176.7210 1036 A 4.2671 8.9592 130.8301 50.8233 19.5972 177.7366 1037 A 4.0924 8.4769 122.3899 55.0717 18.2856 178.4545 1038 D 4.4938 7.8875 112.3977 53.4788 39.9782 176.7969 1039 D 4.4850 8.5335 119.6989 54.4450 39.2060 174.1680 1040 T 4.3204 7.1640 109.5609 60.0700 71.6114 173.9749 1041 W 4.9543 8.4563 122.8383 56.1131 29.6845 175.3994 1042 E 4.6929 9.3177 127.5535 54.0948 30.8352 173.7044 1043 P 4.4601 0.0000 0.0000 63.5845 31.5048 175.3073 1044 F 4.7676 8.6832 124.4504 59.5094 41.8405 174.5498 1045 A 4.4968 7.7174 117.0117 51.5997 22.2745 174.9091 1046 S 4.6628 7.8265 112.8233 57.6620 66.3005 173.5284 1047 G 3.9869 7.8517 105.0346 46.3889 0.0000 172.1510 1048 K 5.3227 8.5321 117.8855 54.4231 36.1517 176.9477 1049 T 4.3118 8.5650 113.8222 61.8529 70.3603 174.8627 1050 S 4.6890 8.7181 120.9034 57.7613 65.0155 175.2456 1051 E 3.9812 8.6630 115.4888 58.5385 29.3455 173.7445 1052 S 4.4387 7.8575 109.4421 58.5844 63.6682 175.2305 1053 G 3.8685 8.4988 110.4814 45.0848 0.0000 172.6051 1054 E 5.0092 7.4956 118.7252 54.2968 32.8038 174.9298 1055 L 4.8640 8.7776 124.5539 53.8745 44.6752 175.1100 1056 H 4.9947 8.9026 122.7342 54.6251 32.3647 174.6390 1057 G 3.8939 8.7282 106.0412 46.1904 0.0000 175.7137 1058 L 3.7921 7.8237 121.2648 57.5619 41.7040 176.4771 1059 T 4.4487 6.9884 108.3692 61.3175 70.7070 171.6513 1060 T 4.7763 8.0363 111.2670 59.1328 71.7812 174.3599 1061 E 4.0973 8.9040 122.6690 59.4253 29.9241 177.8220 1062 E 4.1661 8.3390 118.3998 59.2928 29.8541 177.6247 1063 E 4.2711 8.0231 116.4032 58.7300 30.0654 177.5298 1064 F 5.0759 8.0748 122.7380 57.1789 37.6209 174.7021 1065 V 4.0574 7.5991 117.8135 59.5366 33.4144 175.5067 1066 E 4.4770 8.0950 121.4544 55.8028 30.1511 176.4456 1067 G 3.7839 7.9484 111.2389 46.6688 0.0000 170.4071 1068 I 4.7617 7.1961 120.1262 59.9858 38.9895 174.9960 1069 Y 5.1293 8.6375 124.6871 55.8939 41.5088 174.5539 1070 K 4.8768 9.1510 123.5186 54.5884 35.3189 174.7922 1071 V 4.7105 9.0512 128.2263 61.4051 33.4398 173.7353 1072 E 4.8975 9.4108 130.5626 54.6370 31.6442 174.3526 1073 I 4.4565 8.8549 128.5406 59.6914 39.0208 175.9435 1074 D 5.0213 8.7950 130.2657 53.5350 37.5496 177.2547 1075 T 3.9462 7.7130 113.9703 64.2030 69.4789 176.7375 1076 K 4.1065 7.7650 121.7775 59.6667 32.1412 178.9260 1077 S 4.1530 8.1074 114.8868 61.5925 62.4349 175.5977 1078 Y 4.0550 7.6339 121.1240 60.8581 38.4778 178.6273 1079 W 4.2671 8.2034 119.5105 59.6452 29.1799 178.7916 1080 K 4.4075 8.7018 119.7571 58.9092 31.2866 179.1400 1081 A 4.0983 7.6279 119.8487 54.1193 18.3405 178.5378 1082 L 4.3889 7.0840 115.5889 54.4384 42.0329 177.4097 1083 G 3.9473 8.1114 107.3761 45.3951 0.0000 173.1567 1084 I 4.3733 7.8635 120.4123 59.2433 39.1512 175.2200 1085 S 4.7277 8.5488 121.7181 56.5333 62.3518 172.2779 1086 P 4.3528 0.0000 0.0000 61.2328 32.8222 176.4891 1087 F 3.9238 8.1111 120.7742 61.1903 39.2828 175.5639 1088 H 4.5387 7.8181 115.6482 54.8552 30.0631 175.4068 1089 E 4.0202 8.6270 122.3074 59.6246 29.5560 176.1550 1090 H 4.8789 7.6381 110.3633 55.8675 31.5819 172.5896 1091 A 4.3854 8.7106 122.6970 50.5361 21.0560 176.0275 1092 E 5.0213 8.8417 120.0402 54.5405 33.2816 172.5713 1093 V 4.4436 8.9398 124.7388 60.2736 34.2049 174.2385 1094 V 5.1734 8.6241 128.0907 61.1091 33.5911 174.4574 1095 F 5.1548 8.8136 121.5537 55.8392 41.6349 173.4965 1096 T 4.7015 8.7196 117.2608 63.4107 69.3798 173.9264 1097 A 4.6575 8.7156 127.2233 50.6302 22.4590 175.9038 1098 N 5.1782 9.5186 116.3443 53.8630 36.6077 175.2989 1099 D 4.6685 8.2482 116.3185 54.4437 40.0621 176.4485 1100 S 4.6141 8.1369 116.3044 58.2889 64.0512 174.3879 1101 G 3.9893 8.2559 105.4566 43.8335 0.0000 171.7359 1102 P 4.7754 0.0000 0.0000 62.9804 31.6135 175.7861 1103 R 4.7982 8.8096 119.8604 54.5397 34.5970 174.4557 1104 R 4.8915 8.5874 119.4771 54.8862 32.5788 175.0968 1105 Y 5.0215 9.2514 121.5592 56.4551 41.2662 174.6099 1106 T 4.9340 8.9408 121.2678 61.8851 71.2840 