NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.1778 8.3033 121.4522 55.9969 31.9975 177.7561 3 Q 3.8280 7.8929 117.8986 56.9552 29.1035 176.1611 4 Q 4.0240 8.8474 119.3977 59.6087 28.6108 178.6963 5 L 3.5936 7.5525 120.0235 57.3438 41.6371 179.1884 6 K 3.8849 7.5070 118.2308 59.1963 32.0057 178.3589 7 D 4.4188 8.3817 120.8030 56.0957 40.8212 178.6366 8 I 3.4825 7.5111 120.5886 63.7653 37.0513 178.4245 9 I 3.5003 7.6638 121.1037 64.2967 37.1008 178.5242 10 S 4.0313 7.6378 114.8823 61.3817 62.6682 176.1097 11 A 3.9924 7.8818 124.5004 55.1136 18.0322 179.5162 12 C 3.9007 7.7042 114.9575 62.8982 27.8415 175.5615 13 D 4.3325 8.4682 119.9688 57.3990 40.5594 178.3501 14 L 3.9449 8.2122 120.6153 57.9684 42.2299 178.5818 15 A 4.2774 7.9692 121.9791 54.3627 18.1617 179.5549 16 I 3.7168 7.6814 118.4533 64.1000 37.1360 178.4529 17 Q 4.0059 7.4677 117.6841 59.1357 28.6283 177.0763 18 N 4.5382 8.3227 112.1175 52.8403 38.3383 174.6744 19 E 2.9047 7.2629 116.9226 57.2981 28.3173 175.5324 20 D 4.7159 7.0449 114.9037 51.6867 38.7627 176.9580 21 F 4.3985 6.9205 121.1154 60.2850 39.7952 177.7350 22 D 4.5686 8.1799 120.1987 55.9454 39.4179 177.3808 23 T 4.3847 7.8386 108.6317 62.6774 69.8835 175.7858 24 L 4.4285 7.2668 124.9149 55.1205 41.2830 177.8568 *26 N 4.6899 8.1210 114.9179 52.8399 40.5753 174.9723 27 Y 4.5728 7.7460 114.3952 58.5226 39.1717 174.9464 28 Y 5.2321 7.9418 116.7715 56.3161 40.3544 175.5865 29 S 4.5528 8.8439 117.5775 57.7896 64.5792 173.9166 30 E 4.1700 8.9277 120.6033 58.3020 30.4451 177.2557 31 D 4.8525 7.9192 116.2747 53.0163 40.4048 176.7019 32 A 4.5311 7.8059 121.5325 53.1671 19.9593 177.6233 33 V 4.8273 8.8075 111.5826 59.4951 35.9453 174.8280 34 L 5.0184 8.8360 126.3450 53.2270 45.1971 175.3039 35 V 4.1297 8.7565 127.5131 61.9884 31.2386 176.0115 36 V 3.6647 8.4494 128.8439 65.2042 31.7394 175.9383 37 K 4.9150 7.4193 113.9190 55.5817 34.7067 172.9855 38 P 3.6639 0.0000 0.0000 64.2873 31.8034 176.1287 39 G 3.5877 8.2417 111.9392 45.8164 0.0000 172.4236 *41 I 4.1142 7.3512 113.0512 60.9823 39.5422 175.8872 42 A 4.7307 8.7152 125.6738 50.2283 21.4641 175.4940 43 R 4.8279 8.6730 121.2837 55.4455 32.9303 176.9070 44 G 4.4425 9.1170 109.4263 45.8965 0.0000 174.5056 45 K 3.8953 8.6580 120.4341 59.2998 32.0178 179.2888 46 E 3.8995 8.0566 118.8693 59.4764 29.8036 178.4278 47 E 3.9408 8.1395 118.0284 59.6426 29.6119 179.4726 48 I 3.5698 7.7639 119.7728 63.8394 37.0949 178.3875 49 K 4.0157 8.0645 120.5778 59.4851 32.0903 178.8918 50 K 3.8122 8.0387 118.4601 59.4002 31.9103 178.8661 51 A 3.8321 7.8305 120.8152 55.3924 17.9897 179.7756 52 F 4.0972 7.5011 114.3714 60.6609 39.0246 177.6546 53 I 3.2453 7.0488 118.2843 64.4493 37.1225 178.3551 54 T 4.1044 8.2209 117.1064 66.5460 68.0774 176.5501 55 I 3.9772 7.6327 111.9590 61.2868 37.9052 177.4476 56 A 4.5229 7.9832 124.1823 55.2693 19.5006 179.2263 57 N 4.7907 7.9845 116.2496 52.1117 37.6613 175.1584 58 Y 4.8333 7.7266 124.2292 56.4160 39.4759 175.1811 59 F 4.2964 8.1430 121.5146 57.3178 40.9328 174.3698 60 N 4.7594 7.6882 124.3551 51.2499 37.3123 174.0476 61 H 4.0315 9.0138 122.4688 58.1069 30.8040 173.9978 62 H 4.0558 8.8501 124.0146 56.0236 27.5129 174.1302 63 I 4.1862 7.2473 116.7354 60.5425 41.4626 174.9547 64 V 4.3511 8.2736 124.8137 60.2598 32.9900 172.6745 65 P 4.8603 0.0000 0.0000 63.5548 32.6965 175.7781 66 T 4.5547 8.6677 115.0984 62.2050 73.1970 173.6118 67 Q 4.1562 9.0285 128.4614 56.8031 29.4959 175.9086 68 G 4.3004 8.4495 114.2817 44.9722 0.0000 170.9530 69 K 4.0442 8.9900 123.4372 56.8849 33.6114 176.7324 *71 I 4.2524 8.1088 119.5608 61.1367 38.8120 174.9664 72 L 5.0478 8.4461 124.5111 53.0293 44.5583 176.1690 73 L 4.5398 9.0416 125.0113 53.0415 43.0561 174.4523 74 E 4.6194 8.5741 124.5098 54.1826 30.7403 176.1456 75 A 4.7382 8.2997 129.0570 50.6826 20.2214 176.6868 76 G 3.9695 8.7855 113.4095 45.9294 0.0000 173.1443 77 D 4.3943 9.4833 120.4877 56.9198 42.3912 174.9545 78 T 5.6006 7.8254 107.5597 60.2208 72.6175 173.0518 79 V 4.7363 8.8125 120.8191 61.4872 35.2869 172.9733 80 L 4.8294 9.2947 130.9520 53.8439 43.5566 174.9605 81 V 4.6009 9.1942 127.6620 61.6573 33.3642 174.6861 82 L 5.0122 8.9332 129.1358 52.3428 41.9059 