NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2421 8.2033 119.6894 55.9126 30.8135 174.7547 2 D 4.2063 8.0961 117.0549 54.7780 41.0222 175.6836 3 N 4.5879 8.7600 126.3606 55.0291 40.2590 175.7779 4 S 4.1939 7.3396 113.9301 60.8217 62.7316 176.9078 5 R 3.6857 7.8807 122.2465 59.2988 29.9123 177.3513 6 Y 4.5456 8.3972 120.9149 60.5830 38.5215 178.3387 7 T 3.6784 7.9494 109.6689 64.6426 68.7126 175.8588 8 H 4.3144 7.9540 119.9241 58.6903 28.6339 177.1878 9 F 4.1574 8.1621 122.2654 61.4415 39.3112 176.9043 10 L 3.9333 8.1329 118.5887 58.4518 41.2082 179.9506 11 T 3.9250 7.6469 114.0414 66.2777 68.4817 176.1906 12 Q 4.1755 7.9275 118.0007 56.9951 29.3527 176.0417 13 H 4.6391 8.1864 114.4200 54.8804 32.0733 171.9305 14 Y 5.1422 8.2245 120.1572 55.7892 41.3774 174.6331 15 D 4.2561 8.9256 125.3604 52.3474 43.5620 175.5018 16 A 3.9024 8.0846 129.0187 54.6934 18.4384 177.4937 17 K 4.6632 7.3528 116.6600 53.6117 32.7899 174.5197 18 P 4.4271 0.0000 0.0000 62.2348 32.0443 175.8254 19 Q 4.0032 7.8684 117.4634 56.0001 29.3325 175.8798 20 G 3.8748 7.8612 109.0382 44.9154 0.0000 174.8846 21 R 3.6418 8.0858 125.6877 54.6219 28.8749 174.7618 22 D 4.9467 7.2979 120.9887 51.3116 43.8560 176.6171 23 D 4.5568 8.6302 118.2009 58.1120 40.6941 179.5257 24 R 3.9669 8.0326 117.6602 59.2083 30.0315 178.1765 25 Y 4.0301 8.0478 119.3960 60.9228 38.6827 177.5672 26 C 3.9262 8.2366 117.1428 60.0469 34.6082 175.7355 27 E 4.0681 8.1353 120.1622 59.7916 29.0847 179.9028 28 S 4.0748 8.0434 113.9660 61.3514 63.1664 176.1568 29 I 3.4936 7.4337 122.0354 63.2650 37.6533 177.7851 30 M 3.9979 7.9869 120.3715 58.3588 31.8874 178.6510 31 R 3.9295 7.7500 118.4903 59.3334 30.0478 178.5023 32 R 4.0412 8.1787 117.9659 58.5293 30.0393 177.6277 33 R 4.4625 7.6972 116.0308 55.3879 30.6465 177.5563 34 G 3.9650 7.7899 106.5318 45.9710 0.0000 175.0215 35 L 4.1554 7.7305 119.0638 55.3596 41.2614 177.6707 36 T 4.5738 7.7201 111.4363 61.6593 67.5860 175.0345 37 S 4.2828 8.1926 114.8975 61.4514 62.7822 172.9782 38 P 4.5671 0.0000 0.0000 60.7758 32.8004 175.6720 39 C 4.3936 8.5323 119.1726 57.0518 38.9979 173.8392 40 K 4.1880 8.7723 127.0853 56.3705 32.2721 177.4677 41 D 4.5412 8.9669 127.6542 56.2939 40.5273 175.9070 42 I 5.0332 7.2927 117.7107 60.0739 41.5578 173.3844 43 N 4.9700 8.9018 125.8095 52.8324 42.8230 172.8849 44 T 4.8766 8.4016 121.2213 61.7131 71.4281 173.2728 45 F 4.7601 8.8359 124.6597 55.8742 41.5228 174.8924 46 I 4.5352 8.4991 124.0892 60.4350 39.1363 174.6523 47 H 5.6441 8.6257 122.2799 53.3258 31.6849 173.9700 48 G 4.1489 9.0791 104.3734 44.6472 0.0000 172.6302 49 N 5.2351 8.7780 118.3111 50.8473 39.8268 176.1322 50 K 3.4631 8.7893 120.2527 59.7448 32.0482 179.3911 51 R 3.9532 8.1654 117.7726 59.7557 29.7985 178.8196 52 S 4.2823 7.9049 110.1773 61.0317 62.5739 176.1422 53 I 3.8732 7.4229 122.5978 64.2778 36.5632 177.9849 54 K 3.7536 8.2084 120.2194 59.5217 32.0663 177.8818 55 A 4.8008 8.1139 120.0909 52.8283 18.3128 179.1414 56 I 3.8921 8.0825 119.4999 64.1540 36.8908 177.5516 57 C 4.3886 7.7390 116.0585 58.1215 34.5980 173.6363 58 E 4.5762 7.2089 119.5203 54.7952 30.7112 176.4269 59 N 4.9264 8.4314 114.8290 53.7485 38.6010 176.6194 60 K 4.0630 8.1111 120.6948 59.2822 32.6266 177.0476 61 N 5.0665 8.2363 114.4653 52.8343 40.8983 173.0029 62 G 5.1654 8.2162 103.3181 43.2512 0.0000 172.0175 63 N 5.2820 8.6515 117.9424 50.1964 42.5342 172.4335 64 P 4.5722 0.0000 0.0000 63.6566 32.4439 175.3707 65 H 4.6097 9.1431 122.6595 56.0373 33.1586 173.5285 66 R 3.4596 8.4682 124.9748 57.3910 28.8825 175.1865 67 E 4.1667 8.7146 121.7691 57.4708 30.0383 