173.2745 1107 I 4.7674 8.7370 127.8838 59.5887 39.3538 174.5316 1108 A 5.3204 8.8311 128.8660 49.9971 22.0822 174.8275 1109 A 5.1593 8.9574 122.3509 50.0496 22.9175 174.6362 1110 L 4.9703 9.1699 124.9901 53.3607 44.3535 174.9242 1111 L 5.4196 8.9512 126.6889 53.3653 44.2115 175.8782 1112 S 5.2189 9.3521 118.4171 56.0382 67.2550 173.3402 1113 P 3.1973 0.0000 0.0000 65.3134 31.0482 177.8804 1114 Y 4.7931 7.7913 111.8616 57.2330 38.5863 174.9519 1115 S 4.7639 8.0279 113.8604 57.5590 65.6881 172.6264 1116 Y 5.5054 7.7760 121.9779 55.8041 41.1805 174.0811 1117 S 4.8820 9.1344 116.0160 57.1170 66.6638 173.1398 1118 T 5.2133 8.5289 116.9381 60.8358 70.6464 172.3678 1119 T 4.8742 8.8439 120.4888 60.5079 71.7700 171.9728 1120 A 5.2067 8.4730 125.0904 49.9907 22.2636 175.4534 1121 V 4.3064 8.6179 121.2659 60.9663 34.1843 174.4684 1122 V 4.6705 8.4185 127.5218 61.2382 33.6188 174.4081 1123 T 4.6833 8.6248 117.4078 59.7426 72.6054 172.2456 1124 N 4.9181 8.5924 122.9973 51.8582 40.9267 173.1378 *1125 P 4.2222 0.0000 0.0000 62.3448 31.6093 172.5985 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 1010 C 8.33 4.56 0.00 3.08 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 1011 P 0.00 4.44 0.00 2.62 2.54 0.00 3.64 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 1012 L 7.83 5.13 0.00 0.97 1.16 0.93 0.50 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 1013 M 9.19 4.95 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.50 0.00 1014 V 8.25 4.84 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 0.91 0.00 0.00 0.89 0.00 0.00 1015 K 9.11 5.01 0.00 1.80 1.54 0.00 1.47 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.28 1.34 7.81 1016 V 8.81 4.82 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 0.67 0.00 0.00 0.80 0.00 0.00 1017 L 8.92 5.02 0.00 1.58 1.50 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 1018 D 9.12 5.14 0.00 2.65 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 1019 A 9.27 4.37 1.42 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 0.00 0.00 1020 V 8.51 3.91 2.58 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 0.96 0.00 0.00 1.01 0.00 0.00 1021 R 8.79 4.24 0.00 1.92 2.03 0.00 3.63 0.00 0.00 3.30 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 1022 G 8.37 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 0.00 0.00 0.00 1023 S 7.36 4.82 0.00 3.88 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 1024 P 0.00 4.57 0.00 2.11 2.19 0.00 3.76 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 2.03 1.98 0.00 1025 A 8.65 4.39 0.66 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 0.00 0.00 1026 I 8.38 4.30 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.80 0.93 0.00 0.00 1027 N 8.41 4.16 0.00 2.93 2.93 0.00 0.00 6.88 7.84 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 1028 V 7.72 4.10 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 0.75 0.00 0.00 0.52 0.00 0.00 1029 A 8.56 4.68 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 1030 V 8.82 4.78 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 0.97 0.00 0.00 0.92 0.00 0.00 1031 H 9.30 5.08 0.00 3.10 2.78 0.00 5.62 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 1032 V 8.79 4.90 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 1.24 0.00 0.00 0.93 0.00 0.00 1033 F 9.46 5.53 0.00 2.88 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 1034 R 9.23 4.83 0.00 1.36 1.70 0.00 2.80 0.00 0.00 3.04 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.50 0.00 1035 K 8.68 3.98 0.00 0.84 1.28 0.00 0.90 0.00 0.00 0.61 0.00 0.00 2.51 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.98 0.97 7.81 1036 A 8.96 4.27 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 1037 A 8.48 4.09 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 1038 D 7.89 4.49 0.00 3.00 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 1039 D 8.53 4.48 0.00 2.93 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 