NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3146 8.3044 118.1975 54.5354 32.4618 174.5282 2 D 4.1991 8.5371 120.2066 53.4188 40.9408 174.0846 3 I 4.5398 8.1214 118.8446 59.6717 41.1907 172.9477 4 D 4.9970 8.4705 121.8484 52.4140 42.8908 173.8062 5 P 4.7609 0.0000 0.0000 62.8343 31.4148 176.4377 6 Y 4.7333 7.8444 115.8967 58.4243 40.9188 177.3880 7 K 3.9701 8.5384 119.7308 59.0472 32.2030 176.9415 8 E 4.0302 8.3110 117.7405 58.1158 30.2146 176.2204 9 F 4.8391 9.9801 118.2919 58.1989 39.7138 175.5110 10 G 3.9797 8.5498 104.3420 46.0619 0.0000 172.6944 11 A 4.8166 7.9287 120.0598 50.2178 22.0881 175.6126 12 T 4.6487 7.6377 112.3890 59.8906 70.8498 175.4379 13 V 2.9784 8.2432 124.5827 64.7159 31.2637 178.4938 14 E 3.6738 8.1815 120.4207 58.3843 29.3665 178.1058 15 L 4.2355 7.2380 118.6915 55.2100 42.1115 176.5464 16 L 4.7277 8.9078 116.7630 54.7461 43.2961 178.0595 17 S 4.1944 7.7799 113.3277 60.4721 61.8102 174.3923 18 F 3.6926 8.1958 116.0279 61.5042 39.1521 175.1069 19 L 4.2473 8.1055 121.6211 54.7472 42.3419 176.0225 20 P 4.4588 0.0000 0.0000 62.9313 31.9584 176.2213 21 S 4.4437 9.1981 119.7635 62.0148 63.1805 175.6665 22 D 4.8373 7.9024 119.4629 52.2378 37.5611 174.0922 23 F 4.7036 7.9850 125.5154 60.2504 43.9130 174.4698 24 F 3.8856 8.2654 118.7245 56.7968 38.9312 173.5610 25 P 4.3438 0.0000 0.0000 62.3987 32.0944 176.2786 26 S 4.1304 8.7843 115.2646 59.0090 63.4475 175.1151 27 V 3.4387 8.8033 123.8177 66.5389 31.1437 177.9735 28 R 3.8830 8.0756 117.6143 59.7775 29.8276 177.3138 29 D 4.3919 8.0192 117.9626 57.6922 40.9171 178.6323 30 L 4.0106 8.0217 118.4236 58.0724 41.1427 179.0876 31 L 3.9110 8.4017 118.6800 58.3418 41.4909 179.2277 32 D 4.4685 7.9572 117.1019 58.7931 41.2187 178.8112 33 T 3.6964 8.3545 114.0104 67.7022 68.5690 175.6686 34 A 3.9334 8.7185 119.0878 56.5378 18.4511 178.8467 35 A 4.1577 8.0088 121.3983 53.6258 19.0155 178.2899 36 A 4.6541 7.3532 118.5789 51.5766 20.6605 176.6972 37 L 4.0761 7.4301 123.4909 57.4560 47.3970 174.7842 38 Y 4.9478 7.8334 113.9727 58.1229 40.4661 176.5060 39 R 3.9545 8.5381 122.6276 59.8567 30.0395 178.3304 40 D 4.3918 8.1228 115.0286 56.9090 41.1050 177.5508 41 A 4.2712 8.0734 119.8875 53.8057 18.7629 177.5923 42 L 4.6523 7.9284 114.0598 55.7734 44.2613 178.3291 43 E 4.3915 8.0261 113.8913 56.9749 28.9511 176.7760 44 S 4.4640 7.7765 114.2992 57.3057 63.0365 172.5353 45 P 4.4343 0.0000 0.0000 63.4668 31.6124 175.9677 46 E 4.3913 7.9111 119.4972 55.0610 30.4970 177.0432 47 H 4.5770 8.9115 123.9859 57.4395 27.5592 177.2937 48 A 3.5785 6.3340 123.5648 55.1201 19.8729 177.2882 49 S 4.5915 7.8456 109.7427 56.5045 66.3101 176.2603 50 P 4.1918 0.0000 0.0000 66.7371 30.6383 178.2111 51 H 3.9380 8.3265 113.3576 59.7103 28.5231 176.4454 52 H 3.8518 8.2461 115.7218 59.6561 28.5460 177.5515 53 T 3.8592 7.6309 116.3301 67.6573 68.7663 175.3229 54 A 3.6661 8.9940 120.8438 55.8266 17.9842 180.5637 55 L 3.0667 8.2990 110.1214 54.8423 42.2521 180.8932 56 R 3.8701 7.7800 117.6408 59.0264 30.5206 178.4368 57 Q 3.9701 8.2440 117.7681 59.2064 28.7491 179.3808 58 A 3.8396 8.7358 122.4501 55.1719 17.8366 179.5063 59 I 3.7907 7.7219 117.4632 64.7314 37.2877 178.5771 60 L 4.3335 8.3253 119.5664 57.8683 41.1397 179.4812 61 A 4.1225 8.2721 120.6664 54.8016 18.1810 179.3662 62 W 4.5656 8.7960 127.2330 60.2425 30.6714 178.6128 63 G 3.6459 9.7072 105.9205 47.2872 0.0000 174.9631 64 D 4.5419 8.1465 120.4012 55.9678 40.7051 178.4506 65 L 3.9467 6.9011 120.2638 57.3576 41.8424 178.2987 66 M 3.9911 7.4187 115.4528 56.5799 