NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4437 8.3044 118.1952 55.1860 32.5556 174.3144 1 V 4.2330 7.8638 118.2922 60.6994 34.2402 173.4524 2 L 4.2310 8.3564 127.6821 54.2181 43.3550 177.0214 3 S 4.5343 8.5549 117.3981 57.7160 65.3903 175.1256 4 E 4.2955 8.8354 122.3193 59.4610 29.4353 179.0000 5 G 3.6496 8.0905 105.4131 47.6775 0.0000 175.4558 6 E 3.8824 8.0983 120.7738 59.0704 29.4807 179.2453 7 W 4.4656 7.9056 118.9309 60.1213 29.0479 178.6322 8 Q 4.1295 8.4305 117.7903 59.0860 28.2350 178.7686 9 L 4.0563 7.9118 119.6581 57.6838 41.5920 179.9124 10 V 3.7506 7.7895 118.1787 66.0547 31.6216 177.9948 11 L 4.3839 8.6357 118.3826 57.0530 41.1576 178.9078 12 H 4.2015 8.5475 119.1865 59.2841 29.8693 177.4181 13 V 3.7178 7.8395 119.6977 65.6639 31.3875 177.6443 14 W 3.9196 8.5366 127.9636 60.4506 30.1934 177.7701 15 A 3.9872 7.9140 119.9390 54.7450 18.0468 179.4904 16 K 3.9344 7.2479 117.6706 59.3087 32.1534 179.3619 17 V 2.7544 7.1013 118.5267 66.0064 30.9848 177.8080 18 E 3.8588 7.5120 115.5131 58.2545 29.2569 178.6603 19 A 4.1664 7.4351 120.6692 54.0497 20.0294 177.4929 20 D 4.6602 8.0467 116.4474 51.8604 42.1109 175.5300 21 V 3.4770 7.8548 122.8952 65.6898 32.0790 176.8200 22 A 4.1175 7.9917 120.1766 55.0542 18.4595 179.6802 23 G 3.9672 8.1030 105.1127 47.8704 0.0000 175.5358 24 H 4.1922 8.4237 118.9483 58.2497 28.6821 178.0380 25 G 3.7461 8.5544 108.0700 47.9634 0.0000 175.5031 26 Q 4.0010 8.1614 120.5676 58.8211 28.7287 178.5576 27 D 4.3494 7.8454 119.1812 57.6026 40.9530 179.0408 28 I 3.5118 7.5762 119.8065 64.4509 37.0700 178.6699 29 W 3.6878 7.8005 119.3271 59.4320 28.6610 178.8483 30 I 3.7980 7.8652 120.0277 64.0942 36.4523 178.3068 31 R 3.7795 8.0744 119.7965 59.2548 29.8910 178.1874 32 L 3.8761 8.0823 120.2847 58.4356 42.0010 179.0806 33 F 4.7938 8.1858 117.7331 60.4965 38.5594 177.9939 34 K 4.0377 8.2428 117.7799 59.5545 32.0149 179.3670 35 S 4.2616 8.1075 114.4507 60.5073 64.2350 174.6477 36 H 4.7963 8.4163 118.7424 52.1077 29.0108 172.0013 37 P 4.7247 0.0000 0.0000 64.6650 31.5405 177.6454 38 E 4.1405 8.2957 116.3187 59.5074 29.4465 179.1384 39 T 3.8878 8.2657 111.0946 64.5417 68.7410 176.2103 40 L 3.8750 8.0718 123.0689 57.6724 41.7743 178.5371 41 E 4.1852 8.1155 117.5763 58.6149 29.4515 178.6059 42 K 4.4339 8.2088 117.4265 56.8577 32.5792 176.7158 43 F 4.5530 8.0603 119.0507 55.4548 39.0153 176.0822 44 D 4.3604 8.5013 126.7538 56.9606 41.0067 178.4648 45 R 3.7380 7.8143 118.5526 58.2786 30.1669 176.7693 46 F 5.0023 7.3812 113.5579 56.8507 41.0176 177.1566 47 K 3.8782 8.2485 120.7712 59.8917 31.8648 177.6663 48 H 4.3395 8.1971 111.6228 57.1574 28.8306 175.2925 49 L 4.0858 7.6149 121.7647 54.8620 41.4979 176.8181 50 K 4.2431 9.4889 124.6718 57.8689 33.0598 177.4474 51 T 4.7492 7.3140 107.3069 58.8684 73.2304 174.2000 52 E 3.9434 8.6993 121.0903 59.4450 29.6832 178.7023 53 A 4.0347 7.9446 120.3653 55.2026 18.2710 179.3299 54 E 3.9769 7.8016 115.8502 59.6111 29.8317 179.1864 55 M 4.1855 8.1396 118.8670 58.3684 31.8394 178.8680 56 K 3.9428 8.2754 117.6377 59.2008 32.3358 178.4980 57 A 4.3850 7.6791 118.0657 51.7622 19.2232 177.1699 58 S 4.2708 7.4859 114.1051 57.5686 63.0366 174.5459 59 E 4.0517 8.8484 128.7261 59.0433 29.4993 178.2538 60 D 4.4253 8.0995 118.7350 57.3312 41.0647 178.1585 61 L 3.1554 7.9841 120.8073 57.8406 42.0344 178.9333 62 K 3.9289 7.8531 118.9920 59.4119 32.1356 178.9742 63 K 4.0276 8.1420 118.8615 59.7382 31.9818 178.8525 64 H 4.3509 8.4836 118.7199 59.1334 29.6457 177.5971 65 G 3.8519 8.2158 107.7594 47.7304 0.0000 175.9439 66 V 3.6539 7.7741 120.1015 66.0318 31.5436 178.1803 67 T 3.9226 8.0415 115.5477 66.6580 68.2852 176.6656 68 V 3.6921 7.9589 119.9098 66.2826 31.6672 178.1888 69 L 4.2540 