174.2746 83 S 4.5796 8.1139 117.8869 56.9078 64.2692 171.9294 84 Q 4.8515 9.0962 129.4659 55.1480 30.9401 174.1430 85 T 5.0114 8.5408 122.5686 61.7784 71.6830 173.0811 86 L 4.6299 9.2376 127.0789 53.8589 43.0209 177.7506 87 L 4.0262 8.6506 124.8779 57.1460 42.5769 177.0694 88 D 4.6575 7.8949 115.7118 54.6654 42.9540 175.7078 *99 E 4.3353 7.7935 115.1033 56.1858 31.3266 175.9271 100 R 4.3153 8.9489 119.9814 54.8543 32.6752 174.3156 101 R 4.8164 8.5627 126.9026 55.2259 31.0752 175.9935 102 A 4.5854 8.7211 126.9393 50.3779 21.9080 175.5839 103 T 4.6702 7.7570 108.0337 60.3375 71.5389 172.5582 104 Y 5.1318 8.8621 124.3534 55.9601 41.9506 175.1609 105 V 4.9062 8.6136 121.4586 61.4278 34.5941 174.3370 106 F 5.4228 9.1711 126.5389 55.8075 42.5178 174.5821 107 K 5.3189 9.3204 122.4631 54.5853 35.2876 174.9488 108 K 3.9085 7.6870 129.5658 55.5284 32.5014 176.6404 109 N 4.5802 8.2373 126.1061 51.7024 39.0162 175.5076 110 A 3.9225 8.5083 120.1852 55.6820 18.3022 179.1584 111 Q 3.9517 7.8767 112.7579 57.5528 28.8042 177.6360 112 G 3.7793 8.1102 106.3286 44.7274 0.0000 172.5784 113 E 4.5629 8.1894 118.9846 54.2502 31.6182 175.4095 114 W 4.6292 8.9554 124.7889 56.7246 29.6899 175.7616 115 L 5.0959 9.0213 125.1425 53.3536 44.4888 175.0070 116 C 4.1023 8.9795 121.5318 58.6335 32.5539 173.9708 117 V 4.2048 9.0318 125.2652 63.5968 34.2880 175.0422 118 I 4.8249 7.5497 120.6725 59.6882 40.8920 174.2086 119 D 5.1545 9.3050 128.8700 52.7636 42.4734 173.5146 120 N 5.1739 8.6924 124.5160 50.9018 39.4077 174.7037 121 S 4.3597 8.9668 114.9764 59.3875 63.3954 175.0926 122 Y 4.2611 8.5503 119.0548 57.2022 39.7736 177.0156 123 G 4.0209 8.3488 108.7575 45.6631 0.0000 175.3395 124 T 4.1085 8.3126 110.2520 63.6957 68.5077 176.0889 125 D 4.4476 7.9803 122.3073 57.0009 40.5252 177.9651 126 L 3.7066 7.5634 120.3154 58.1549 41.9798 178.7805 127 I 3.9105 7.6041 119.3846 64.2382 37.2268 176.2413 128 G 3.7384 7.5534 111.9439 45.8395 0.0000 173.1466 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 2 E 8.30 4.18 0.00 1.96 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 2.22 2.29 0.00 3 Q 7.89 3.83 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.68 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 4 Q 8.85 4.02 0.00 2.26 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.92 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 5 L 7.55 3.59 0.00 1.44 1.36 0.45 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 6 K 7.51 3.88 0.00 1.95 1.87 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.44 7.81 7 D 8.38 4.42 0.00 2.79 2.63 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 0.00 0.00 0.00 0.00 8 I 7.51 3.48 1.72 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.90 0.59 0.00 0.00 9 I 7.66 3.50 1.91 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.84 0.83 0.00 0.00 10 S 7.64 4.03 0.00 3.96 4.06 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 11 A 7.88 3.99 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 C 7.70 3.90 0.00 2.93 2.82 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 13 D 8.47 4.33 0.00 2.78 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 14 L 8.21 3.94 0.00 1.85 1.76 0.90 1.30 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 15 A 7.97 4.28 1.40 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 0.00 0.00 16 I 7.68 3.72 2.06 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 1.28 0.90 1.09 0.00 0.00 17 Q 7.47 4.01 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.19 0.00 0.00 0.00 0.00 0.00 2.46 2.61 0.00 18 N 8.32 4.54 0.00 2.81 2.77 0.00 0.00 7.31 8.43 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 19 E 7.26 2.90 0.00 1.93 1.81 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 2.33 2.36 0.00 20 D 7.04 4.72 0.00 2.92 2.68 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 0.00 0.00 0.00 0.00 21 F 6.92 4.40 0.00 3.26 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 22 D 8.18 4.57 0.00 2.79 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 23 T 7.84 4.38 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 1.28 0.00 0.00 24 L 7.27 4.43 0.00 1.84 1.86 0.90 0.10 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 *26 N 8.12 4.69 0.00 2.53 2.63 0.00 0.00 7.13 7.46 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 27 Y 7.75 4.57 0.00 2.92 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 28 Y 7.94 5.23 0.00 2.99 2.91 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 29 S 8.84 4.55 0.00 3.94 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.93 4.17 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 31 D 7.92 4.85 0.00 2.72 2.73 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 32 A 7.81 4.53 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.81 4.83 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 0.68 0.00 0.00 0.99 0.00 0.00 34 L 8.84 5.02 0.00 1.46 1.27 0.53 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.76 4.13 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 0.51 0.00 0.00 0.94 0.00 0.00 36 V 8.45 3.66 1.95 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 0.71 0.00 0.00 0.74 0.00 0.00 37 K 7.42 4.92 0.00 1.80 1.71 0.00 1.08 0.00 0.00 2.27 0.00 0.00 3.01 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.21 1.35 7.81 38 P 0.00 3.66 0.00 1.93 1.91 0.00 3.71 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.57 0.00 39 G 8.24 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *41 I 7.35 4.11 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.59 0.83 0.00 0.00 42 A 8.72 4.73 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 43 R 8.67 4.83 0.00 1.63 1.79 0.00 3.14 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 1.51 1.50 0.00 44 G 9.12 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.66 3.90 0.00 1.83 1.93 0.00 1.98 0.00 0.00 1.82 0.00 0.00 3.18 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.63 1.68 7.81 46 E 8.06 3.90 0.00 2.03 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 2.40 0.00 47 E 8.14 3.94 0.00 2.18 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 2.38 0.00 48 I 7.76 3.57 1.83 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.16 0.55 0.00 0.00 49 K 8.06 4.02 0.00 2.03 1.97 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.59 7.81 50 K 8.04 3.81 0.00 1.96 1.79 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.55 7.81 51 A 7.83 3.83 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 52 F 7.50 4.10 0.00 2.98 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 53 I 7.05 3.25 1.83 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.01 0.90 0.00 0.00 54 T 8.22 4.10 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 1.22 0.00 0.00 55 I 7.63 3.98 1.73 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 1.60 0.63 0.68 0.00 0.00 56 A 7.98 4.52 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 0.00 0.00 0.00 0.00 0.00 57 N 7.98 4.79 0.00 2.55 2.78 0.00 0.00 6.67 7.46 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 58 Y 7.73 4.83 0.00 3.09 2.88 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 59 F 8.14 4.30 0.00 3.11 2.99 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 60 N 7.69 4.76 0.00 2.86 2.80 0.00 0.00 5.98 7.90 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 61 H 9.01 4.03 0.00 3.16 3.40 0.00 6.08 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 62 H 8.85 4.06 0.00 2.96 3.19 0.00 5.84 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 63 I 7.25 4.19 2.21 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.65 0.88 0.00 0.00 64 V 8.27 4.35 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 0.92 0.00 0.00 1.02 0.00 0.00 65 P 0.00 4.86 0.00 2.12 2.06 0.00 3.97 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 2.04 2.02 0.00 66 T 8.67 4.55 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 67 Q 9.03 4.16 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 68 G 8.45 4.30 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 0.00 69 K 8.99 4.04 0.00 1.94 1.75 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.44 7.81 *71 I 8.11 4.25 1.86 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 1.33 0.35 0.90 0.00 0.00 72 L 8.45 5.05 0.00 1.39 1.46 0.86 0.73 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 73 L 9.04 4.54 0.00 1.64 1.60 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.57 4.62 0.00 1.89 