NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1002 S 4.2626 8.3344 115.2811 58.0288 63.5695 171.9688 1003 E 4.1580 8.3972 123.5348 54.0435 30.3925 173.3371 1004 Q 4.6601 8.9147 129.2771 54.1034 31.4519 174.0863 1005 S 4.3997 9.1210 122.4764 58.1705 63.0521 173.5493 1006 I 4.6644 9.2423 119.5544 59.4912 38.4175 174.9165 1007 C 5.2995 6.9489 121.8728 58.9372 32.7316 172.3997 1008 Q 5.1485 8.2915 120.3670 55.0916 31.3766 173.2970 1009 A 4.6949 10.0206 126.9112 51.1905 23.7021 174.9076 1010 R 4.7147 8.5291 118.2207 54.9932 31.9087 175.8613 1011 A 4.5046 8.4956 123.8471 50.9933 23.5742 174.8598 1012 S 5.1007 9.1426 115.4162 56.7353 63.9598 174.2950 1013 V 4.2471 8.2087 127.1975 61.2311 33.5906 175.3250 *1015 V 4.0593 8.0570 113.4042 61.3160 33.2510 174.2964 1016 Y 3.5373 7.9920 126.8851 56.7782 39.0103 175.2645 1017 D 4.1802 8.4311 129.0234 52.4714 39.9417 175.9852 1018 D 3.8734 7.8447 125.7525 56.1182 39.0868 178.3369 1019 T 3.8561 7.2486 113.6335 64.5242 67.8515 175.0213 1020 S 4.0157 9.5472 116.4386 58.6837 62.5632 175.4807 1021 K 3.7473 7.6451 116.5689 57.8506 32.1411 174.7885 1022 K 4.6255 7.1643 118.5012 54.7826 35.5325 174.8083 1023 W 4.9297 8.6772 121.1350 55.7666 29.9780 176.6338 1024 V 4.7507 8.7162 118.5650 58.4288 34.3902 174.2150 1025 P 4.4572 0.0000 0.0000 62.7184 31.8322 176.6529 1026 I 3.8696 8.0379 120.5386 63.3480 38.0015 176.5464 1027 K 3.9235 7.5024 119.5934 58.5593 32.6897 176.4906 *1033 F 5.2336 7.9157 117.2659 56.9495 41.0672 174.5517 1034 S 4.9058 9.2119 117.2455 56.7814 67.7656 172.5665 1035 R 4.8846 8.9020 121.8069 55.2656 31.3493 174.8768 1036 I 5.0866 9.6829 127.5260 59.8288 39.9698 174.4699 1037 N 5.6390 8.8336 121.9589 50.7372 43.6328 173.4849 1038 I 4.7809 8.0935 122.0671 60.0601 39.7497 174.3232 1039 Y 5.0649 8.8834 125.3102 56.7578 40.7077 174.4094 1040 H 4.8076 9.1320 121.2374 54.2183 33.6845 171.9267 1041 N 4.8699 8.3280 124.2716 51.8509 40.0572 175.1531 1042 T 3.7020 8.3291 117.8843 64.6199 69.1710 176.0466 1043 A 4.4679 7.7458 122.8113 51.9602 17.9242 176.7639 1044 S 4.5168 8.4220 114.7980 59.2476 66.4977 176.8270 1045 S 3.6515 7.9937 112.8867 60.4988 60.3689 170.8676 1046 T 4.7918 6.8359 115.2558 60.1223 71.7089 172.6444 1047 F 5.2892 8.6919 124.0819 55.8628 43.1548 174.0776 1048 R 5.0543 9.3383 120.9125 54.5698 35.0303 174.1778 1049 V 4.6648 9.6263 123.2223 61.5047 33.4039 174.6588 1050 V 4.9003 9.1129 128.5261 61.1847 34.3368 174.1214 1051 G 4.4225 9.3847 116.1229 44.5266 0.0000 172.1045 1052 V 4.9362 8.5899 125.0488 60.7771 35.0206 174.8689 1053 K 4.7905 9.7307 129.6294 54.9366 32.0816 177.1822 1054 L 4.1853 8.6526 125.2391 56.8527 40.2840 177.8708 1055 Q 4.3192 7.9694 117.6804 58.1826 29.5390 176.7456 1056 D 4.9009 7.9439 116.6069 52.2820 41.3688 176.4884 1057 Q 4.0550 8.3472 117.1047 56.5834 27.1974 173.5157 1058 Q 4.4903 7.3730 114.5732 55.1727 30.7225 174.8938 1059 V 4.2397 8.3760 122.5758 63.2510 31.5601 175.8575 1060 V 4.2379 9.1606 121.8359 62.7499 33.0223 176.3731 1061 I 4.6904 7.6076 119.1786 59.6576 41.6087 173.8763 1062 N 5.4615 8.7428 126.0466 52.3650 38.9976 171.0234 1063 Y 4.6966 9.7342 124.2800 55.2597 41.5375 174.1460 1064 S 5.2287 7.8594 121.8937 57.2117 64.2581 173.7068 1065 I 4.0878 8.0968 120.0901 60.4875 37.7892 176.6792 1066 V 4.0279 8.2199 127.3750 59.8817 33.1932 175.9176 1067 K 4.1211 8.7482 120.4105 59.0735 31.9323 177.6680 1068 G 4.1147 7.8125 104.7307 44.8448 0.0000 172.9316 1069 L 4.1085 7.9424 120.7134 55.1257 42.6270 176.5400 1070 K 4.6380 8.5580 121.5746 54.9956 34.6453 174.3191 1071 Y 5.3053 8.7797 126.9730 56.1585 40.1615 174.0790 1072 N 4.7587 9.4767 126.1688 51.9672 42.0680 173.6304 1073 Q 4.2493 8.4043 125.9158 53.8817 26.9757 174.9592 1074 A 4.1642 8.5551 125.8392 54.6861 19.0003 177.9670 1075 T 4.8312 8.6465 103.8157 59.0543 71.7841 172.9957 1076 P 4.4672 0.0000 0.0000 65.1628 31.5778 