8.4062 118.7976 57.9156 41.4428 179.6665 70 T 4.0343 8.2838 115.9017 66.4289 68.2272 176.6006 71 A 4.0109 8.0944 122.7965 55.0433 18.3681 179.4681 72 L 3.6828 8.1846 119.0944 58.0697 42.1424 179.1296 73 G 3.4730 8.4926 105.9076 48.0150 0.0000 175.4583 74 A 4.0542 7.8400 121.8109 54.5080 18.6397 179.7204 75 I 3.7895 7.2884 118.5989 64.6158 37.3047 178.3513 76 L 3.9810 7.7272 119.9567 57.9317 41.2088 179.6844 77 K 4.0352 7.6490 116.4590 58.3843 32.2969 179.0935 78 K 3.9040 7.8257 118.8405 56.6134 32.2862 176.8193 79 K 2.0000 8.2454 117.7919 56.5426 29.7921 175.2958 80 G 4.0505 7.9400 106.0523 46.1138 0.0000 174.1697 81 H 4.5492 7.4104 118.6714 55.6511 27.8683 175.0918 82 H 5.1029 7.6613 111.5456 54.1733 29.4801 175.8803 83 E 3.9692 8.5336 120.7310 60.3971 28.6797 179.0851 84 A 4.0315 7.9181 119.8875 54.7290 19.1687 179.0110 85 E 4.0855 8.1766 116.6753 59.3618 29.5006 179.1557 86 L 3.9238 7.9384 120.5625 57.6842 42.0909 178.9201 87 K 3.9476 7.8162 118.4979 59.1631 32.1166 177.5285 88 P 4.3699 0.0000 0.0000 65.4408 31.3219 178.1423 89 L 4.0861 7.5100 118.8699 57.9321 41.9911 178.5706 90 A 4.2523 8.4707 121.2434 55.1792 18.2459 179.4981 91 Q 3.8748 8.1881 118.3441 59.3469 29.1371 178.5321 92 S 3.9997 8.1172 115.4017 61.8612 63.0361 176.1331 93 H 4.1689 8.6292 119.5431 57.9237 28.5771 177.7268 94 A 2.6434 8.2025 123.1411 54.5117 18.0598 179.2494 95 T 3.9479 7.4736 112.1417 64.7137 69.4646 176.3124 96 K 4.0239 7.4657 120.1662 59.0023 32.7615 177.2902 97 H 4.2981 7.9390 114.7085 56.1302 29.4686 175.2506 98 K 3.3261 7.4488 116.6019 56.3237 28.1614 175.0026 99 I 4.3705 8.0331 119.0919 58.4486 38.7451 174.7787 100 P 4.6671 0.0000 0.0000 62.3632 32.0737 177.4585 101 I 3.6598 8.7595 121.9734 64.4534 36.8984 178.5161 102 K 3.6242 7.9939 120.0133 59.9671 31.9231 178.2485 103 Y 4.1348 7.9168 116.5215 60.8793 37.7682 178.3815 104 L 4.2381 7.8775 119.6200 57.4068 41.8882 179.0912 105 E 3.9865 8.1085 118.9146 59.3550 29.3903 179.2107 106 F 4.4745 7.8402 117.8273 60.8294 38.8994 177.6467 107 I 3.6986 8.0380 118.0443 63.7676 37.7059 178.0105 108 S 4.1293 8.0815 116.3924 61.5134 62.6756 176.1998 109 E 3.9714 8.2537 121.5023 59.3469 29.4486 178.7897 110 A 3.9981 7.9363 120.7975 55.0444 18.2963 179.7651 111 I 3.6285 8.0592 118.7611 64.6365 37.2083 178.7137 112 I 3.7808 7.8680 120.6919 64.5010 36.9133 178.0414 113 H 4.1160 8.3751 119.1255 59.3605 29.7726 177.6087 114 V 3.5783 7.8452 120.0548 65.9255 31.2425 178.0232 115 L 3.8229 7.9552 119.0017 57.6931 41.0339 178.8964 116 H 4.3305 7.9096 117.5621 59.3989 29.8911 177.3023 117 S 4.1705 7.8359 115.8465 61.6605 62.7711 176.4890 118 R 4.0360 7.7846 119.3228 57.7768 30.9992 176.7319 119 H 5.0637 8.3216 115.5154 53.8897 29.7772 173.2454 120 P 4.2742 0.0000 0.0000 65.9260 31.5447 179.1971 121 G 3.6788 8.1875 106.5778 47.5659 0.0000 173.6113 122 N 5.0320 8.3270 114.8266 52.9170 39.6283 174.5991 123 F 4.9256 7.9445 119.0620 56.4162 39.5950 174.2267 124 G 3.8619 7.7627 108.7955 43.9502 0.0000 172.2728 125 A 3.8779 8.4224 120.7564 55.4184 18.2177 179.5304 126 D 4.1837 7.9748 116.3736 57.5712 40.8982 178.8503 127 A 3.9176 7.7626 120.6504 55.0380 18.2941 179.3394 128 Q 3.1068 7.7658 118.4368 58.7941 29.0484 178.4211 129 G 3.5474 8.2011 106.9854 47.8268 0.0000 175.5305 130 A 3.8777 7.9376 123.1430 54.8930 18.3722 179.4111 131 M 3.9803 8.3133 117.1601 58.7570 32.2960 177.8888 132 N 4.2875 8.4676 117.5972 56.5645 39.0135 176.6192 133 K 3.8037 8.0603 120.7188 59.5212 32.2592 178.6204 134 A 3.7780 7.9353 120.9637 55.0609 18.2567 179.5952 135 L 4.1289 8.1533 117.5175 57.5854 41.6797 179.3841 136 E 3.9578 8.5501 119.1199 59.2497 29.4541 178.8572 137 L 3.9335 8.1273 120.5662 58.3006 42.0660 178.5430 138 F 4.1941 8.3546 