32.1320 177.5515 67 T 4.3282 7.1724 113.6747 63.7743 69.7901 175.4715 68 L 4.2327 7.0796 121.6589 57.1401 42.8982 178.0578 69 A 3.9608 9.2060 120.8728 54.5437 18.9289 178.0934 70 T 4.6711 7.6008 108.3431 60.1539 68.1676 174.9742 71 W 4.9215 8.1821 126.3845 58.8618 35.8654 174.9987 72 V 4.2009 7.6401 115.3637 63.6960 31.2658 176.0407 73 G 4.0232 7.7612 105.5207 46.6526 0.0000 174.6496 74 T 4.0055 7.5454 116.1928 65.8999 68.9691 176.4150 75 N 4.5828 6.6943 116.8010 52.5044 39.0178 175.9973 76 L 4.1935 7.2667 113.4494 54.4184 45.6099 175.4677 77 E 4.8395 8.4339 125.2496 55.3091 31.1929 175.8474 78 D 4.5602 8.4249 125.2313 55.8080 39.8143 178.4721 79 P 4.5994 0.0000 0.0000 63.2307 33.4872 176.1773 80 A 4.4902 8.4415 120.9458 53.5658 19.0695 178.1484 81 S 4.7830 7.9411 111.3088 59.5287 63.8214 174.9861 82 R 4.3093 8.0957 115.1922 57.3481 29.7085 176.8394 83 D 4.7998 7.7325 118.5489 55.1944 42.3981 177.4661 84 L 4.2593 7.6882 119.8466 56.8809 42.1889 178.9081 85 V 3.6755 7.7941 112.3140 64.7945 31.6557 177.4840 86 V 3.9897 7.5438 114.0696 63.7218 31.1701 176.5010 87 S 4.7779 7.9688 111.2612 58.8989 62.5483 173.2995 88 Y 4.5791 7.7333 119.7133 59.1136 40.6229 176.7043 89 V 3.3478 7.3765 119.2426 65.2961 31.6152 176.5995 90 N 4.6613 7.2723 113.0208 54.7650 38.9308 175.4292 91 T 4.3989 7.6648 114.0335 64.5398 70.8093 174.9893 92 N 4.7171 8.8428 117.4501 53.4569 40.1168 175.7397 93 V 4.2160 7.1024 118.3836 63.0832 33.1233 177.7311 94 G 3.8371 8.6891 107.3452 46.7769 0.0000 175.2491 95 L 3.9392 7.6931 122.5408 58.0413 42.2627 178.7945 96 K 4.2591 7.7756 119.1802 58.8491 32.5664 178.0738 97 F 4.2657 8.5440 118.5653 58.7250 39.1393 177.9663 98 R 3.9229 7.3829 118.4425 57.9120 30.0602 178.3417 99 Q 3.0498 8.9096 114.7409 59.0189 27.9110 179.3348 100 L 3.5762 5.8960 126.0476 59.3132 43.3077 177.6772 101 L 3.4186 7.4406 120.5806 57.8988 42.5741 178.7256 102 W 4.2760 9.3595 128.1002 60.8187 30.6122 180.1066 103 F 2.5352 9.4968 113.3293 57.7579 41.0482 177.6721 104 H 2.9745 7.2488 109.5890 58.3687 29.0371 178.2033 105 I 3.3343 6.8424 125.2847 64.6984 37.7170 177.2039 106 S 3.8919 7.4258 115.4955 61.7511 62.5190 176.3022 107 A 3.3625 7.2140 124.0261 54.7186 18.0648 178.2442 108 L 4.1503 7.3427 116.8551 55.9023 42.2413 177.0246 109 T 4.5890 8.8219 111.7571 64.0178 72.1854 174.3136 110 F 4.6039 7.6978 117.7152 55.9927 41.0575 170.9533 111 G 3.8104 8.0900 118.6107 45.2005 0.0000 174.9123 112 R 3.7113 8.5794 122.7892 59.5898 29.3280 177.8896 113 E 3.9712 8.3243 119.3937 59.4460 29.3469 179.5937 114 T 3.9911 7.5703 113.5446 66.3551 68.3154 176.6508 115 V 3.7834 7.9973 120.8172 65.7666 31.6541 177.5824 116 L 4.1320 7.9993 118.1897 58.2067 41.3704 179.2312 117 E 4.1547 8.0573 116.2999 59.1315 29.4868 177.8612 118 Y 4.2489 9.5212 121.5033 58.3568 38.5690 176.9899 119 L 4.1800 8.1021 118.8271 58.6893 42.0197 179.3693 120 V 3.9704 7.8828 115.7166 66.8481 31.8558 177.5410 121 S 4.3831 8.1001 114.2102 61.8989 62.7515 176.9405 122 F 4.3127 8.9018 123.4807 61.1384 38.9735 177.9505 123 G 4.2927 9.4688 101.4912 45.3895 0.0000 173.6947 124 V 4.3367 9.1210 121.0164 63.8683 35.3418 177.0146 125 W 4.2702 7.8570 127.8732 60.2134 30.6566 176.7032 126 I 3.8002 7.6436 117.6429 63.4419 37.8394 177.4456 127 R 3.9734 7.1840 116.1912 57.7070 30.0485 176.4686 128 T 4.2840 8.1519 116.9700 61.0195 69.3922 172.8807 129 P 3.9591 0.0000 0.0000 63.4294 31.4656 175.7253 130 P 3.6090 0.0000 0.0000 65.1119 32.4041 177.6696 131 A 3.9566 7.7374 122.9567 55.6851 18.5301 177.9756 132 Y 4.6086 7.5572 