177.7227 1077 T 4.9123 8.2860 106.8508 60.8321 71.0050 173.0938 1078 F 5.2398 8.5869 124.7943 56.5307 42.5542 173.0496 1079 H 5.4938 8.1864 122.5136 54.0911 33.0779 172.3833 1080 Q 4.9401 9.4070 118.8554 55.1321 32.9282 173.3667 1081 W 6.1743 8.9040 114.7299 56.5311 31.6376 173.5361 1082 R 5.1407 8.9323 122.1311 55.0202 31.6131 176.4923 1083 D 4.6629 9.4293 124.6891 54.2343 40.0506 177.6546 1084 A 5.5683 9.0713 134.1680 52.0251 21.4288 177.5554 1085 R 4.5694 7.6640 109.3394 56.4638 31.5641 174.2798 1086 Q 4.6599 7.6274 117.7787 55.8857 32.3316 172.3998 1087 V 4.9612 7.7238 124.4478 60.1720 34.3361 173.9437 1088 Y 4.8068 8.5592 121.4087 56.1946 40.9215 174.9083 1089 G 3.8890 8.2946 107.3633 44.6215 0.0000 171.8451 1090 L 4.4450 7.9078 121.0055 52.3798 45.1652 175.5303 1091 N 4.9271 8.6953 124.4006 52.3740 39.4304 174.6312 1092 F 4.7119 9.1476 125.7193 57.4797 39.7132 175.3558 1093 A 4.6358 8.2617 120.7772 52.8291 19.8142 177.6895 1094 S 4.5991 7.6808 107.8120 55.8798 65.7236 176.0517 1095 K 4.0949 8.7179 123.7776 59.0480 31.7804 178.9274 1096 E 3.8604 8.1704 118.9129 59.6666 29.5476 178.7961 1097 E 3.9225 8.4731 118.1267 58.9024 29.4117 179.3066 1098 A 2.5800 7.4063 121.0925 54.7201 18.4584 179.7269 1099 T 3.8194 8.0964 114.6863 66.9774 68.3694 177.0367 1100 T 3.7987 7.9232 117.5804 66.7253 68.3267 176.6063 1101 F 4.0002 7.9561 121.2782 61.0842 39.4245 177.0048 1102 S 4.2696 8.1467 113.4109 61.4639 63.2075 175.8126 1103 N 4.4573 8.0199 119.5370 55.8149 38.1564 177.2641 1104 A 4.3101 7.3339 118.9003 53.3568 18.2145 178.7803 *1106 L 4.0437 7.9648 119.9684 55.8400 43.8853 178.9989 1107 F 4.0811 8.3309 119.9005 61.4032 39.0244 177.0032 1108 A 2.5800 7.7974 119.3527 54.4407 17.9724 179.0668 1109 L 3.7917 7.1003 117.4976 57.9583 42.2842 178.4061 1110 N 4.3871 7.8781 116.0242 56.1130 39.1549 178.9310 1111 I 3.7137 7.0007 121.9209 60.7580 36.5477 175.9396 *1113 N 4.4816 8.1082 121.4681 53.6460 38.8621 174.9302 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 1002 S 8.33 4.26 0.00 3.82 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 1003 E 8.40 4.16 0.00 1.85 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 1.74 2.23 0.00 1004 Q 8.91 4.66 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 1005 S 9.12 4.40 0.00 3.40 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 1006 I 9.24 4.66 2.02 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.87 1.15 0.00 0.00 1007 C 6.95 5.30 0.00 2.98 3.03 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 1008 Q 8.29 5.15 0.00 2.22 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 1009 A 10.02 4.69 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 1010 R 8.53 4.71 0.00 1.77 1.26 0.00 3.13 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 1011 A 8.50 4.50 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.14 5.10 0.00 3.99 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 1013 V 8.21 4.25 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 0.72 0.00 0.00 1.02 0.00 0.00 *1015 V 8.06 4.06 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 0.33 0.00 0.00 0.91 0.00 0.00 1016 Y 7.99 3.54 0.00 1.43 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 0.00 0.00 0.00 0.00 1017 D 8.43 4.18 0.00 2.40 2.38 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.84 3.87 0.00 2.69 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 T 7.25 3.86 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 1.11 0.00 0.00 1020 S 9.55 4.02 0.00 3.76 4.13 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 1021 K 7.65 3.75 0.00 2.03 2.01 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.54 7.81 1022 K 7.16 4.63 0.00 1.60 1.77 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.63 7.81 1023 W 8.68 4.93 0.00 3.20 3.21 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 1024 V 8.72 4.75 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 