175.9625 68 N 4.1709 8.8733 119.5060 53.2768 36.5009 173.4324 69 L 4.7709 7.4833 118.5067 53.6017 45.2177 175.2409 70 R 5.1322 8.9811 118.4482 54.4867 34.3164 174.7431 71 I 5.0151 8.5122 122.0263 58.9518 40.8275 175.0852 72 S 4.8169 8.9038 124.5143 58.5781 63.2643 174.5996 73 K 4.2924 8.7990 121.9876 59.0639 32.4085 177.8892 74 S 4.5463 8.0907 113.3374 57.3968 64.5465 174.4893 75 S 4.5927 8.1120 116.7278 57.8421 64.1038 173.5980 76 F 5.0439 8.9588 120.8042 55.6594 42.8614 174.5580 77 Q 4.9868 9.0144 121.0766 56.1173 30.0554 175.2635 78 V 4.8774 9.1640 122.6746 61.5726 36.1334 174.4049 79 T 5.0402 8.4574 120.5835 62.4120 72.5547 172.9623 80 T 4.7828 9.1142 124.6916 62.4721 70.5549 173.2680 81 C 5.3591 9.3696 124.9012 55.3751 40.0521 172.5034 82 K 5.1412 9.0350 125.9956 54.1507 34.2977 175.0557 83 L 3.8947 8.9292 128.3393 55.6529 41.8955 177.4096 84 H 4.8236 8.5478 122.7339 52.6064 27.9388 173.8851 85 G 3.9084 8.3027 105.7550 45.0708 0.0000 173.0663 86 G 3.9147 8.3728 108.2093 45.1852 0.0000 173.5181 87 S 4.6777 7.2799 114.2944 55.7535 64.0344 172.1114 88 P 4.1797 0.0000 0.0000 63.2200 31.6010 175.3727 89 W 5.2616 7.4578 119.7251 54.0114 31.1008 173.8170 90 P 4.3435 0.0000 0.0000 62.5502 31.3435 174.1673 91 P 4.3554 0.0000 0.0000 62.5253 31.7248 177.4226 92 C 4.2613 8.5808 121.5342 55.9578 37.5263 171.9833 93 Q 4.4330 8.1026 126.4572 55.6143 29.7727 173.7115 94 Y 5.1726 8.3345 123.1380 56.1688 40.8136 175.2336 95 R 4.5600 9.3086 124.4622 55.2880 31.7442 174.7916 96 A 5.2293 8.4398 127.1284 50.9098 21.2845 176.5625 97 T 4.5718 8.7106 117.0605 61.6219 71.6762 173.5862 98 A 4.6775 8.7853 128.6053 52.0072 19.7817 176.0891 99 G 4.2858 8.8598 106.1790 45.3927 0.0000 171.8432 100 F 5.5929 8.5764 121.3474 57.0657 41.8360 173.2784 101 R 4.5342 8.5879 125.4625 55.3008 34.0817 173.5336 102 N 5.2706 8.6268 119.9483 52.6655 38.8568 174.5282 103 V 4.5713 8.8534 112.4964 59.5999 35.6179 175.0763 104 V 4.5323 8.2404 123.5252 61.7327 33.0479 175.0134 105 V 5.0172 8.3968 120.0067 59.5059 35.9147 174.1233 106 A 4.9778 8.6925 123.4203 50.6456 21.1083 175.2460 107 C 5.1850 8.6647 119.1021 55.1045 43.3512 173.1577 108 E 4.5152 8.8184 123.1129 55.5534 31.6775 175.3225 109 N 4.1836 9.9519 123.7572 54.4089 36.3733 174.8432 110 G 3.8291 8.4448 101.8513 45.8158 0.0000 173.7934 111 L 4.3279 7.5822 119.3461 51.1908 44.4361 174.4839 112 P 4.4383 0.0000 0.0000 63.2959 31.4464 176.6371 113 V 4.6037 8.1637 113.8624 60.7076 33.8992 174.7706 114 H 4.8432 7.6142 118.6003 55.1390 33.1620 171.8173 115 L 4.9823 8.3760 126.7440 53.1724 44.1920 174.9236 116 D 4.5783 8.9104 127.2763 53.9247 41.2964 176.2404 117 Q 4.4507 8.9032 125.2611 57.2955 29.7055 178.3342 118 S 4.1628 8.1841 113.7995 61.1008 63.0677 176.0815 119 I 3.7606 7.4921 111.7775 61.9678 37.3543 176.0345 120 F 4.8944 7.6263 118.9663 57.6999 39.8270 176.7078 121 R 4.3216 7.6915 122.4065 54.9992 28.4647 177.1193 122 R 4.2619 7.6186 116.8310 54.4943 30.9622 175.6070 123 P 4.4417 0.0000 0.0000 62.9870 31.3359 176.2086 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 Q 8.20 4.24 0.00 2.18 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.88 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 2 D 8.10 4.21 0.00 2.73 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 N 8.76 4.59 0.00 2.92 2.94 0.00 0.00 6.87 7.63 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 4 S 7.34 4.19 0.00 4.24 4.17 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 5 R 7.88 3.69 0.00 1.92 1.97 0.00 3.25 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 6 Y 8.40 4.55 0.00 3.01 3.08 