NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 3.3521 8.1933 115.4103 57.3188 64.5241 174.3556 2 I 3.4617 7.1217 121.2887 62.8360 36.9929 177.4105 3 T 3.8386 7.8422 111.4352 64.5673 69.4986 174.8913 4 D 4.5388 8.0184 120.4756 55.7451 41.3105 176.5893 5 I 4.3048 7.6935 117.6408 62.5257 38.9625 175.8353 6 L 4.6627 7.7739 118.7111 53.2680 43.3266 177.1669 7 S 4.4456 8.3138 115.9113 57.8787 65.2736 175.1613 8 A 4.0466 8.6378 126.0135 55.6468 18.1253 180.0299 9 E 3.9224 8.1126 116.5425 59.6141 29.5360 179.1212 10 D 4.3541 8.0369 118.6384 57.1201 40.8824 178.8126 11 I 3.5960 7.8461 120.2143 64.3584 37.1203 178.1807 12 A 4.0230 8.2888 121.5545 55.2269 18.1852 179.5717 13 A 3.8964 8.1843 118.9484 55.2208 18.2307 179.7406 14 A 3.8531 7.8777 118.4188 55.2445 18.3843 179.6025 15 L 4.2425 8.1254 117.5879 57.8305 41.5629 179.3305 16 Q 3.9946 8.3289 119.7564 59.3108 28.7621 178.0528 17 E 4.0353 8.1709 119.3255 58.3368 29.6351 177.0242 18 C 5.1433 7.3291 111.5946 56.9096 30.3027 174.8608 19 Q 4.1225 7.9176 123.7414 60.1623 28.5955 176.9133 20 D 4.6518 7.9063 117.2419 52.7271 41.7502 174.0207 21 P 4.2478 0.0000 0.0000 64.3816 31.6860 175.7322 22 D 4.5974 8.9852 119.0151 55.6736 38.1117 174.5830 23 T 4.4534 7.5250 108.1148 61.1773 69.9160 173.9774 24 F 4.4391 8.5295 125.9342 58.3279 40.0350 174.5476 25 E 4.2623 7.7117 126.1777 52.9785 32.8852 174.2535 26 P 3.3375 0.0000 0.0000 65.5853 31.4820 178.4559 27 Q 4.0879 7.8502 115.4671 59.3969 28.3134 178.7222 28 K 3.8886 7.6915 119.8722 58.9165 32.1494 178.8863 29 F 3.8715 7.8149 120.8857 61.3957 39.2305 177.2715 30 F 4.5697 8.0132 117.6723 60.4124 38.7568 177.6253 31 Q 3.9262 8.1338 119.3328 59.6506 28.7727 178.2818 32 T 3.8492 7.8480 115.8989 66.5279 68.5322 176.5760 33 S 4.2424 7.7038 115.0795 59.6060 63.4081 175.4481 34 G 4.0092 7.9747 110.8046 44.9745 0.0000 175.2053 35 L 4.1183 7.8622 120.3683 57.8346 41.7640 179.5259 36 S 4.3286 8.2670 111.9796 60.2664 62.9741 174.9488 37 K 4.3404 7.7975 119.2579 56.8850 32.3695 176.7237 38 M 4.4170 7.7212 119.3391 54.2973 32.9803 176.6946 39 S 4.4301 8.3466 116.0015 57.8537 65.3834 175.1950 40 A 4.0095 8.4255 123.4984 55.3714 18.1011 179.7415 41 S 4.0316 8.0509 111.1055 61.7283 62.5077 176.3354 42 Q 4.0680 7.8981 120.7299 58.9781 28.3893 178.8336 43 V 3.7800 8.1146 119.4573 65.8654 31.5129 178.0275 44 K 4.0053 8.4216 119.6483 59.5514 31.8934 178.5636 45 D 4.1968 8.2398 119.2459 57.2835 40.8186 178.8486 46 I 3.9666 7.9406 120.2991 64.4050 37.2142 177.9138 47 F 3.6016 8.5665 121.8589 61.6186 38.8589 177.4705 48 R 3.8012 7.8949 115.9669 59.2558 29.8403 178.8348 49 F 4.4413 7.1880 116.7175 60.3123 38.9466 177.5044 50 I 3.8753 7.1312 118.4777 63.0899 38.4690 177.1484 51 D 4.3930 7.4530 120.4174 52.6898 37.7099 175.5483 52 N 4.1936 8.0961 121.7460 56.0392 39.4239 175.0215 53 D 4.6758 8.3656 114.3893 52.4086 39.6924 175.9352 54 Q 3.5644 7.8709 117.3110 57.2646 26.7849 175.0150 55 S 4.2776 8.2521 112.5878 59.5446 63.5602 175.1734 56 G 3.9441 9.6877 109.8443 45.0955 0.0000 172.6614 57 Y 5.2241 7.4819 115.4557 56.2596 42.4130 174.6287 58 L 5.1748 9.4560 123.0158 53.4383 43.6191 175.7091 59 D 4.7153 9.1643 121.6254 52.0178 42.9173 177.1523 60 G 3.7276 8.8288 108.2316 46.5075 0.0000 176.9789 61 D 4.1567 8.6549 122.5513 56.8717 41.0730 178.2590 62 E 4.1188 8.1849 118.9842 59.1228 29.3579 179.3789 63 L 4.0265 7.8462 119.1184 57.6745 41.7331 179.2617 64 K 3.8378 7.8545 119.0250 58.9361 32.0674 177.1845 65 Y 5.0842 7.4917 115.1467 57.7372 37.9184 176.9316 66 F 4.0864 7.9636 124.5644 61.8668 39.4057 177.4955 67 L 4.1557 8.0217 117.5891 57.7369 40.9911 179.1450 68 Q 4.3999 8.1340 117.1555 58.2146 28.3585 178.4744 69 K 3.9684 7.7150 118.9583 58.5758 32.0616 178.6718 70 F 4.4392 8.1140 117.5205 58.3950 39.7369 176.4415 71 Q 4.5750 7.5120 116.9800 