120.3130 61.7303 39.1593 177.4248 139 R 3.4435 8.1045 117.3194 58.8462 29.8423 178.9580 140 K 3.8242 8.2360 119.7757 59.6644 32.3145 178.6808 141 D 4.3376 8.0900 119.1359 57.2847 40.6824 178.8437 142 I 3.4590 7.5969 120.3206 64.0744 37.0730 178.2921 143 A 3.7025 7.9578 121.7119 54.9775 18.2724 179.5482 144 A 3.9621 8.0234 119.2828 55.2591 18.4504 180.0880 145 K 4.0277 7.9043 116.8175 59.5652 32.0358 178.9941 146 Y 4.4105 8.5101 117.6702 61.1936 37.8471 178.8379 147 K 3.9562 8.1015 119.9183 59.7619 32.1482 178.6359 148 E 4.0369 7.9314 117.0692 59.1374 29.4671 178.5759 149 L 4.4177 7.8679 116.4549 54.8211 42.0244 177.5283 150 G 3.9518 8.0882 107.4085 45.7601 0.0000 173.3460 151 Y 4.1572 7.9915 121.2072 59.2255 40.2274 177.3333 152 Q 2.9835 7.5825 116.3932 58.4925 27.3286 174.8923 153 G 3.3278 8.7812 117.0042 45.0966 0.0000 172.4174 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 0 M 8.30 4.44 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 1 V 7.86 4.23 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 0.89 0.00 0.00 0.96 0.00 0.00 2 L 8.36 4.23 0.00 1.04 0.67 0.60 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.55 4.53 0.00 4.08 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 4 E 8.84 4.30 0.00 2.19 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 2.43 2.52 0.00 5 G 8.09 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 0.00 0.00 0.00 6 E 8.10 3.88 0.00 1.93 1.70 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 2.20 2.25 0.00 7 W 7.91 4.47 0.00 3.61 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 8 Q 8.43 4.13 0.00 2.37 2.21 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 2.45 2.75 0.00 9 L 7.91 4.06 0.00 1.88 1.75 0.88 0.63 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 10 V 7.79 3.75 2.40 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 1.19 0.00 0.00 0.93 0.00 0.00 11 L 8.64 4.38 0.00 1.83 1.81 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.55 4.20 0.00 3.45 3.54 0.00 5.78 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.84 3.72 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 0.99 0.00 0.00 1.30 0.00 0.00 14 W 8.54 3.92 0.00 3.68 3.13 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 15 A 7.91 3.99 1.37 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 0.00 0.00 0.00 16 K 7.25 3.93 0.00 1.60 1.70 0.00 1.65 0.00 0.00 1.48 0.00 0.00 2.73 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.44 7.81 17 V 7.10 2.75 0.94 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 -0.11 0.00 0.00 0.41 0.00 0.00 18 E 7.51 3.86 0.00 1.99 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 2.22 2.06 0.00 19 A 7.44 4.17 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 20 D 8.05 4.66 0.00 2.69 2.51 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 0.00 21 V 7.85 3.48 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 1.01 0.00 0.00 0.86 0.00 0.00 22 A 7.99 4.12 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 23 G 8.10 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 24 H 8.42 4.19 0.00 3.25 3.24 0.00 5.83 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.55 3.75 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 0.00 0.00 0.00 26 Q 8.16 4.00 0.00 2.34 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.69 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 27 D 7.85 4.35 0.00 2.78 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 28 I 7.58 3.51 1.84 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 1.40 0.47 0.42 0.00 0.00 29 W 7.80 3.69 0.00 3.27 2.65 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 30 I 7.87 3.80 1.97 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 1.47 0.67 0.92 0.00 0.00 31 R 8.07 3.78 0.00 1.88 2.12 0.00 3.00 0.00 0.00 2.97 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 32 L 8.08 3.88 0.00 1.45 1.41 1.