NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5577 8.2185 120.1946 53.8103 41.8224 175.6612 3 A 3.9257 8.5414 130.2717 54.7082 18.1377 177.5755 4 K 3.9680 8.4759 117.6715 59.5568 32.8129 177.2963 5 A 4.2098 8.6399 121.3319 55.1225 18.2360 179.9080 6 G 3.6065 8.4005 104.4802 47.6973 0.0000 175.3932 7 E 2.5400 7.5080 120.4839 58.7632 29.8646 178.5490 8 A 4.0463 7.6271 120.7674 55.1218 18.4757 179.6901 9 V 3.5453 7.7225 116.3178 66.1700 31.5519 177.8272 10 F 4.1669 8.2626 120.1924 60.8651 38.8515 177.1029 11 K 3.8342 7.5452 117.2751 59.4816 32.0452 178.8197 12 Q 3.9987 8.1008 118.2565 59.1855 28.6605 178.6041 13 C 3.8735 7.6164 117.0741 62.6724 27.9211 175.3605 14 M 4.8071 7.2060 119.7560 56.4871 31.4520 177.8895 15 T 3.9052 7.3451 116.5177 66.1836 68.8891 174.3949 16 C 4.6906 7.7543 114.8839 59.1391 30.8806 173.1270 17 H 5.1748 8.0931 116.0311 53.7837 31.9814 172.5821 18 R 5.0448 8.0688 118.6561 54.0553 34.0458 176.9125 19 A 4.0445 8.9253 121.9291 55.3407 18.4239 179.1038 20 D 5.0953 8.0690 111.1557 53.7130 41.9333 175.8818 21 K 4.7003 7.5478 116.9783 55.1610 35.4863 175.5862 22 N 4.8636 8.5493 117.8485 53.8515 40.2217 174.4182 23 M 4.7464 8.2901 123.9331 54.4148 33.4257 177.2896 24 V 3.6805 8.9416 125.4025 66.2544 31.6973 175.8177 25 G 3.7692 7.9787 108.2116 42.2849 0.0000 170.7340 26 P 4.1627 0.0000 0.0000 61.4740 31.8619 176.1980 27 A 4.2448 8.6018 123.2084 53.2732 18.8060 177.8537 28 L 4.4686 8.5763 119.7539 54.3821 43.0243 176.7864 29 A 4.1418 8.0360 123.5570 53.3996 19.0901 178.0333 30 G 3.9868 8.9331 110.8652 45.2922 0.0000 175.6307 31 V 3.4722 7.8552 120.6669 64.1893 31.6281 176.7793 32 V 4.0216 6.9819 119.6121 63.9179 31.4403 175.9339 33 G 3.9376 9.2681 116.1820 45.1898 0.0000 172.4520 34 R 4.6517 7.6905 119.9794 53.6681 32.7622 175.2999 35 K 4.1252 8.6677 125.4252 56.7481 32.8478 176.2452 36 A 3.8290 8.4210 129.4491 52.7256 19.5911 177.7410 37 G 2.3575 8.6397 107.7905 46.3525 0.0000 174.1748 38 T 4.6116 7.6808 105.0445 60.4325 69.9461 173.3633 39 A 4.0737 8.3547 125.7295 52.4477 18.7371 177.8333 40 A 4.0665 8.6096 126.5373 53.8262 18.8823 177.8469 41 G 4.0178 9.0911 110.6265 45.1195 0.0000 173.0772 42 F 4.3253 7.6308 122.0939 56.8677 40.3177 175.1981 43 T 4.1897 7.0905 124.8152 62.4478 68.1121 174.2187 44 Y 4.6318 8.4176 124.5653 56.8340 39.2663 176.5570 45 S 4.4340 8.6843 116.8997 57.8471 65.1142 173.3789 46 P 4.2985 0.0000 0.0000 65.9773 31.1281 178.6847 47 L 4.0041 7.9546 118.2872 58.2907 41.9179 178.4055 48 N 4.4652 8.4692 117.0732 56.7671 38.9097 176.3546 49 H 4.0824 8.7364 120.0520 59.5184 30.0819 177.0860 50 N 4.3721 8.8406 118.5273 56.2773 38.3179 177.6084 51 S 4.2694 8.1291 116.7425 61.6187 62.9388 176.9986 52 G 3.8040 7.3912 108.2505 47.3155 0.0000 175.6324 53 E 3.9622 7.9116 119.6163 58.4965 29.5094 178.3204 54 A 4.4148 7.5848 118.7046 52.0330 18.9400 177.7497 55 G 4.0521 7.8047 106.0209 44.6734 0.0000 173.6589 56 L 3.5928 7.9972 123.3553 54.4410 42.7926 175.8578 57 V 4.3969 7.8228 125.6203 60.2595 34.1122 176.1286 58 W 5.0473 8.3679 129.3543 55.9265 27.0239 176.0008 59 T 4.3404 7.7108 112.5911 60.9758 70.0089 176.1679 60 A 4.0095 8.6897 124.0246 55.6449 18.1367 179.6483 61 D 4.5170 8.1054 115.0139 56.5884 41.2568 177.8007 62 N 4.8240 7.8291 116.0937 55.6758 39.1074 177.4214 63 I 3.4355 8.0754 121.3679 64.0799 36.9208 178.4486 64 V 3.5643 7.5777 118.3004 65.6819 31.6849 176.1130 65 P 4.3937 0.0000 0.0000 65.8064 31.2303 177.4273 66 Y 3.8022 7.3072 118.8836 60.6205 38.5261 178.3851 67 L 3.6635 7.9038 119.0826 57.2597 41.3849 179.2356 68 A 4.2219 7.5056 121.0407 53.4184 19.5516 177.1872 69 D 4.4357 7.6269 112.5089 51.6980 43.7754 173.8653 70 P 4.0719 0.0000 0.0000 65.1864 31.6484 177.4599 71 N 4.4496 8.1806 114.2915 56.4189 38.5699 177.2604 72 A 4.0819 8.2927 122.0438 54.9117 18.4668 179.4730 73 F 4.0890 8.6277 119.3432 61.6107 39.6136 177.4220 74 L 4.1622 8.4642 118.6248 57.8154 41.3532 179.7210 75 K 4.0521 8.2758 118.5301 59.3108 31.9754 179.3550 76 K 3.8862 8.2401 120.0268 59.1968 