54.1216 32.4237 175.8782 72 S 4.3254 9.1160 117.3483 60.1045 63.2248 174.5192 73 D 4.6854 7.9501 118.7379 52.8295 39.4677 176.3048 74 A 4.2542 7.8586 123.0432 51.8854 18.9451 178.2469 75 R 4.2138 8.1843 116.2128 55.8683 30.3331 176.3463 76 E 4.4667 8.3803 118.3170 56.1644 30.2918 176.9560 77 L 4.3649 8.3803 123.2773 54.7921 42.6172 177.2218 78 T 4.1703 9.0825 113.0591 61.2042 70.2920 175.5329 79 E 3.8899 8.8106 121.2784 59.5799 29.4119 179.6113 80 S 4.0968 7.9598 112.6463 61.5048 62.5995 175.9418 81 E 4.1082 8.3739 121.5620 59.4592 29.1483 179.4841 82 T 3.8121 8.1330 110.2595 64.5440 68.8750 176.6306 83 K 3.9351 8.1611 122.8254 59.1852 32.2235 178.8517 84 S 4.1771 8.2102 114.5813 61.2805 62.9027 176.2603 85 L 3.9683 7.9220 123.8543 58.1419 41.8082 178.6487 86 M 4.0856 8.1251 118.0466 58.8689 31.9760 177.8588 87 D 4.3447 8.4162 118.0801 57.3836 41.0363 178.4100 88 A 4.1474 8.0910 120.2531 54.2066 18.4338 178.5430 89 A 4.5560 7.5461 117.3616 52.3993 20.5568 177.1953 90 D 4.6146 8.0314 117.9470 54.4375 41.5433 175.4428 91 N 5.0238 9.8596 122.7063 52.4584 37.2788 174.3255 92 D 4.8006 8.2007 117.6094 52.6916 39.9820 176.4538 93 G 3.8283 8.2899 105.8663 47.0623 0.0000 174.2196 94 D 4.6010 7.6009 114.2600 52.0399 39.8542 176.9131 95 G 3.9595 8.5284 107.6174 46.0523 0.0000 173.3371 96 K 4.8616 8.1209 116.7072 55.1209 36.4498 175.6806 97 I 4.6678 8.9222 122.5281 59.9140 38.8837 176.2128 98 G 4.1879 9.6254 115.3815 45.1848 0.0000 174.1626 99 A 2.6675 8.0443 121.4983 54.4131 18.1090 179.6747 100 D 4.2131 7.7794 117.1811 56.7909 39.5785 178.5575 101 E 4.2551 8.0946 121.2077 58.2471 29.4555 178.9097 102 F 4.2266 8.4646 120.7800 61.4420 39.6242 177.0672 103 Q 3.8591 8.2072 117.5986 59.1773 28.0321 178.9088 104 E 3.9618 8.2474 119.4247 59.4861 29.4379 179.2248 105 M 3.9831 8.0142 118.2040 58.6069 32.1395 178.4024 106 V 2.7727 7.0429 117.0908 65.8229 31.6520 176.8436 107 H 4.6429 7.4536 112.1809 56.2448 28.8172 176.1304 108 S 4.4487 7.7483 123.1066 58.8208 62.8915 173.6796 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 8.19 3.35 0.00 3.61 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 2 I 7.12 3.46 1.58 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.12 0.80 0.00 0.00 3 T 7.84 3.84 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 1.16 0.00 0.00 4 D 8.02 4.54 0.00 2.87 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 5 I 7.69 4.30 2.08 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.67 1.00 0.00 0.00 6 L 7.77 4.66 0.00 1.73 1.66 1.22 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.31 4.45 0.00 4.19 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 8 A 8.64 4.05 1.35 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 0.00 0.00 0.00 9 E 8.11 3.92 0.00 2.07 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 2.40 2.46 0.00 10 D 8.04 4.35 0.00 2.80 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.85 3.60 2.10 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 1.67 1.15 1.09 0.00 0.00 12 A 8.29 4.02 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.18 3.90 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 14 A 7.88 3.85 0.84 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 15 L 8.13 4.24 0.00 1.91 1.81 1.03 0.68 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 16 Q 8.33 3.99 0.00 2.18 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 17 E 8.17 4.04 0.00 2.13 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 0.00 2.33 2.32 0.00 18 C 7.33 5.14 0.00 3.25 3.10 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 19 Q 7.92 4.12 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.82 6.93 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 20 D 7.91 4.65 0.00 2.77 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 21 P 0.00 4.25 0.00 2.18 