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.19 4.79 0.00 3.18 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 34 K 8.24 4.04 0.00 1.77 1.86 0.00 1.71 0.00 0.00 1.84 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.71 7.81 35 S 8.11 4.26 0.00 3.76 3.58 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 36 H 8.42 4.80 0.00 2.88 2.80 0.00 5.63 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.72 0.00 2.17 2.13 0.00 3.86 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.27 0.00 38 E 8.30 4.14 0.00 2.33 2.32 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 2.38 2.60 0.00 39 T 8.27 3.89 4.55 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 0.00 0.00 0.00 0.82 0.00 0.00 40 L 8.07 3.87 0.00 1.39 1.81 0.02 0.82 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 41 E 8.12 4.19 0.00 2.35 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 2.39 2.41 0.00 42 K 8.21 4.43 0.00 1.93 1.67 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.78 1.99 7.81 43 F 8.06 4.55 0.00 3.32 2.90 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 44 D 8.50 4.36 0.00 2.57 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 45 R 7.81 3.74 0.00 1.24 0.66 0.00 2.98 0.00 0.00 2.84 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.32 0.00 46 F 7.38 5.00 0.00 2.86 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 47 K 8.25 3.88 0.00 1.82 1.94 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.70 7.81 48 H 8.20 4.34 0.00 3.29 3.45 0.00 5.53 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.61 4.09 0.00 1.56 1.58 0.87 0.91 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 50 K 9.49 4.24 0.00 1.79 1.85 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.57 7.81 51 T 7.31 4.75 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 52 E 8.70 3.94 0.00 2.06 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 2.38 2.39 0.00 53 A 7.94 4.03 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 54 E 7.80 3.98 0.00 2.16 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 2.35 2.35 0.00 55 M 8.14 4.19 0.00 2.12 2.29 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 2.76 2.61 0.00 56 K 8.28 3.94 0.00 1.92 1.87 0.00 1.84 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.45 7.81 57 A 7.68 4.39 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 58 S 7.49 4.27 0.00 3.92 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 59 E 8.85 4.05 0.00 2.13 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 0.00 2.39 2.47 0.00 60 D 8.10 4.43 0.00 2.97 3.13 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 61 L 7.98 3.16 0.00 1.16 1.57 -0.26 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.85 3.93 0.00 1.87 1.92 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.48 7.81 63 K 8.14 4.03 0.00 1.91 1.88 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.76 1.56 7.81 64 H 8.48 4.35 0.00 3.47 3.23 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.22 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 66 V 7.77 3.65 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 1.06 0.00 0.00 0.99 0.00 0.00 67 T 8.04 3.92 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 1.30 0.00 0.00 68 V 7.96 3.69 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 1.25 0.00 0.00 69 L 8.41 4.25 0.00 1.84 1.92 0.95 1.26 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 70 T 8.28 4.03 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 1.27 0.00 0.00 71 A 8.09 4.01 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 72 L 8.18 3.68 0.00 1.59 1.58 0.21 