109.8152 58.3279 38.2029 175.5488 133 R 4.0185 7.4349 121.1184 54.3068 30.9674 174.3867 134 P 4.5418 0.0000 0.0000 61.6815 32.0801 174.9802 135 P 4.4025 0.0000 0.0000 65.7447 31.4840 176.7670 136 N 4.6565 7.9784 116.0757 50.9429 38.7201 173.4626 137 A 3.3896 7.8028 121.8130 49.1404 21.6611 173.8444 138 P 4.5411 0.0000 0.0000 62.0166 32.6728 175.2279 139 I 4.8640 7.2827 118.7149 59.8683 41.0044 174.7502 140 L 4.1790 8.5250 121.5557 54.9817 39.9801 177.1454 141 S 4.6155 8.4494 119.7029 57.1457 62.6458 175.0565 142 T 4.2981 8.2046 123.2630 61.6464 68.5266 175.9826 143 L 3.7835 7.9559 117.7658 55.4116 39.5306 173.3900 144 P 4.4973 0.0000 0.0000 62.7594 31.9265 174.1396 145 E 4.5990 8.0948 118.9519 56.3257 32.3712 174.9566 146 T 4.2000 8.3257 116.4951 63.6155 68.7608 175.0078 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 1 M 8.30 4.31 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 2 D 8.54 4.20 0.00 2.75 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 3 I 8.12 4.54 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 1.32 0.43 0.95 0.00 0.00 4 D 8.47 5.00 0.00 2.69 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 5 P 0.00 4.76 0.00 1.47 1.85 0.00 4.01 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 6 Y 7.84 4.73 0.00 3.13 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 7 K 8.54 3.97 0.00 1.77 1.92 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.50 7.81 8 E 8.31 4.03 0.00 1.94 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 1.47 2.03 0.00 9 F 9.98 4.84 0.00 3.30 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 10 G 8.55 3.98 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 0.00 0.00 0.00 11 A 7.93 4.82 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 12 T 7.64 4.65 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 1.17 0.00 0.00 13 V 8.24 2.98 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 0.81 0.00 0.00 0.84 0.00 0.00 14 E 8.18 3.67 0.00 2.05 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 0.00 2.42 2.32 0.00 15 L 7.24 4.24 0.00 1.31 1.71 0.77 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 16 L 8.91 4.73 0.00 1.43 1.60 0.33 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17 S 7.78 4.19 0.00 3.74 4.04 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 0.00 0.00 0.00 0.00 18 F 8.20 3.69 0.00 3.03 3.23 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 19 L 8.11 4.25 0.00 1.63 1.18 0.80 1.22 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 20 P 0.00 4.46 0.00 2.23 2.15 0.00 4.11 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 21 S 9.20 4.44 0.00 3.93 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 0.00 22 D 7.90 4.84 0.00 2.83 2.78 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 23 F 7.99 4.70 0.00 2.77 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 24 F 8.27 3.89 0.00 2.92 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 25 P 0.00 4.34 0.00 2.07 2.03 0.00 3.67 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 26 S 8.78 4.13 0.00 4.04 4.07 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 27 V 8.80 3.44 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 0.56 0.00 0.00 0.84 0.00 0.00 28 R 8.08 3.88 0.00 2.03 1.99 0.00 3.36 0.00 0.00 3.64 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.88 0.00 29 D 8.02 4.39 0.00 2.99 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 30 L 8.02 4.01 0.00 1.95 1.74 1.05 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.40 3.91 0.00 1.81 1.80 1.07 