NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3043 8.3349 115.4131 58.2596 64.6910 174.7885 2 N 3.8887 8.1700 120.0539 53.8847 37.6299 171.7051 3 I 4.3252 8.0329 120.2888 61.7268 38.9609 174.3014 4 I 4.7042 8.7113 117.3198 62.2343 43.9860 176.0963 5 K 4.2457 8.0337 118.9467 57.9760 32.7296 177.8992 6 Q 4.0965 8.1067 116.2178 59.2350 28.9336 177.9825 7 L 4.0360 8.0175 118.1084 57.5079 42.3311 176.9424 8 E 4.6776 7.8637 120.3047 54.3127 28.8023 173.6998 9 Q 4.4807 9.2175 120.0215 56.2986 32.2145 176.2424 10 E 4.4858 7.7745 112.3548 55.5886 32.6837 176.9522 11 Q 4.1154 8.0274 116.7557 57.3901 28.4383 177.6561 12 M 3.9144 7.6003 119.3502 57.9858 31.9803 176.0439 13 K 4.5828 7.8739 119.0274 54.8184 35.4495 176.7244 14 Q 4.0634 8.8032 123.9511 57.9384 28.8898 175.8997 15 D 4.6930 7.0366 115.8940 50.4428 38.7071 175.2577 16 V 3.5210 8.0890 125.4254 61.9349 31.6713 175.1659 17 P 4.2326 0.0000 0.0000 62.3653 31.7539 176.0165 18 S 4.1551 7.4218 111.6503 56.7704 64.5834 175.2904 19 F 3.8977 7.4642 117.0965 57.9481 36.4982 175.6858 20 R 4.0644 7.5083 121.0758 58.2341 30.2730 174.5958 21 P 4.8940 0.0000 0.0000 61.0308 33.4661 175.3835 22 G 4.1635 8.9383 109.9928 45.8589 0.0000 172.8239 23 D 4.7499 7.8263 118.7688 53.5760 44.2301 175.2454 24 T 3.5761 8.4788 119.2767 63.1597 65.8479 172.8540 25 V 3.6994 7.3003 121.1937 63.8991 32.3724 176.7493 26 E 4.0947 8.4059 122.8224 57.5486 28.4513 175.3021 27 V 3.8201 7.1744 110.1089 61.3021 33.0508 176.0901 28 K 4.6625 8.1371 122.2925 55.6098 33.8301 176.2007 29 V 3.7286 8.2956 119.8833 58.8802 35.0657 176.2692 30 W 3.9650 7.8116 119.4549 56.8897 29.0925 175.9333 31 V 3.7692 8.1647 120.7440 62.6712 31.1339 176.7337 32 V 3.4700 8.9120 128.1171 66.1785 31.2712 178.2490 33 E 3.5463 9.2225 119.6534 53.8805 29.9583 174.2026 34 G 4.6299 8.5383 127.0700 45.3414 0.0000 171.7943 35 S 4.0964 8.3709 122.4729 60.8354 62.3359 175.9983 36 K 3.9196 8.1729 114.6011 57.0120 29.0765 175.4985 37 K 4.4088 7.3660 115.1529 56.2945 35.0968 176.6014 38 R 4.4754 8.1784 119.0196 57.8001 33.0913 177.4406 39 L 4.6776 7.3376 115.5464 53.9441 43.0965 177.4606 40 Q 3.1251 8.9884 113.4487 55.9172 28.1848 174.1832 41 A 3.5187 7.6991 120.7737 52.4700 18.3313 175.6794 42 F 5.6120 7.9673 113.7853 56.1501 42.7243 175.4417 43 E 4.1835 9.7079 122.6533 57.3246 29.6400 174.7710 44 G 3.6653 8.2391 110.8008 45.0599 0.0000 171.8623 45 V 4.6877 7.9764 124.8119 60.2053 35.2455 174.7372 46 V 3.6631 8.5026 126.4139 62.5615 31.5645 176.6900 47 I 3.8568 8.3315 125.6835 60.6811 35.7724 175.8842 48 A 4.8471 7.5910 132.2749 50.2585 18.1775 175.3215 49 I 4.2534 7.6609 114.8714 60.8569 38.9851 177.4642 50 R 4.9161 8.5570 121.9169 54.8722 33.7725 174.6047 51 N 4.9676 8.4780 116.5707 51.8774 42.7397 175.4660 52 R 4.2740 7.8521 120.5527 55.4346 30.7195 175.9151 53 G 4.0571 6.7623 108.0890 44.8907 0.0000 170.7247 54 L 4.6502 7.2707 118.3253 54.5559 43.7747 174.4114 55 H 4.0793 9.4748 114.2141 56.2417 28.1541 174.5860 56 S 3.7614 8.3846 106.1440 58.6575 60.7521 171.5200 57 A 4.3139 8.0751 125.0475 53.2093 23.1473 178.6384 58 F 4.1734 8.1323 111.8542 60.0449 38.3248 177.2622 59 T 4.0556 7.2757 110.3916 63.6112 68.6811 176.0706 60 V 4.1232 7.6294 115.0677 61.1859 31.1635 177.1955 61 R 4.3609 7.9343 122.9652 56.1996 28.9100 174.8261 62 K 4.3972 8.4616 126.1838 56.3074 34.1809 175.2678 63 I 4.8689 8.5833 128.1422 59.3075 37.9979 176.1900 64 S 4.2359 9.1138 124.8735 60.9191 63.8559 174.8424 65 N 5.0390 7.8955 116.9102 52.0564 39.4781 175.1777 66 G 3.8596 8.3928 107.0288 46.8455 0.0000 175.5107 67 E 4.4371 8.1440 120.7800 53.8385 30.2414 178.3380 68 G 4.4834 7.9823 115.0165 47.3880 0.0000 174.7489 69 V 3.7434 8.8012 113.9905 60.9607 31.4939 175.5887 70 E 3.5894 8.7572 118.8600 57.1883 27.3347 174.0791 71 R 4.6019 8.5107 116.1182 57.2865 27.3378 177.1064 72 V 4.4106 7.6357 106.7678 60.8145 33.6105 175.9051 73 F 4.5706 8.2521 123.9444 58.8067 38.5642 173.5338 74 Q 5.1668 8.6690 124.2630 54.5805 31.2707 174.4097 75 T 4.7249 8.3296 115.4142 60.7664 71.3008 173.6804 76 H 4.5160 9.0358 125.4723 55.0407 28.7588 174.9396 77 S 4.1992 8.6010 120.7439 60.6427 62.6918 173.2919 78 P 4.1663 0.0000 0.0000 64.1239 30.7175 177.9286 79 V 3.7036 8.7744 123.4523 64.0319 31.9931 