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.49 3.47 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 0.00 74 A 7.84 4.05 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 75 I 7.29 3.79 1.83 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 1.53 0.98 0.89 0.00 0.00 76 L 7.73 3.98 0.00 1.34 1.58 -0.19 1.05 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 77 K 7.65 4.04 0.00 1.67 1.80 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.48 1.53 7.81 78 K 7.83 3.90 0.00 1.86 1.79 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.59 1.84 7.81 79 K 8.25 2.00 0.00 1.24 0.74 0.00 1.47 0.00 0.00 1.42 0.00 0.00 2.73 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.36 0.81 7.81 80 G 7.94 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 81 H 7.41 4.55 0.00 3.20 3.23 0.00 5.80 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.66 5.10 0.00 3.32 3.44 0.00 5.67 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.53 3.97 0.00 2.21 2.32 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 2.40 2.37 0.00 84 A 7.92 4.03 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 85 E 8.18 4.09 0.00 2.28 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 2.41 2.44 0.00 86 L 7.94 3.92 0.00 2.11 1.69 0.93 0.60 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 87 K 7.82 3.95 0.00 2.03 1.88 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.49 7.81 88 P 0.00 4.37 0.00 2.31 2.34 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.06 0.00 89 L 7.51 4.09 0.00 1.92 1.95 0.97 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.47 4.25 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 91 Q 8.19 3.87 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 92 S 8.12 4.00 0.00 4.02 4.12 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 93 H 8.63 4.17 0.00 3.62 3.62 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.20 2.64 0.75 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 0.00 0.00 95 T 7.47 3.95 4.18 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 1.11 0.00 0.00 96 K 7.47 4.02 0.00 1.53 1.61 0.00 1.64 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.23 1.34 7.81 97 H 7.94 4.30 0.00 3.01 3.17 0.00 5.84 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.45 3.33 0.00 1.79 1.81 0.00 1.47 0.00 0.00 2.27 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.25 1.29 7.81 99 I 8.03 4.37 2.13 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.04 1.20 0.00 0.00 100 P 0.00 4.67 0.00 1.98 2.02 0.00 3.24 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.40 0.00 101 I 8.76 3.66 1.89 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.06 0.81 0.00 0.00 102 K 7.99 3.62 0.00 1.73 1.66 0.00 1.27 0.00 0.00 1.69 0.00 0.00 3.11 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.50 0.94 7.81 103 Y 7.92 4.13 0.00 3.29 3.11 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 0.00 104 L 7.88 4.24 0.00 1.82 1.77 0.74 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.11 3.99 0.00 2.09 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 2.31 2.41 0.00 106 F 7.84 4.47 0.00 3.11 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 0.00 107 I 8.04 3.70 1.78 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.11 0.97 0.00 0.00 108 S 8.08 4.13 0.00 4.23 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 0.00 109 E 8.25 3.97 0.00 2.17 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 0.00 2.35 2.39 0.00 110 A 7.94 4.00 1.28 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 0.00 0.00 0.00 111 I 8.06 3.63 2.03 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.55 0.99 0.00 0.00 112 I 7.87 3.78 2.09 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.88 1.10 0.00 0.00 113 H 8.38 4.12 0.00 3.38 