31.9747 178.6597 77 F 3.8474 8.0439 120.9023 61.3268 39.2581 177.1627 78 L 3.9369 8.0814 118.5495 58.0477 41.3618 179.6968 79 T 3.8113 8.1239 115.9135 66.7162 68.1827 176.6440 80 E 3.9460 7.9738 119.1769 58.7147 29.4583 178.0075 81 K 3.9995 7.1812 116.2401 56.2093 32.0341 177.3328 82 G 3.9113 8.1090 106.8692 46.2924 0.0000 174.3335 83 K 4.6832 8.0031 118.0810 55.2695 33.1632 178.5285 84 A 3.9684 8.2866 124.4547 55.2859 18.3993 179.7594 85 D 4.6236 8.0888 112.5932 54.8259 39.5582 176.6147 86 Q 4.4372 8.2361 118.1783 56.0658 29.4462 175.6775 87 A 4.6236 7.8192 120.3086 51.6154 19.3765 177.4128 88 V 3.6423 7.5158 117.4715 64.5059 32.2503 176.8531 89 G 3.8877 9.1554 113.3295 44.6401 0.0000 172.1293 90 V 4.5939 7.7344 110.3527 59.3627 35.5123 175.3266 91 T 4.4048 8.9051 112.4872 61.0154 69.5879 174.4397 92 K 4.1987 8.5474 121.2274 57.5346 33.3693 177.2885 93 M 3.2409 8.6237 120.4292 56.8028 29.3445 177.5425 94 T 4.1999 7.5398 114.0772 63.3367 69.9189 174.6784 95 F 4.9266 8.5917 126.9810 56.1242 42.5553 173.8389 96 K 4.3363 7.4343 125.1130 54.1351 34.9252 175.4315 97 L 4.2990 8.2602 124.3495 52.9387 43.5309 176.9435 98 A 3.8402 8.5528 130.0105 54.9118 18.8690 177.6698 99 N 4.3206 8.0113 115.1881 53.6881 39.6968 174.9746 100 E 3.8872 8.7480 128.9153 59.4616 29.8956 178.3040 101 Q 3.9624 8.1032 119.1299 59.3225 29.0863 178.0172 102 Q 4.0042 8.7895 119.4357 58.9806 28.7280 179.0777 103 R 3.9263 7.9304 119.0502 59.1918 30.1183 179.1970 104 K 3.9861 8.3721 118.5994 59.6148 32.0688 179.2139 105 D 4.3776 8.4694 119.6463 57.3646 40.7101 179.2372 106 V 3.7707 8.1599 120.0252 64.7992 31.2008 178.6254 107 V 3.5540 8.0076 118.7758 65.6499 31.1247 177.7847 108 A 3.9925 7.8405 119.7983 55.3725 18.5045 178.6489 109 Y 4.0382 8.1401 117.9701 60.7840 38.8586 178.1741 110 L 3.7180 8.3251 120.0341 57.6506 41.4616 179.3044 111 A 4.0507 7.4995 119.9696 54.5077 17.0494 178.8595 112 T 3.9959 7.5124 107.2562 62.8728 68.9578 176.5762 113 L 3.9462 7.3624 121.7168 56.8842 42.0616 176.8923 114 K 4.0451 7.2622 122.5530 56.6036 32.3692 175.2226 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 D 8.22 4.56 0.00 2.70 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 3 A 8.54 3.93 1.45 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 0.00 0.00 4 K 8.48 3.97 0.00 1.88 1.90 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.54 7.81 5 A 8.64 4.21 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 6 G 8.40 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 0.00 0.00 0.00 0.00 7 E 7.51 2.54 0.00 1.60 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 2.11 1.98 0.00 8 A 7.63 4.05 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 9 V 7.72 3.55 2.23 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 1.06 0.00 0.00 0.93 0.00 0.00 10 F 8.26 4.17 0.00 3.06 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 11 K 7.55 3.83 0.00 1.89 1.81 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.61 7.81 12 Q 8.10 4.00 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 13 C 7.62 3.87 0.00 2.26 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 14 M 7.21 4.81 0.00 1.84 2.08 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.35 0.00 15 T 7.35 3.91 4.00 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 16 C 7.75 4.69 0.00 2.68 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 17 H 8.09 5.17 0.00 3.01 3.05 0.00 5.55 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.07 5.04 0.00 2.01 1.84 0.00 3.33 0.00 0.00 3.38 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 19 A 8.93 4.04 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 20 D 8.07 5.10 0.00 2.66 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 21 K 7.55 4.70 0.00 1.82 1.74 0.00 1.59 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.48 7.81 22 N 8.55 4.86 0.00 2.83 2.99 0.00 0.00 6.72 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 23 M 8.29 4.75 0.00 1.90 1.54 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.76 0.00 24 V 8.94 3.68 