0.67 0.00 0.00 0.97 0.00 0.00 1025 P 0.00 4.46 0.00 2.19 2.07 0.00 3.79 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 1026 I 8.04 3.87 1.95 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.89 1.03 0.00 0.00 1027 K 7.50 3.92 0.00 1.93 1.75 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.47 7.81 *1033 F 7.92 5.23 0.00 2.97 2.97 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 1034 S 9.21 4.91 0.00 3.87 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 1035 R 8.90 4.88 0.00 1.96 1.84 0.00 3.12 0.00 0.00 3.38 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 1036 I 9.68 5.09 1.97 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 1.27 0.85 1.09 0.00 0.00 1037 N 8.83 5.64 0.00 2.48 1.86 0.00 0.00 6.69 8.55 0.00 0.00 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 I 8.09 4.78 1.74 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.47 0.94 0.00 0.00 1039 Y 8.88 5.06 0.00 3.00 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 1040 H 9.13 4.81 0.00 2.39 3.02 0.00 5.73 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 1041 N 8.33 4.87 0.00 2.57 2.47 0.00 0.00 6.87 6.89 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 1042 T 8.33 3.70 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 1.27 0.00 0.00 1043 A 7.75 4.47 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 1044 S 8.42 4.52 0.00 3.72 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 1045 S 7.99 3.65 0.00 3.96 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 1046 T 6.84 4.79 4.13 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 1.10 0.00 0.00 1047 F 8.69 5.29 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 1048 R 9.34 5.05 0.00 1.77 1.83 0.00 3.08 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 1049 V 9.63 4.66 2.15 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 1.17 0.00 0.00 0.69 0.00 0.00 1050 V 9.11 4.90 2.41 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 1.08 0.00 0.00 1.18 0.00 0.00 1051 G 9.38 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 0.00 0.00 0.00 0.00 1052 V 8.59 4.94 2.15 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 1.12 0.00 0.00 1.03 0.00 0.00 1053 K 9.73 4.79 0.00 2.13 1.85 0.00 1.72 0.00 0.00 1.84 0.00 0.00 3.17 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.43 7.81 1054 L 8.65 4.19 0.00 1.82 1.81 1.04 0.62 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 1055 Q 7.97 4.32 0.00 2.24 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 1056 D 7.94 4.90 0.00 2.80 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 1057 Q 8.35 4.05 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 1058 Q 7.37 4.49 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.01 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 1059 V 8.38 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 0.91 0.00 0.00 0.98 0.00 0.00 1060 V 9.16 4.24 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 0.73 0.00 0.00 1.04 0.00 0.00 1061 I 7.61 4.69 2.02 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.26 1.09 0.00 0.00 1062 N 8.74 5.46 0.00 2.79 2.71 0.00 0.00 6.88 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 1063 Y 9.73 4.70 0.00 3.04 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 1064 S 7.86 5.23 0.00 3.78 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 1065 I 8.10 4.09 1.67 0.00 0.00 0.50 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 0.43 0.86 0.00 0.00 1066 V 8.22 4.03 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 0.76 0.00 0.00 0.89 0.00 0.00 1067 K 8.75 4.12 0.00 1.73 1.88 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.63 1.43 7.81 1068 G 7.81 4.11 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 0.00 1069 L 7.94 4.11 0.00 1.79 1.63 1.22 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 1070 K 8.56 4.64 0.00 1.87 1.80 