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 2.31 2.39 0.00 75 A 8.30 4.74 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 76 G 8.79 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 77 D 9.48 4.39 0.00 2.76 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 78 T 7.83 5.60 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 1.31 0.00 0.00 79 V 8.81 4.74 1.73 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 0.71 0.00 0.00 0.41 0.00 0.00 80 L 9.29 4.83 0.00 1.79 1.55 0.97 0.75 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 81 V 9.19 4.60 2.43 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 1.14 0.00 0.00 1.08 0.00 0.00 82 L 8.93 5.01 0.00 1.47 1.55 0.90 0.81 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 83 S 8.11 4.58 0.00 4.07 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 84 Q 9.10 4.85 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.52 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 85 T 8.54 5.01 4.23 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 1.21 0.00 0.00 86 L 9.24 4.63 0.00 1.66 1.56 0.92 0.55 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 87 L 8.65 4.03 0.00 1.55 1.66 0.88 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 88 D 7.89 4.66 0.00 2.65 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 *99 E 7.79 4.34 0.00 1.97 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 2.16 2.30 0.00 100 R 8.95 4.32 0.00 1.73 1.73 0.00 2.75 0.00 0.00 3.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.46 0.00 101 R 8.56 4.82 0.00 1.76 1.82 0.00 3.13 0.00 0.00 3.32 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 102 A 8.72 4.59 0.82 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 0.00 0.00 103 T 7.76 4.67 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 1.14 0.00 0.00 104 Y 8.86 5.13 0.00 3.06 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 0.00 105 V 8.61 4.91 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 0.88 0.00 0.00 0.96 0.00 0.00 106 F 9.17 5.42 0.00 3.15 3.38 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 0.00 107 K 9.32 5.32 0.00 1.92 1.72 0.00 1.86 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.48 7.81 108 K 7.69 3.91 0.00 0.79 0.74 0.00 1.48 0.00 0.00 1.49 0.00 0.00 2.55 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.94 0.51 7.81 109 N 8.24 4.58 0.00 2.81 2.93 0.00 0.00 6.43 7.45 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 0.00 110 A 8.51 3.92 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 0.00 111 Q 7.88 3.95 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.72 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 112 G 8.11 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 0.00 113 E 8.19 4.56 0.00 2.09 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 0.00 2.19 2.38 0.00 114 W 8.96 4.63 0.00 3.16 3.26 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 0.00 115 L 9.02 5.10 0.00 1.74 1.70 0.97 0.61 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 0.00 116 C 8.98 4.10 0.00 2.69 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 0.00 0.00 0.00 0.00 117 V 9.03 4.20 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 1.04 0.00 0.00 1.04 0.00 0.00 118 I 7.55 4.82 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.60 0.93 0.00 0.00 119 D 9.31 5.15 0.00 2.95 2.72 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 0.00 120 N 8.69 5.17 0.00 2.93 2.82 0.00 0.00 6.76 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 0.00 121 S 8.97 4.36 0.00 4.02 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 0.00 122 Y 8.55 4.26 0.00 3.26 3.05 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 0.00 0.00 0.00 123 G 8.35 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 0.00 0.00 0.00 124 T 8.31 4.11 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 1.20 0.00 0.00 125 D 7.98 4.45 0.00 2.99 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 0.00 126 L 7.56 3.71 0.00 1.80 1.68 0.61 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 127 I 7.60 3.91 2.01 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 1.44 0.64 0.90 0.00 0.00 128 G 7.55 3.74 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.