NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 N 4.6676 8.4244 119.2066 53.6286 40.1074 174.3732 7 V 3.8276 8.1573 123.6090 63.7428 31.6405 176.0424 8 Q 4.0655 8.1726 118.5655 58.3780 29.3388 176.2123 9 H 4.3913 7.8892 118.7074 58.6914 29.9716 176.6859 10 Q 4.1134 7.8807 119.2384 57.9065 28.7275 177.7857 11 L 3.9697 7.7205 121.6570 57.9069 42.1609 178.7065 12 A 4.0113 7.6952 120.2992 55.4863 18.3927 179.6276 13 Q 4.1502 7.8040 116.6145 59.1350 28.5942 178.9773 14 F 4.1202 8.4183 121.7263 61.2959 39.2968 177.2798 15 Q 3.9944 8.5422 118.1244 58.8117 28.6796 178.4782 16 Q 4.1582 8.7063 119.5960 58.7781 28.7181 178.4046 17 L 3.9822 7.9195 121.2367 57.7752 42.0037 178.9770 18 Q 3.8448 7.4533 118.4629 58.7335 28.5775 178.4406 19 Q 3.9852 7.8256 119.1726 58.6744 28.7607 178.2843 20 Q 3.8981 7.9746 120.2247 59.1923 29.1745 178.1322 21 A 4.0752 7.8800 121.7341 55.2205 18.0731 179.4886 22 Q 3.8583 7.6101 116.7165 59.0616 29.4699 177.8094 23 A 4.1069 8.3210 122.1601 55.4822 18.5357 179.5318 24 I 3.9076 8.1747 119.7943 64.0297 37.2534 178.6207 25 S 4.1094 7.8635 113.4165 61.2053 62.1717 176.4685 26 V 3.6113 7.8413 121.1209 65.9831 31.1038 177.9830 27 Q 3.9996 8.0438 117.3827 58.8334 28.5829 178.6778 28 K 4.0035 8.1232 120.5942 59.5836 32.0453 178.6919 29 Q 3.9921 7.7471 118.2618 59.3270 28.9903 178.1327 30 T 4.0056 7.7998 116.0534 66.6822 68.8558 176.5461 31 V 3.9640 8.0796 120.4687 65.8525 31.4811 178.5168 32 E 3.9033 8.0995 116.4430 56.9112 29.2298 178.8281 *34 Q 4.3172 8.1318 120.4384 56.1159 31.1423 177.9810 35 I 3.7345 7.7948 118.8712 64.3688 37.0184 178.0375 36 N 4.5631 8.1482 118.6650 55.8166 38.3694 177.1126 37 E 3.9241 8.0991 120.1280 59.5383 29.7419 178.8506 38 T 3.8888 7.9827 115.8594 66.6716 68.0738 176.7380 39 Q 3.9723 8.3475 120.2604 58.7805 28.7904 178.7942 40 K 3.9246 8.3326 120.5705 59.4923 32.2664 178.7391 41 A 4.0114 8.0046 121.0436 55.2059 18.3307 179.6443 42 L 3.9699 8.2223 117.7400 57.6868 41.3942 179.3880 43 E 3.9119 8.1760 118.7901 59.2463 29.7816 178.3862 44 E 4.1195 8.0825 118.4317 59.5721 29.1080 179.3458 45 L 4.0207 8.0609 119.1518 57.8262 41.4364 179.6987 46 S 4.2871 7.9092 113.0276 60.8666 63.1939 175.6021 47 R 4.0774 7.6251 120.3549 57.6629 30.3301 176.7891 48 A 4.2407 7.2942 119.0944 51.0915 19.4250 177.0450 49 A 4.2826 8.1989 122.3941 51.7711 19.1477 178.8556 50 D 4.4312 8.6685 119.5203 56.6800 40.9733 177.5307 51 D 4.8210 7.8586 116.3997 52.6077 39.7056 176.1598 52 A 4.0734 7.6922 122.4042 52.8298 18.8330 177.7362 53 E 4.2970 8.5851 120.8073 55.4544 30.5887 176.3940 54 V 4.6877 7.8385 116.2981 59.7395 35.5580 174.1822 55 Y 5.1928 8.5675 118.8283 56.1716 42.2138 174.5647 56 K 4.7584 9.1950 122.7456 54.6805 35.3391 174.8030 57 S 5.1059 8.7484 121.8090 57.0815 64.9890 174.1155 58 S 4.4112 8.9528 117.8979 57.0561 64.1406 174.6273 59 G 4.0288 8.1757 120.4863 46.8850 0.0000 172.5408 60 N 4.7153 8.9674 122.3531 52.7203 38.7541 174.1898 61 I 4.5843 7.4412 112.6622 58.6845 40.2714 173.9680 62 L 5.1781 8.2992 122.5832 53.3913 44.5524 175.2919 63 I 4.7748 8.9199 126.0824 58.9932 41.6293 174.1190 64 R 4.1370 8.7511 129.2441 56.3194 30.5494 175.8237 65 V 4.5929 8.0278 118.3693 58.9197 35.9334 175.5285 66 A 3.9671 8.5395 126.0539 52.3262 18.9861 178.8620 67 K 3.9686 8.6898 123.2665 59.4505 32.3340 178.9931 68 D 4.3464 7.9785 119.2034 56.3713 39.5302 178.3262 69 E 3.9634 8.0563 119.6068 58.9554 29.5801 178.8033 70 L 3.9618 7.9877 120.4641 58.3235 42.0624 179.1614 71 T 3.8387 8.0563 115.7487 66.7140 68.4736 176.1468 72 E 3.9022 8.0649 121.0273 59.2130 29.5920 178.4902 73 E 3.9229 8.2583 119.2590 59.3881 29.7512 178.8998 74 L 4.0171 8.0199 119.0319 57.6056 41.6200 179.1412 75 Q 3.9473 8.4123 119.9819 59.3006 28.9158 178.3907 76 E 3.9584 8.2444 119.4646 59.2502 29.5211 179.2701 77 K 3.9018 7.9963 119.6210 59.2560 32.2900 