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 7 T 7.95 3.68 4.22 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 1.17 0.00 0.00 8 H 7.95 4.31 0.00 3.44 3.40 0.00 5.82 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 9 F 8.16 4.16 0.00 3.19 3.29 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 10 L 8.13 3.93 0.00 1.69 1.63 nan 0.18 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 11 T 7.65 3.92 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 1.19 0.00 0.00 12 Q 7.93 4.18 0.00 1.58 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.89 0.00 0.00 0.00 0.00 0.00 2.22 2.52 0.00 13 H 8.19 4.64 0.00 2.05 2.64 0.00 5.75 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.22 5.14 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 15 D 8.93 4.26 0.00 2.71 2.58 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 16 A 8.08 3.90 1.22 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 0.00 0.00 17 K 7.35 4.66 0.00 1.65 1.67 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.32 7.81 18 P 0.00 4.43 0.00 1.51 1.94 0.00 3.56 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 1.59 1.08 0.00 19 Q 7.87 4.00 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 20 G 7.86 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 21 R 8.09 3.64 0.00 1.62 1.67 0.00 2.84 0.00 0.00 3.06 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.05 0.00 22 D 7.30 4.95 0.00 2.87 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 23 D 8.63 4.56 0.00 2.83 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 24 R 8.03 3.97 0.00 2.11 2.01 0.00 3.21 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 25 Y 8.05 4.03 0.00 3.14 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 26 C 8.24 3.93 0.00 3.30 3.14 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 27 E 8.14 4.07 0.00 2.20 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 2.68 2.61 0.00 28 S 8.04 4.07 0.00 3.96 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 29 I 7.43 3.49 1.01 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.89 -0.18 0.00 0.00 30 M 7.99 4.00 0.00 1.80 1.92 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 2.42 0.00 31 R 7.75 3.93 0.00 2.01 2.02 0.00 3.11 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 32 R 8.18 4.04 0.00 1.80 1.89 0.00 3.24 0.00 0.00 3.15 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 33 R 7.70 4.46 0.00 2.11 1.96 0.00 3.28 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.71 0.00 34 G 7.79 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 35 L 7.73 4.16 0.00 1.71 1.62 0.81 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.72 4.57 4.32 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 1.26 0.00 0.00 37 S 8.19 4.28 0.00 4.07 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 38 P 0.00 4.57 0.00 1.52 0.93 0.00 3.79 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.86 0.00 39 C 8.53 4.39 0.00 2.69 3.06 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 40 K 8.77 4.19 0.00 2.01 1.72 0.00 1.57 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.37 7.81 41 D 8.97 4.54 0.00 2.74 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 42 I 7.29 5.03 1.91 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.64 0.94 0.00 0.00 43 N 8.90 4.97 0.00 2.71 2.34 0.00 0.00 6.83 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 44 T 8.40 4.88 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 0.40 0.00 0.00 45 F 8.84 4.76 0.00 2.94 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 46 I 8.50 4.54 1.98 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.61 0.81 0.00 