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.57 7.81 1071 Y 8.78 5.31 0.00 2.96 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 1072 N 9.48 4.76 0.00 2.71 2.58 0.00 0.00 6.75 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 1073 Q 8.40 4.25 0.00 1.85 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.74 0.00 0.00 0.00 0.00 0.00 1.76 2.08 0.00 1074 A 8.56 4.16 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.65 4.83 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 1.23 0.00 0.00 1076 P 0.00 4.47 0.00 2.23 2.17 0.00 3.58 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 2.14 2.11 0.00 1077 T 8.29 4.91 4.39 0.00 0.00 0.00 0.00 0.00 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 1078 F 8.59 5.24 0.00 3.02 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 1079 H 8.19 5.49 0.00 3.29 2.85 0.00 5.65 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1080 Q 9.41 4.94 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 1081 W 8.90 6.17 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 1082 R 8.93 5.14 0.00 1.91 2.01 0.00 3.17 0.00 0.00 3.47 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 1083 D 9.43 4.66 0.00 3.09 3.35 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 1084 A 9.07 5.57 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 1085 R 7.66 4.57 0.00 1.93 2.01 0.00 3.28 0.00 0.00 3.71 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.75 0.00 1086 Q 7.63 4.66 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.90 0.00 0.00 0.00 0.00 0.00 1.79 1.67 0.00 1087 V 7.72 4.96 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 0.92 0.00 0.00 1088 Y 8.56 4.81 0.00 1.43 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 0.00 0.00 0.00 1089 G 8.29 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 1090 L 7.91 4.45 0.00 0.57 0.40 0.61 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 1091 N 8.70 4.93 0.00 2.96 2.81 0.00 0.00 6.78 8.05 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 1092 F 9.15 4.71 0.00 2.99 2.89 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 1093 A 8.26 4.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1094 S 7.68 4.60 0.00 3.96 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 1095 K 8.72 4.09 0.00 1.81 1.89 0.00 1.98 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.47 7.81 1096 E 8.17 3.86 0.00 1.97 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 2.36 2.34 0.00 1097 E 8.47 3.92 0.00 2.10 1.97 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 2.31 2.29 0.00 1098 A 7.41 2.58 0.90 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 1099 T 8.10 3.82 4.51 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 1.19 0.00 0.00 1100 T 7.92 3.80 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 1.19 0.00 0.00 1101 F 7.96 4.00 0.00 3.15 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 1102 S 8.15 4.27 0.00 4.42 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 1103 N 8.02 4.46 0.00 2.85 2.85 0.00 0.00 6.92 7.10 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 1104 A 7.33 4.31 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 *1106 L 7.96 4.04 0.00 1.71 1.74 0.99 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 1107 F 8.33 4.08 0.00 2.91 3.17 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 1108 A 7.80 2.58 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.10 3.79 0.00 1.47 1.61 0.82 0.88 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 1110 N 7.88 4.39 0.00 2.78 2.80 0.00 0.00 7.07 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 1111 I 7.00 3.71 1.46 0.00 0.00 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 1.16 0.25 0.93 0.00 0.00 *1113 N 8.11 4.48 0.00 2.69 2.75 0.00 0.00 7.03 7.56 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 * Residues marked with a * may have inaccurate shift predictions.