1040 T 7.16 4.32 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 1.16 0.00 0.00 1041 W 8.46 4.95 0.00 3.04 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 1042 E 9.32 4.69 0.00 2.12 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 0.00 2.37 2.38 0.00 1043 P 0.00 4.46 0.00 2.02 1.98 0.00 3.81 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.35 0.00 1044 F 8.68 4.77 0.00 3.07 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 1045 A 7.72 4.50 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 1046 S 7.83 4.66 0.00 3.62 3.56 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.85 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 0.00 0.00 0.00 1048 K 8.53 5.32 0.00 1.55 1.63 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.42 7.81 1049 T 8.56 4.31 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 1.15 0.00 0.00 1050 S 8.72 4.69 0.00 4.02 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 1051 E 8.66 3.98 0.00 2.01 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 1.87 0.00 1052 S 7.86 4.44 0.00 3.99 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 1053 G 8.50 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 1054 E 7.50 5.01 0.00 2.02 1.72 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 2.20 2.38 0.00 1055 L 8.78 4.86 0.00 1.62 1.53 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 1056 H 8.90 4.99 0.00 3.02 3.15 0.00 5.81 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 1057 G 8.73 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 1058 L 7.82 3.79 0.00 1.56 1.69 0.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 1059 T 6.99 4.45 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 0.93 0.00 0.00 1060 T 8.04 4.78 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 1.21 0.00 0.00 1061 E 8.90 4.10 0.00 2.03 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 0.00 2.38 2.41 0.00 1062 E 8.34 4.17 0.00 2.01 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 2.34 2.37 0.00 1063 E 8.02 4.27 0.00 2.11 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 0.00 2.37 2.28 0.00 1064 F 8.07 5.08 0.00 3.11 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 1065 V 7.60 4.06 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 0.86 0.00 0.00 1.04 0.00 0.00 1066 E 8.10 4.48 0.00 1.95 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 2.44 2.10 0.00 1067 G 7.95 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 0.00 0.00 0.00 1068 I 7.20 4.76 1.68 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 1.31 0.65 1.08 0.00 0.00 1069 Y 8.64 5.13 0.00 1.93 2.52 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 1070 K 9.15 4.88 0.00 0.79 0.74 0.00 1.17 0.00 0.00 0.84 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.05 1.08 7.81 1071 V 9.05 4.71 2.20 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 0.98 0.00 0.00 1.12 0.00 0.00 1072 E 9.41 4.90 0.00 1.99 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 2.23 1.93 0.00 1073 I 8.85 4.46 1.73 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 1.16 0.44 0.77 0.00 0.00 1074 D 8.80 5.02 0.00 2.78 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 1075 T 7.71 3.95 4.42 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 1.13 0.00 0.00 1076 K 7.76 4.11 0.00 2.29 1.91 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.53 7.81 1077 S 8.11 4.15 0.00 3.94 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 1078 Y 7.63 4.05 0.00 2.89 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 1079 W 8.20 4.27 0.00 3.48 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 1080 K 8.70 4.41 0.00 1.85 1.89 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.54 7.81 1081 A 7.63 4.10 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 1082 L 7.08 4.39 0.00 1.62 1.80 0.77 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 1083 G 8.11 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 