0.00 47 H 8.63 5.64 0.00 3.14 3.20 0.00 5.58 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 48 G 9.08 4.15 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 0.00 49 N 8.78 5.24 0.00 3.05 3.05 0.00 0.00 5.98 7.20 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 50 K 8.79 3.46 0.00 1.75 1.88 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.95 0.53 7.81 51 R 8.17 3.95 0.00 1.95 2.05 0.00 3.23 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.81 0.00 52 S 7.90 4.28 0.00 4.36 4.32 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 53 I 7.42 3.87 1.93 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 1.69 0.62 0.97 0.00 0.00 54 K 8.21 3.75 0.00 1.99 2.04 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.21 7.81 55 A 8.11 4.80 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.08 3.89 1.94 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.95 0.92 0.00 0.00 57 C 7.74 4.39 0.00 3.00 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 58 E 7.21 4.58 0.00 2.03 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 2.24 2.23 0.00 59 N 8.43 4.93 0.00 2.69 2.85 0.00 0.00 7.23 7.61 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 60 K 8.11 4.06 0.00 1.71 1.84 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.43 7.81 61 N 8.24 5.07 0.00 2.87 2.79 0.00 0.00 6.75 7.90 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 62 G 8.22 5.17 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 0.00 0.00 0.00 63 N 8.65 5.28 0.00 2.84 2.68 0.00 0.00 7.20 8.05 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 64 P 0.00 4.57 0.00 1.93 1.99 0.00 3.66 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 2.03 2.09 0.00 65 H 9.14 4.61 0.00 3.20 3.19 0.00 5.93 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 R 8.47 3.46 0.00 1.85 1.76 0.00 3.17 0.00 0.00 3.18 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.37 0.00 67 E 8.71 4.17 0.00 1.92 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 68 N 8.87 4.17 0.00 2.97 2.98 0.00 0.00 6.17 7.79 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 69 L 7.48 4.77 0.00 1.88 1.76 0.99 1.24 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 70 R 8.98 5.13 0.00 1.66 1.76 0.00 3.03 0.00 0.00 3.28 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 71 I 8.51 5.02 1.68 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.42 0.97 0.00 0.00 72 S 8.90 4.82 0.00 4.13 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 73 K 8.80 4.29 0.00 1.69 1.90 0.00 1.82 0.00 0.00 1.85 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.39 7.81 74 S 8.09 4.55 0.00 3.62 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 75 S 8.11 4.59 0.00 2.74 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 76 F 8.96 5.04 0.00 3.02 3.02 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 77 Q 9.01 4.99 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.81 0.00 0.00 0.00 0.00 0.00 2.60 2.34 0.00 78 V 9.16 4.88 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 0.80 0.00 0.00 0.92 0.00 0.00 79 T 8.46 5.04 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 1.33 0.00 0.00 80 T 9.11 4.78 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 1.23 0.00 0.00 81 C 9.37 5.36 0.00 2.63 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 82 K 9.03 5.14 0.00 1.87 1.73 0.00 1.66 0.00 0.00 1.52 0.00 0.00 2.74 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.59 7.81 83 L 8.93 3.89 0.00 1.66 1.47 0.83 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 84 H 8.55 4.82 0.00 2.95 3.18 0.00 5.69 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 85 