178.4342 78 L 3.9318 8.4876 120.8739 58.4857 42.0729 178.8955 79 E 4.1463 8.5980 118.7345 59.7766 29.3517 179.6216 80 T 3.9394 8.2055 116.0082 66.4891 68.3962 176.9082 81 L 4.0347 8.1064 121.0662 57.7825 41.6091 179.5601 82 Q 3.9728 8.2197 118.1307 58.7861 28.6409 178.4595 83 L 3.9426 7.8990 121.4044 58.0647 42.0645 178.9625 84 R 3.8634 8.0280 118.6829 59.3961 30.0423 177.9919 85 E 3.9101 8.4642 119.3717 59.4066 29.7130 179.0479 86 K 4.0372 8.1050 118.4509 59.7152 32.0698 179.5609 87 T 3.9252 8.1231 116.1795 66.4910 68.2281 176.9092 88 I 3.7046 7.9638 121.9160 64.5079 37.1922 178.3683 89 E 3.9439 8.2446 119.4154 59.3334 29.1920 179.4518 90 R 3.9100 7.9522 118.6887 59.3978 30.1613 178.4032 91 Q 3.9900 8.1114 119.5313 58.7515 28.7667 177.6948 92 E 3.8949 8.0993 120.0967 59.3618 29.8071 178.3540 93 E 4.1081 7.9642 117.0826 59.4326 29.8310 179.2204 94 R 4.1252 7.7951 117.6790 59.1469 30.0432 180.2823 95 V 3.7862 7.6184 115.4350 63.3029 31.3533 177.7761 *97 K 4.2118 8.0016 117.8061 55.8409 33.7698 178.2628 98 K 3.9859 8.3974 118.1295 59.1462 31.9558 178.3531 99 L 4.0966 7.9483 120.5535 58.1881 42.2395 178.3977 100 Q 4.2559 8.1611 116.9768 58.9713 28.8647 178.4752 101 E 4.1072 8.1529 117.2257 57.1557 29.2551 177.7466 *103 Q 3.9438 7.9412 120.2294 55.7894 31.2564 177.3278 104 V 3.5603 8.3426 117.2549 66.1642 31.6308 177.7005 105 N 4.5050 8.2531 115.0965 55.4758 38.2645 176.6182 106 I 4.1471 7.0637 119.7233 63.0849 37.9625 177.4839 107 Q 4.2474 8.2012 115.3977 57.4766 28.4887 176.8664 108 E 4.5550 8.2819 116.8446 57.0955 33.9632 177.3551 109 A 4.2475 7.3213 122.2518 51.6705 17.0673 177.5793 *111 K 4.0621 7.8793 114.9368 57.9647 33.8020 176.9384 112 G 3.7161 8.1246 107.0735 45.7822 0.0000 170.3086 113 A 3.4869 9.7540 135.0000 52.5531 18.9398 177.1017 114 G 4.0127 8.8130 109.5181 45.6938 0.0000 173.2451 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 6 N 8.42 4.67 0.00 2.70 2.83 0.00 0.00 6.90 6.83 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 7 V 8.16 3.83 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 0.94 0.00 0.00 0.93 0.00 0.00 8 Q 8.17 4.07 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 9 H 7.89 4.39 0.00 3.28 3.30 0.00 5.82 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 10 Q 7.88 4.11 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.70 0.00 0.00 0.00 0.00 0.00 2.46 2.63 0.00 11 L 7.72 3.97 0.00 1.71 1.83 0.89 1.06 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 12 A 7.70 4.01 1.33 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 0.00 0.00 0.00 13 Q 7.80 4.15 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.22 0.00 14 F 8.42 4.12 0.00 3.24 3.31 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 15 Q 8.54 3.99 0.00 2.31 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.63 2.82 0.00 16 Q 8.71 4.16 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 17 L 7.92 3.98 0.00 1.81 1.58 0.86 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 7.45 3.84 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 1.99 1.76 0.00 19 Q 7.83 3.99 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 20 Q 7.97 3.90 0.00 2.12 2.22 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 2.32 2.35 0.00 21 A 7.88 4.08 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 22 Q 7.61 3.86 0.00 2.