174.2993 80 V 3.9503 7.5568 112.4293 63.8567 31.5283 175.0359 81 D 4.7119 7.2748 117.6707 52.0228 42.0668 175.1309 82 S 4.0855 8.8241 112.4983 60.4350 63.5449 174.6312 83 I 3.2092 7.5899 121.4680 62.6043 34.2343 173.9198 84 S 4.3240 7.5734 117.7599 58.3860 63.6523 173.2820 85 V 3.9881 8.1188 122.7789 63.4930 32.8126 177.3116 86 K 3.9345 7.6881 113.2336 57.6380 28.6321 175.0939 87 R 4.3015 7.6776 130.6980 55.6590 29.2436 177.5740 88 R 4.0699 7.7995 118.3251 57.7387 31.1764 175.6115 89 G 3.9290 7.2107 102.2679 45.9003 0.0000 171.2865 90 A 4.7987 7.5822 118.8106 50.5714 23.1256 176.0281 91 V 4.4990 8.1094 118.6345 61.0735 34.5010 174.9081 92 R 4.0481 8.5318 127.5461 56.8877 29.7705 176.5556 93 K 4.2685 8.5412 121.3643 54.8485 33.2833 179.8477 94 A 3.4413 7.7879 118.1425 53.9707 18.9882 178.1932 95 K 4.0631 7.6199 113.8132 56.2886 33.4615 180.2065 96 L 3.1546 7.4992 116.3367 55.4003 41.3932 174.1118 97 Y 4.4171 7.6232 122.6149 58.9285 39.4017 175.7848 98 Y 5.0077 7.7624 115.1277 56.9562 39.9630 175.3190 99 L 4.3058 7.8458 120.0409 55.8398 41.1733 176.7472 100 R 4.3386 8.4013 114.6374 55.6307 30.4573 177.9502 101 E 3.8047 8.3094 116.7867 56.6806 27.2239 175.7089 102 R 4.0845 7.4453 113.7791 57.1833 29.3115 176.4062 103 T 3.8222 7.5555 115.8324 64.4437 67.8440 173.7808 104 G 3.8704 8.5705 115.1742 45.7531 0.0000 172.2763 105 K 4.4473 7.6104 119.2659 55.0705 34.1288 175.5560 106 A 4.4783 7.9523 118.5756 53.1549 24.1289 177.7345 107 A 4.0595 8.2804 119.0720 54.4670 18.5694 178.0659 108 R 4.4143 7.5445 113.0707 54.2970 30.8584 174.7737 109 I 3.7687 8.2284 124.6674 61.0808 37.6711 177.6291 110 K 4.2979 8.4083 126.9925 56.0288 30.4661 176.7125 111 E 4.5018 8.0793 124.1221 55.5058 31.6701 176.4522 112 R 4.0668 8.3535 115.6765 55.7997 30.5983 176.5930 113 L 4.2560 8.6710 123.8226 54.8416 42.6104 176.8288 114 N 4.6615 8.5734 118.8996 53.0288 37.1013 174.2505 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 S 8.33 4.30 0.00 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 0.00 2 N 8.17 3.89 0.00 2.94 2.89 0.00 0.00 7.19 6.57 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 3 I 8.03 4.33 1.87 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 0.35 0.91 0.00 0.00 4 I 8.71 4.70 1.88 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 1.30 0.41 0.92 0.00 0.00 5 K 8.03 4.25 0.00 1.77 1.90 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.45 7.81 6 Q 8.11 4.10 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.06 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 7 L 8.02 4.04 0.00 1.60 1.69 0.92 0.82 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 8 E 7.86 4.68 0.00 1.94 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 2.21 2.30 0.00 9 Q 9.22 4.48 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.53 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 10 E 7.77 4.49 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 2.31 2.28 0.00 11 Q 8.03 4.12 0.00 2.15 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.26 0.00 12 M 7.60 3.91 0.00 1.83 1.80 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.43 0.00 13 K 7.87 4.58 0.00 1.76 1.51 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.53 1.33 7.81 14 Q 8.80 4.06 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.87 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 15 D 7.04 4.69 0.00 2.77 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 16 V 8.09 3.52 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 0.71 0.00 0.00 0.90 0.00 0.00 17 P 0.00 4.23 0.00 1.39 1.86 0.00 3.63 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.93 0.00 18 S 7.42 4.16 0.00 3.83 3.90 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 19 F 7.46 3.90 0.00 3.04 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 20 R 7.51 4.06 0.00 1.78 2.02 0.00 3.10 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 21 P 0.00 4.89 0.00 2.26 2.08 0.00 3.68 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.91 0.00 22 G 8.94 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 D 7.83 4.75 0.00 2.66 2.48 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 24 T 8.48 3.58 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 1.20 0.00 0.00 25 V 7.30 3.70 