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.96 4.47 0.00 2.96 2.79 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 0.00 0.00 0.00 0.00 33 T 8.35 3.70 4.57 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 0.00 0.00 0.00 1.29 0.00 0.00 34 A 8.72 3.93 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 35 A 8.01 4.16 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 36 A 7.35 4.65 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 37 L 7.43 4.08 0.00 1.25 1.46 0.46 0.69 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 38 Y 7.83 4.95 0.00 3.11 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 39 R 8.54 3.95 0.00 2.11 1.98 0.00 3.19 0.00 0.00 3.35 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 40 D 8.12 4.39 0.00 2.73 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 41 A 8.07 4.27 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 42 L 7.93 4.65 0.00 1.80 1.67 1.03 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.03 4.39 0.00 1.95 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 2.37 2.56 0.00 44 S 7.78 4.46 0.00 3.99 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 45 P 0.00 4.43 0.00 2.08 2.08 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 46 E 7.91 4.39 0.00 1.93 1.84 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 2.26 2.34 0.00 47 H 8.91 4.58 0.00 3.28 3.41 0.00 5.49 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 A 6.33 3.58 0.96 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 0.00 0.00 49 S 7.85 4.59 0.00 4.01 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 50 P 0.00 4.19 0.00 2.11 2.03 0.00 3.66 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 51 H 8.33 3.94 0.00 3.14 3.19 0.00 5.66 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 H 8.25 3.85 0.00 3.40 3.34 0.00 5.85 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 T 7.63 3.86 4.43 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 0.00 0.00 1.18 0.00 0.00 54 A 8.99 3.67 1.15 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 0.00 0.00 0.00 55 L 8.30 3.07 0.00 1.81 1.41 0.68 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 56 R 7.78 3.87 0.00 2.07 1.90 0.00 3.14 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 2.05 0.00 57 Q 8.24 3.97 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.61 2.52 0.00 58 A 8.74 3.84 1.06 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 0.00 0.00 59 I 7.72 3.79 2.04 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 1.65 0.69 1.03 0.00 0.00 60 L 8.33 4.33 0.00 1.81 1.75 0.94 1.13 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 61 A 8.27 4.12 1.57 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 0.00 0.00 0.00 0.00 0.00 0.00 62 W 8.80 4.57 0.00 4.01 3.57 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 0.00 0.00 0.00 0.00 63 G 9.71 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 64 D 8.15 4.54 0.00 2.93 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 65 L 6.90 3.95 0.00 1.31 1.25 0.74 0.71 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 66 M 7.42 3.99 0.00 1.84 1.75 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.32 0.00 67 T 7.17 4.33 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 1.16 0.00 0.00 68 L 7.08 4.23 0.00 1.86 1.61 0.87 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 69 A 9.21 3.96 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 70 T 7.60 4.67 4.27 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 1.21 0.00 0.00 71 W 8.18 4.92 0.00 3.31 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 