3.46 0.00 5.78 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 7.85 3.58 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 0.90 0.00 0.00 0.95 0.00 0.00 115 L 7.96 3.82 0.00 0.39 0.72 0.76 0.79 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 0.00 116 H 7.91 4.33 0.00 3.43 3.55 0.00 5.95 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 0.00 117 S 7.84 4.17 0.00 3.80 3.83 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 0.00 118 R 7.78 4.04 0.00 1.64 1.49 0.00 2.80 0.00 0.00 2.95 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.49 0.00 119 H 8.32 5.06 0.00 3.17 3.18 0.00 5.63 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.27 0.00 2.20 2.27 0.00 3.74 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.94 0.00 121 G 8.19 3.68 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 0.00 0.00 0.00 122 N 8.33 5.03 0.00 2.76 2.93 0.00 0.00 6.68 7.39 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 0.00 123 F 7.94 4.93 0.00 2.99 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 0.00 124 G 7.76 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 0.00 0.00 0.00 125 A 8.42 3.88 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 0.00 126 D 7.97 4.18 0.00 2.64 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 0.00 127 A 7.76 3.92 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 0.00 128 Q 7.77 3.11 0.00 1.23 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 129 G 8.20 3.55 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 7.94 3.88 1.28 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 0.00 0.00 0.00 131 M 8.31 3.98 0.00 2.38 2.39 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.89 0.00 132 N 8.47 4.29 0.00 2.89 2.95 0.00 0.00 6.87 6.70 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 0.00 133 K 8.06 3.80 0.00 1.95 1.67 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.37 7.81 134 A 7.94 3.78 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 0.00 135 L 8.15 4.13 0.00 1.75 1.80 0.96 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 0.00 136 E 8.55 3.96 0.00 2.12 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 2.33 2.55 0.00 137 L 8.13 3.93 0.00 1.83 1.97 1.03 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.35 4.19 0.00 3.11 3.28 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 0.00 139 R 8.10 3.44 0.00 2.01 1.83 0.00 3.15 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.81 0.00 140 K 8.24 3.82 0.00 1.76 1.91 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.44 7.81 141 D 8.09 4.34 0.00 2.70 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 0.00 142 I 7.60 3.46 1.28 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 -0.36 0.11 0.00 0.00 143 A 7.96 3.70 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 0.00 144 A 8.02 3.96 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 0.00 145 K 7.90 4.03 0.00 2.09 1.94 0.00 1.59 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.55 7.81 146 Y 8.51 4.41 0.00 3.20 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 0.00 147 K 8.10 3.96 0.00 2.03 1.95 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 1.45 1.49 7.81 148 E 7.93 4.04 0.00 2.21 2.03 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 2.37 2.54 0.00 149 L 7.87 4.42 0.00 1.79 1.70 0.98 0.82 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 0.00 150 G 8.09 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 0.00 151 Y 7.99 4.16 0.00 2.58 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 0.00 152 Q 7.58 2.98 0.00 2.14 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.93 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 153 G 8.78 3.33 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 0.00