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 0.77 0.00 0.00 0.91 0.00 0.00 26 E 8.41 4.09 0.00 2.13 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 2.18 2.29 0.00 27 V 7.17 3.82 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 0.77 0.00 0.00 0.86 0.00 0.00 28 K 8.14 4.66 0.00 1.23 1.50 0.00 1.57 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.26 1.27 7.81 29 V 8.30 3.73 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 0.58 0.00 0.00 0.79 0.00 0.00 30 W 7.81 3.96 0.00 2.82 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 0.00 0.00 0.00 31 V 8.16 3.77 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 1.00 0.00 0.00 0.75 0.00 0.00 32 V 8.91 3.47 2.25 0.00 0.00 0.00 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 1.10 0.00 0.00 33 E 9.22 3.55 0.00 2.18 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 2.25 2.32 0.00 34 G 8.54 4.63 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 0.00 0.00 0.00 35 S 8.37 4.10 0.00 3.88 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 36 K 8.17 3.92 0.00 1.94 1.87 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.59 7.81 37 K 7.37 4.41 0.00 1.62 1.59 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.49 7.81 38 R 8.18 4.48 0.00 1.70 1.87 0.00 3.13 0.00 0.00 3.20 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 39 L 7.34 4.68 0.00 1.53 1.48 0.85 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.99 3.13 0.00 2.36 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.92 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 41 A 7.70 3.52 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 42 F 7.97 5.61 0.00 3.21 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 43 E 9.71 4.18 0.00 2.22 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 0.00 2.53 2.73 0.00 44 G 8.24 3.67 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 0.00 0.00 0.00 45 V 7.98 4.69 1.77 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 0.58 0.00 0.00 0.61 0.00 0.00 46 V 8.50 3.66 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 0.65 0.00 0.00 0.86 0.00 0.00 47 I 8.33 3.86 1.87 0.00 0.00 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 1.02 0.44 0.85 0.00 0.00 48 A 7.59 4.85 1.18 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 0.00 0.00 49 I 7.66 4.25 1.87 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 1.34 0.65 0.87 0.00 0.00 50 R 8.56 4.92 0.00 1.68 1.83 0.00 3.14 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 51 N 8.48 4.97 0.00 2.61 2.73 0.00 0.00 6.65 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 52 R 7.85 4.27 0.00 1.56 1.68 0.00 3.13 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.48 0.00 53 G 6.76 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 0.00 0.00 0.00 54 L 7.27 4.65 0.00 1.70 1.62 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 55 H 9.47 4.08 0.00 3.24 3.36 0.00 5.89 0.00 0.00 0.00 0.00 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.38 3.76 0.00 4.17 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 57 A 8.08 4.31 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 58 F 8.13 4.17 0.00 3.12 3.20 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 59 T 7.28 4.06 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 1.19 0.00 0.00 60 V 7.63 4.12 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 0.73 0.00 0.00 0.92 0.00 0.00 61 R 7.93 4.36 0.00 1.93 1.86 0.00 3.10 0.00 0.00 3.08 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 62 K 8.46 4.40 0.00 1.89 1.66 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.50 7.81 63 I 8.58 4.87 1.58 0.00 0.00 0.62 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 0.95 0.76 0.00 0.00 64 S 9.11 4.24 0.00 3.75 3.92 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 65 N 7.90 5.04 0.00 2.70 2.76 0.00 0.00 6.93 7.41 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 66 G 8.39 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 67 E 8.14 4.44 0.00 2.11 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 2.27 2.33 0.00 68 G 7.98 4.48 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 0.00 69 V 8.80 3.74 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 0.52 0.00 0.00 0.88 0.00 0.00 70 E 8.76 3.59 0.00 2.08 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 2.25 2.27 0.00 71 R 8.51 4.60 0.00 2.04 2.13 0.00 3.26 0.00 0.00 4.01 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 72 V 7.64 4.41 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 0.72 0.00 0.00 0.98 0.00 0.00 73 F 8.25 4.57 0.00 3.10 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 74 Q 8.67 5.17 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 75 T 8.33 4.72 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 1.22 0.00 0.00 76 H 9.04 4.52 0.00 3.19 3.25 0.00 5.83 0.00 0.00 0.00 0.00 6.