72 V 7.64 4.20 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 0.83 0.00 0.00 1.10 0.00 0.00 73 G 7.76 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 74 T 7.55 4.01 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 1.07 0.00 0.00 75 N 6.69 4.58 0.00 1.64 2.30 0.00 0.00 7.04 7.73 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 76 L 7.27 4.19 0.00 1.57 1.45 0.87 0.87 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 77 E 8.43 4.84 0.00 1.97 1.89 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 2.13 2.23 0.00 78 D 8.42 4.56 0.00 2.67 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 0.00 0.00 0.00 79 P 0.00 4.60 0.00 2.17 2.07 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 80 A 8.44 4.49 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 81 S 7.94 4.78 0.00 3.96 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 82 R 8.10 4.31 0.00 2.14 2.05 0.00 3.01 0.00 0.00 3.21 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 83 D 7.73 4.80 0.00 2.69 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 84 L 7.69 4.26 0.00 1.81 1.78 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.79 3.68 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 0.96 0.00 0.00 0.95 0.00 0.00 86 V 7.54 3.99 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 1.11 0.00 0.00 0.94 0.00 0.00 87 S 7.97 4.78 0.00 3.89 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 88 Y 7.73 4.58 0.00 3.02 3.04 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 0.00 0.00 0.00 0.00 89 V 7.38 3.35 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 1.09 0.00 0.00 90 N 7.27 4.66 0.00 2.95 2.89 0.00 0.00 6.95 7.42 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 91 T 7.66 4.40 4.35 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 1.23 0.00 0.00 92 N 8.84 4.72 0.00 2.50 2.53 0.00 0.00 7.10 7.59 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 93 V 7.10 4.22 1.72 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 0.68 0.00 0.00 0.73 0.00 0.00 94 G 8.69 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 0.00 0.00 0.00 95 L 7.69 3.94 0.00 1.67 1.58 0.95 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.78 4.26 0.00 2.06 2.05 0.00 1.81 0.00 0.00 1.94 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.67 7.81 97 F 8.54 4.27 0.00 3.04 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 98 R 7.38 3.92 0.00 1.93 1.84 0.00 3.52 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 99 Q 8.91 3.05 0.00 1.87 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.47 0.00 0.00 0.00 0.00 0.00 1.32 1.61 0.00 100 L 5.90 3.58 0.00 1.60 1.42 0.61 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.44 3.42 0.00 1.96 1.67 0.60 1.02 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 0.00 102 W 9.36 4.28 0.00 3.46 3.51 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 0.00 103 F 9.50 2.54 0.00 3.09 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 0.00 104 H 7.25 2.97 0.00 2.88 2.96 0.00 5.70 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 6.84 3.33 1.84 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 1.47 0.65 1.01 0.00 0.00 106 S 7.43 3.89 0.00 3.02 3.09 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 0.00 0.00 0.00 107 A 7.21 3.36 0.92 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 0.00 0.00 0.00 0.00 0.00 108 L 7.34 4.15 0.00 1.53 1.52 0.60 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 109 T 8.82 4.59 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 1.06 