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 0.76 0.00 0.00 0.91 0.00 0.00 25 G 7.98 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 0.00 0.00 0.00 26 P 0.00 4.16 0.00 1.96 0.89 0.00 3.39 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.64 0.00 27 A 8.60 4.24 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 28 L 8.58 4.47 0.00 1.82 1.69 0.80 0.27 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 29 A 8.04 4.14 1.29 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 0.00 0.00 30 G 8.93 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 31 V 7.86 3.47 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 0.63 0.00 0.00 0.86 0.00 0.00 32 V 6.98 4.02 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 33 G 9.27 3.94 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 0.00 0.00 0.00 34 R 7.69 4.65 0.00 2.13 1.91 0.00 3.14 0.00 0.00 3.12 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 35 K 8.67 4.13 0.00 1.72 1.65 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.28 1.43 7.81 36 A 8.42 3.83 0.59 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 37 G 8.64 2.36 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 0.00 38 T 7.68 4.61 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 1.22 0.00 0.00 39 A 8.35 4.07 1.44 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 40 A 8.61 4.07 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 41 G 9.09 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 42 F 7.63 4.33 0.00 3.01 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 43 T 7.09 4.19 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 1.11 0.00 0.00 44 Y 8.42 4.63 0.00 3.10 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 45 S 8.68 4.43 0.00 4.16 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 46 P 0.00 4.30 0.00 2.24 2.21 0.00 3.67 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.20 0.00 47 L 7.95 4.00 0.00 1.85 1.79 1.01 0.66 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 48 N 8.47 4.47 0.00 3.11 3.11 0.00 0.00 6.91 7.23 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 49 H 8.74 4.08 0.00 3.39 3.59 0.00 5.84 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 50 N 8.84 4.37 0.00 2.83 2.99 0.00 0.00 7.12 7.40 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 51 S 8.13 4.27 0.00 3.93 3.66 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 52 G 7.39 3.80 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 0.00 0.00 0.00 53 E 7.91 3.96 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 2.21 2.34 0.00 54 A 7.58 4.41 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.80 4.05 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 0.00 0.00 0.00 56 L 8.00 3.59 0.00 0.27 0.82 0.09 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.82 4.40 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 0.89 0.00 0.00 0.90 0.00 0.00 58 W 8.37 5.05 0.00 3.39 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 59 T 7.71 4.34 4.29 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 1.23 0.00 0.00 60 A 8.69 4.01 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 61 D 8.11 4.52 0.00 2.73 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 62 N 7.83 4.82 0.00 3.10 3.09 0.00 0.00 6.84 6.79 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 63 I 8.08 3.44 1.81 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 1.00 1.09 0.67 0.00 0.00 64 V 7.58 3.56 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 0.86 0.00 0.00 1.01 0.00 0.00 65 P 0.00 4.39 0.00 2.57 2.42 0.00 3.82 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 66 Y 7.31 3.80 0.00 2.18 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 67 L 7.90 3.66 0.00 1.81 1.64 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 68 A 7.51 4.22 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 69 D 7.63 4.44 0.00 2.62 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 70 P 0.00 4.07 0.00 2.17 2.00 0.00 3.50 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.42 