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 8.60 4.20 0.00 3.88 3.92 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 78 P 0.00 4.17 0.00 2.31 2.02 0.00 3.51 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 2.11 2.10 0.00 79 V 8.77 3.70 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 1.00 0.00 0.00 0.97 0.00 0.00 80 V 7.56 3.95 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 1.07 0.00 0.00 1.06 0.00 0.00 81 D 7.27 4.71 0.00 2.85 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 82 S 8.82 4.09 0.00 4.04 4.10 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 83 I 7.59 3.21 1.87 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 1.19 0.56 0.91 0.00 0.00 84 S 7.57 4.32 0.00 3.80 3.73 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 85 V 8.12 3.99 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 0.80 0.00 0.00 0.90 0.00 0.00 86 K 7.69 3.93 0.00 1.83 2.05 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.44 7.81 87 R 7.68 4.30 0.00 1.79 1.92 0.00 3.19 0.00 0.00 3.13 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 88 R 7.80 4.07 0.00 1.76 1.94 0.00 3.31 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 89 G 7.21 3.93 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 0.00 0.00 0.00 90 A 7.58 4.80 1.21 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 0.00 0.00 0.00 91 V 8.11 4.50 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 0.87 0.00 0.00 0.98 0.00 0.00 92 R 8.53 4.05 0.00 1.65 1.91 0.00 3.20 0.00 0.00 3.36 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 93 K 8.54 4.27 0.00 1.69 1.66 0.00 1.96 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.35 7.81 94 A 7.79 3.44 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 95 K 7.62 4.06 0.00 1.78 1.77 0.00 1.87 0.00 0.00 1.83 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.60 1.48 7.81 96 L 7.50 3.15 0.00 1.03 0.13 0.88 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 7.62 4.42 0.00 2.49 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 98 Y 7.76 5.01 0.00 3.01 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 99 L 7.85 4.31 0.00 1.79 1.71 0.93 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 100 R 8.40 4.34 0.00 1.89 1.97 0.00 3.24 0.00 0.00 3.35 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 101 E 8.31 3.80 0.00 2.19 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 2.25 2.25 0.00 102 R 7.45 4.08 0.00 1.90 2.05 0.00 3.08 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 103 T 7.56 3.82 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 1.20 0.00 0.00 104 G 8.57 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 0.00 0.00 0.00 105 K 7.61 4.45 0.00 1.74 1.76 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.40 7.81 106 A 7.95 4.48 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 0.00 107 A 8.28 4.06 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 0.00 108 R 7.54 4.41 0.00 1.86 1.90 0.00 3.04 0.00 0.00 3.22 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 109 I 8.23 3.77 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 1.29 0.53 0.90 0.00 0.00 110 K 8.41 4.30 0.00 1.82 1.84 0.00 1.59 0.00 0.00 1.86 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.48 7.81 111 E 8.08 4.50 0.00 2.11 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 2.27 2.32 0.00 112 R 8.35 4.07 0.00 1.72 1.93 0.00 3.26 0.00 0.00 3.45 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.56 0.00 113 L 8.67 4.26 0.00 1.51 1.61 0.95 1.00 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 0.00 114 N 8.57 4.66 0.00 2.68 2.74 0.00 0.00 5.95 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