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.89 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 23 A 8.32 4.11 1.34 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 0.00 0.00 0.00 24 I 8.17 3.91 1.85 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 1.37 1.44 0.90 0.00 0.00 25 S 7.86 4.11 0.00 3.97 4.08 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 26 V 7.84 3.61 2.24 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 0.97 0.00 0.00 0.98 0.00 0.00 27 Q 8.04 4.00 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.61 0.00 28 K 8.12 4.00 0.00 1.93 1.99 0.00 1.71 0.00 0.00 1.57 0.00 0.00 3.04 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.55 1.44 7.81 29 Q 7.75 3.99 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 30 T 7.80 4.01 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 1.21 0.00 0.00 31 V 8.08 3.96 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 1.03 0.00 0.00 0.96 0.00 0.00 32 E 8.10 3.90 0.00 2.29 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 2.42 2.44 0.00 *34 Q 8.13 4.32 0.00 2.26 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.48 6.92 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 35 I 7.79 3.73 2.05 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.86 0.94 0.00 0.00 36 N 8.15 4.56 0.00 2.78 2.87 0.00 0.00 6.20 6.97 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 37 E 8.10 3.92 0.00 2.03 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 2.38 2.40 0.00 38 T 7.98 3.89 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 1.21 0.00 0.00 39 Q 8.35 3.97 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 40 K 8.33 3.92 0.00 1.96 1.97 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.46 7.81 41 A 8.00 4.01 1.38 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 0.00 0.00 42 L 8.22 3.97 0.00 1.84 1.73 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.18 3.91 0.00 2.13 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 0.00 2.32 2.50 0.00 44 E 8.08 4.12 0.00 2.24 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 2.44 2.51 0.00 45 L 8.06 4.02 0.00 1.85 1.72 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 46 S 7.91 4.29 0.00 4.05 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 47 R 7.63 4.08 0.00 1.93 2.03 0.00 3.18 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 48 A 7.29 4.24 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 49 A 8.20 4.28 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 50 D 8.67 4.43 0.00 2.67 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 51 D 7.86 4.82 0.00 2.74 2.71 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 52 A 7.69 4.07 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 53 E 8.59 4.30 0.00 2.04 1.82 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 2.22 2.31 0.00 54 V 7.84 4.69 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 0.74 0.00 0.00 0.88 0.00 0.00 55 Y 8.57 5.19 0.00 2.77 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 56 K 9.19 4.76 0.00 1.79 1.63 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.36 7.81 57 S 8.75 5.11 0.00 3.92 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 58 S 8.95 4.41 0.00 3.81 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 59 G 8.18 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 0.00 0.00 0.00 60 N 8.97 4.72 0.00 2.72 2.86 0.00 0.00 6.57 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 61 I 7.44 4.58 1.89 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 1.38 1.11 0.92 0.00 0.00 62 L 8.30 5.18 0.00 1.60 1.54 0.95 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 63 I 8.92 4.77 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 1.12 1.62 1.01 0.00 0.00 64 R 8.75 4.14 0.00 1.74 1.71 0.00 3.08 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.86 0.00 65 V 8.03 4.59 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 0.75 0.00 0.00 0.88 0.00 0.00 66 A 8.54 3.97 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 67 K 8.69 3.97 0.00 1.79 1.79 0.00 1.70 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.48 7.81 68 D 7.98 4.35 0.00 2.90 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 69 E 8.06 3.96 0.00 2.15 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 2.39 2.35 0.00 70 L 7.99 3.96 0.00 1.82 1.79 0.92 0.66 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 