0.00 71 N 8.18 4.45 0.00 2.78 2.93 0.00 0.00 6.97 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 72 A 8.29 4.08 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 F 8.63 4.09 0.00 3.33 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 74 L 8.46 4.16 0.00 1.96 1.87 1.26 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.28 4.05 0.00 1.86 1.89 0.00 1.79 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.69 1.64 7.81 76 K 8.24 3.89 0.00 1.87 1.89 0.00 1.64 0.00 0.00 1.51 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.40 7.81 77 F 8.04 3.85 0.00 2.68 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 78 L 8.08 3.94 0.00 1.79 1.90 0.99 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.12 3.81 4.31 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 1.18 0.00 0.00 80 E 7.97 3.95 0.00 1.83 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 2.26 0.00 81 K 7.18 4.00 0.00 1.64 1.66 0.00 1.57 0.00 0.00 1.37 0.00 0.00 2.47 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.83 1.07 7.81 82 G 8.11 3.91 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 0.00 0.00 0.00 83 K 8.00 4.68 0.00 1.85 1.75 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.44 7.81 84 A 8.29 3.97 1.29 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 0.00 0.00 85 D 8.09 4.62 0.00 2.80 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 86 Q 8.24 4.44 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 87 A 7.82 4.62 1.29 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 0.00 0.00 88 V 7.52 3.64 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 0.83 0.00 0.00 0.95 0.00 0.00 89 G 9.16 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 90 V 7.73 4.59 2.14 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 0.84 0.00 0.00 0.98 0.00 0.00 91 T 8.91 4.40 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 1.46 0.00 0.00 92 K 8.55 4.20 0.00 1.92 1.87 0.00 1.96 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.55 7.81 93 M 8.62 3.24 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 94 T 7.54 4.20 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 95 F 8.59 4.93 0.00 2.84 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 96 K 7.43 4.34 0.00 1.43 1.55 0.00 1.79 0.00 0.00 1.56 0.00 0.00 2.73 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.14 1.20 7.81 97 L 8.26 4.30 0.00 1.66 1.44 1.01 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.55 3.84 1.23 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 99 N 8.01 4.32 0.00 2.75 2.83 0.00 0.00 6.82 7.65 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 0.00 100 E 8.75 3.89 0.00 2.07 1.93 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 2.38 2.37 0.00 101 Q 8.10 3.96 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.67 0.00 0.00 0.00 0.00 0.00 2.43 2.68 0.00 102 Q 8.79 4.00 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 103 R 7.93 3.93 0.00 2.05 1.97 0.00 3.34 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 104 K 8.37 3.99 0.00 1.93 1.87 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.48 1.66 7.81 105 D 8.47 4.38 0.00 2.73 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 0.00 106 V 8.16 3.77 2.22 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 1.03 0.00 0.00 1.20 0.00 0.00 107 V 8.01 3.55 2.28 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 1.00 0.00 0.00 0.95 0.00 0.00 108 A 7.84 3.99 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 0.00 109 Y 8.14 4.04 0.00 3.22 3.12 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 0.00 110 L 8.33 3.72 0.00 1.81 1.62 0.87 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.50 4.05 1.23 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 0.00 112 T 7.51 4.00 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 1.11 0.00 0.00 113 L 7.36 3.95 0.00 1.59 1.60 0.63 0.29 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 0.00 114 K 7.26 4.05 0.00 1.58 1.55 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.34 7.81