G 8.30 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 86 G 8.37 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 87 S 7.28 4.68 0.00 3.80 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 88 P 0.00 4.18 0.00 1.31 1.89 0.00 3.59 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 1.19 1.66 0.00 89 W 7.46 5.26 0.00 3.30 3.06 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 90 P 0.00 4.34 0.00 2.13 2.09 0.00 4.01 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 2.18 2.25 0.00 91 P 0.00 4.36 0.00 2.04 2.00 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 92 C 8.58 4.26 0.00 3.05 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 93 Q 8.10 4.43 0.00 2.03 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.86 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 94 Y 8.33 5.17 0.00 2.95 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 95 R 9.31 4.56 0.00 2.03 1.95 0.00 3.13 0.00 0.00 3.37 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 96 A 8.44 5.23 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 97 T 8.71 4.57 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 1.27 0.00 0.00 98 A 8.79 4.68 1.22 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 0.00 0.00 99 G 8.86 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 0.00 100 F 8.58 5.59 0.00 2.87 2.95 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 0.00 101 R 8.59 4.53 0.00 2.01 1.88 0.00 3.26 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 102 N 8.63 5.27 0.00 2.90 2.95 0.00 0.00 5.83 7.68 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 0.00 103 V 8.85 4.57 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 0.73 0.00 0.00 104 V 8.24 4.53 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 1.09 0.00 0.00 0.69 0.00 0.00 105 V 8.40 5.02 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 0.69 0.00 0.00 0.84 0.00 0.00 106 A 8.69 4.98 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 0.00 107 C 8.66 5.18 0.00 2.78 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 0.00 108 E 8.82 4.52 0.00 1.86 1.69 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 2.16 2.21 0.00 109 N 9.95 4.18 0.00 2.80 2.79 0.00 0.00 7.19 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 0.00 110 G 8.44 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 0.00 0.00 0.00 111 L 7.58 4.33 0.00 1.60 0.98 0.73 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 112 P 0.00 4.44 0.00 0.82 1.76 0.00 3.23 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.86 0.00 113 V 8.16 4.60 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 0.74 0.00 0.00 0.89 0.00 0.00 114 H 7.61 4.84 0.00 3.23 3.05 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.38 4.98 0.00 1.71 1.32 0.94 1.30 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 0.00 116 D 8.91 4.58 0.00 2.73 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 0.00 117 Q 8.90 4.45 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.67 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 118 S 8.18 4.16 0.00 3.95 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 0.00 119 I 7.49 3.76 1.44 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 -0.36 0.74 0.00 0.00 120 F 7.63 4.89 0.00 3.24 3.03 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 0.00 121 R 7.69 4.32 0.00 2.00 1.92 0.00 3.17 0.00 0.00 3.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 122 R 7.62 4.26 0.00 1.87 1.94 0.00 3.40 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 123 P 0.00 4.44 0.00 2.19 2.05 0.00 3.82 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00