0.00 0.00 110 F 7.70 4.60 0.00 2.81 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.09 3.81 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 0.00 0.00 0.00 112 R 8.58 3.71 0.00 2.12 2.29 0.00 3.19 0.00 0.00 3.41 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.82 0.00 113 E 8.32 3.97 0.00 2.02 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 2.44 2.40 0.00 114 T 7.57 3.99 4.77 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 1.32 0.00 0.00 115 V 8.00 3.78 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 0.85 0.00 0.00 0.77 0.00 0.00 116 L 8.00 4.13 0.00 1.79 1.79 1.01 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.06 4.15 0.00 2.26 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 0.00 2.39 2.39 0.00 118 Y 9.52 4.25 0.00 3.14 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 0.00 119 L 8.10 4.18 0.00 1.91 1.63 1.06 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.88 3.97 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 0.93 0.00 0.00 1.03 0.00 0.00 121 S 8.10 4.38 0.00 4.07 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 0.00 122 F 8.90 4.31 0.00 3.49 3.53 0.00 0.00 0.00 0.00 0.00 0.00 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 9.47 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 0.00 0.00 0.00 0.00 124 V 9.12 4.34 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 0.95 0.00 0.00 1.07 0.00 0.00 125 W 7.86 4.27 0.00 3.10 2.79 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 0.00 0.00 0.00 0.00 126 I 7.64 3.80 1.95 0.00 0.00 1.00 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 1.26 1.05 0.00 0.00 127 R 7.18 3.97 0.00 1.95 1.88 0.00 3.18 0.00 0.00 3.11 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 128 T 8.15 4.28 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 1.05 0.00 0.00 129 P 0.00 3.96 0.00 2.00 1.85 0.00 3.57 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.05 0.00 130 P 0.00 3.61 0.00 2.07 1.86 0.00 3.47 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 131 A 7.74 3.96 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 0.00 132 Y 7.56 4.61 0.00 3.01 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 0.00 133 R 7.43 4.02 0.00 1.71 1.60 0.00 2.59 0.00 0.00 2.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.61 0.00 134 P 0.00 4.54 0.00 2.63 2.10 0.00 3.15 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.07 0.00 135 P 0.00 4.40 0.00 2.23 2.22 0.00 3.84 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 2.06 1.99 0.00 136 N 7.98 4.66 0.00 2.82 2.87 0.00 0.00 5.80 7.26 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 0.00 137 A 7.80 3.39 0.08 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 0.00 0.00 138 P 0.00 4.54 0.00 1.81 1.85 0.00 2.84 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.86 0.00 139 I 7.28 4.86 1.87 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.51 0.99 0.00 0.00 140 L 8.53 4.18 0.00 1.48 0.80 0.79 0.45 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 0.00 141 S 8.45 4.62 0.00 4.01 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 0.00 142 T 8.20 4.30 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 0.93 0.00 0.00 143 L 7.96 3.78 0.00 1.83 1.90 0.98 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 144 P 0.00 4.50 0.00 2.06 2.01 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.08 0.00 145 E 8.09 4.60 0.00 1.89 1.80 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 2.20 2.31 0.00 146 T 8.33 4.20 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