71 T 8.06 3.84 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 1.21 0.00 0.00 72 E 8.06 3.90 0.00 2.10 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 2.30 2.43 0.00 73 E 8.26 3.92 0.00 2.20 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 0.00 2.31 2.35 0.00 74 L 8.02 4.02 0.00 1.89 1.70 0.92 0.61 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 75 Q 8.41 3.95 0.00 2.28 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 76 E 8.24 3.96 0.00 2.21 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 0.00 2.31 2.62 0.00 77 K 8.00 3.90 0.00 1.85 1.95 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.45 7.81 78 L 8.49 3.93 0.00 1.74 1.89 0.92 1.04 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 79 E 8.60 4.15 0.00 2.07 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 0.00 2.33 2.44 0.00 80 T 8.21 3.94 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 1.21 0.00 0.00 81 L 8.11 4.03 0.00 1.88 1.71 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 8.22 3.97 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 83 L 7.90 3.94 0.00 1.78 1.82 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 84 R 8.03 3.86 0.00 2.04 2.12 0.00 3.20 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 85 E 8.46 3.91 0.00 2.05 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 0.00 2.30 2.35 0.00 86 K 8.11 4.04 0.00 2.02 1.84 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.61 7.81 87 T 8.12 3.93 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 1.21 0.00 0.00 88 I 7.96 3.70 2.04 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 1.51 0.82 0.90 0.00 0.00 89 E 8.24 3.94 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 2.32 2.45 0.00 90 R 7.95 3.91 0.00 2.02 2.09 0.00 3.09 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 91 Q 8.11 3.99 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 92 E 8.10 3.89 0.00 2.20 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 0.00 2.31 2.34 0.00 93 E 7.96 4.11 0.00 1.99 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 2.34 2.62 0.00 94 R 7.80 4.13 0.00 1.99 1.97 0.00 3.13 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 95 V 7.62 3.79 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 1.05 0.00 0.00 0.99 0.00 0.00 *97 K 8.00 4.21 0.00 2.13 1.88 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.44 7.81 98 K 8.40 3.99 0.00 1.78 1.97 0.00 1.80 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.46 7.81 99 L 7.95 4.10 0.00 1.89 1.66 0.60 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 100 Q 8.16 4.26 0.00 2.09 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.33 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 101 E 8.15 4.11 0.00 2.38 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 2.32 2.33 0.00 *103 Q 7.94 3.94 0.00 2.27 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.68 0.00 0.00 0.00 0.00 0.00 2.40 2.14 0.00 104 V 8.34 3.56 2.27 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 0.97 0.00 0.00 0.98 0.00 0.00 105 N 8.25 4.51 0.00 2.86 2.86 0.00 0.00 7.02 7.32 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 0.00 106 I 7.06 4.15 1.85 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.59 0.81 0.00 0.00 107 Q 8.20 4.25 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 108 E 8.28 4.55 0.00 1.88 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 2.22 2.39 0.00 109 A 7.32 4.25 1.36 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 0.00 0.00 0.00 *111 K 7.88 4.06 0.00 1.88 1.88 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.43 7.81 112 G 8.12 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 0.00 0.00 0.00 113 A 9.75 3.49 1.32 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 0.00 0.00 0.00 114 G 8.81 4.01 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.