0.00 0.00 0.00 1084 I 7.86 4.37 2.18 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 1.29 1.09 0.72 0.00 0.00 1085 S 8.55 4.73 0.00 3.88 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 1086 P 0.00 4.35 0.00 2.16 1.82 0.00 3.78 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 2.02 2.22 0.00 1087 F 8.11 3.92 0.00 1.90 2.69 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 1088 H 7.82 4.54 0.00 3.30 3.46 0.00 5.95 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1089 E 8.63 4.02 0.00 1.70 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 2.24 2.11 0.00 1090 H 7.64 4.88 0.00 3.14 3.23 0.00 5.28 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 1091 A 8.71 4.39 0.27 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 1092 E 8.84 5.02 0.00 1.72 1.69 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 2.10 1.83 0.00 1093 V 8.94 4.44 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 1.01 0.00 0.00 0.97 0.00 0.00 1094 V 8.62 5.17 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 1.13 0.00 0.00 0.90 0.00 0.00 1095 F 8.81 5.15 0.00 3.16 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 1096 T 8.72 4.70 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 1.29 0.00 0.00 1097 A 8.72 4.66 0.61 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 1098 N 9.52 5.18 0.00 2.71 2.86 0.00 0.00 6.98 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 1099 D 8.25 4.67 0.00 2.79 2.79 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 1100 S 8.14 4.61 0.00 3.85 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 1101 G 8.26 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 0.00 0.00 0.00 1102 P 0.00 4.78 0.00 2.23 2.12 0.00 3.72 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 2.01 2.02 0.00 1103 R 8.81 4.80 0.00 1.30 1.44 0.00 3.30 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 1104 R 8.59 4.89 0.00 1.67 1.82 0.00 3.08 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 1105 Y 9.25 5.02 0.00 2.94 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 1106 T 8.94 4.93 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 1.18 0.00 0.00 1107 I 8.74 4.77 1.83 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.99 0.87 0.00 0.00 1108 A 8.83 5.32 1.20 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 1109 A 8.96 5.16 1.16 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 0.00 0.00 1110 L 9.17 4.97 0.00 1.78 1.59 0.98 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 1111 L 8.95 5.42 0.00 1.80 2.01 0.50 0.85 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 1112 S 9.35 5.22 0.00 3.81 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 1113 P 0.00 3.20 0.00 2.10 1.71 0.00 3.33 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.74 0.00 1114 Y 7.79 4.79 0.00 2.76 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 1115 S 8.03 4.76 0.00 3.80 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 1116 Y 7.78 5.51 0.00 3.08 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 1117 S 9.13 4.88 0.00 3.83 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 1118 T 8.53 5.21 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 1.32 0.00 0.00 1119 T 8.84 4.87 4.25 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 1.21 0.00 0.00 1120 A 8.47 5.21 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 1121 V 8.62 4.31 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 0.99 0.00 0.00 0.91 0.00 0.00 1122 V 8.42 4.67 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 0.45 0.00 0.00 0.93 0.00 0.00 1123 T 8.62 4.68 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 1.16 0.00 0.00 1124 N 8.59 4.92 0.00 2.67 2.70 0.00 0.00 6.85 7.69 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 *1125 P 0.00 4.22 0.00 1.88 1.84 0.00 3.69 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.09 0.00 * Residues marked with a * may have inaccurate shift predictions.