2.07 0.00 3.89 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 22 D 8.99 4.60 0.00 2.88 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 23 T 7.53 4.45 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 24 F 8.53 4.44 0.00 2.94 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 25 E 7.71 4.26 0.00 1.73 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 26 P 0.00 3.34 0.00 2.08 2.07 0.00 3.38 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 27 Q 7.85 4.09 0.00 2.29 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.92 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 28 K 7.69 3.89 0.00 1.80 1.94 0.00 1.60 0.00 0.00 1.86 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.40 7.81 29 F 7.81 3.87 0.00 2.82 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 30 F 8.01 4.57 0.00 3.12 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 31 Q 8.13 3.93 0.00 2.16 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 32 T 7.85 3.85 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 1.15 0.00 0.00 33 S 7.70 4.24 0.00 3.79 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 34 G 7.97 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 0.00 0.00 0.00 35 L 7.86 4.12 0.00 1.93 1.88 1.59 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 36 S 8.27 4.33 0.00 4.00 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 37 K 7.80 4.34 0.00 1.94 1.91 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.42 7.81 38 M 7.72 4.42 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.89 0.00 39 S 8.35 4.43 0.00 4.06 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 40 A 8.43 4.01 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 41 S 8.05 4.03 0.00 3.91 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 Q 7.90 4.07 0.00 2.32 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 43 V 8.11 3.78 2.27 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 1.20 0.00 0.00 0.97 0.00 0.00 44 K 8.42 4.01 0.00 2.11 1.97 0.00 1.51 0.00 0.00 1.48 0.00 0.00 2.98 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.38 1.49 7.81 45 D 8.24 4.20 0.00 3.02 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 46 I 7.94 3.97 2.32 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.27 1.20 0.00 0.00 47 F 8.57 3.60 0.00 2.92 3.16 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 48 R 7.89 3.80 0.00 1.52 1.68 0.00 3.05 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 49 F 7.19 4.44 0.00 3.05 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 50 I 7.13 3.88 1.62 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 1.03 0.41 0.85 0.00 0.00 51 D 7.45 4.39 0.00 2.06 2.35 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 0.00 52 N 8.10 4.19 0.00 2.69 2.85 0.00 0.00 7.27 8.47 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 53 D 8.37 4.68 0.00 2.83 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 54 Q 7.87 3.56 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.03 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 55 S 8.25 4.28 0.00 4.17 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 56 G 9.69 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 Y 7.48 5.22 0.00 2.86 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 58 L 9.46 5.17 0.00 1.66 1.62 0.87 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 59 D 9.16 4.72 0.00 2.75 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 60 G 8.83 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 0.00 0.00 0.00 61 D 8.65 4.16 0.00 2.72 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 62 E 8.18 4.12 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 2.35 2.38 0.00 63 L 7.85 4.03 0.00 1.82 1.64 0.93 0.50 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 64 K 7.85 3.84 0.00 1.52 1.32 0.00 1.20 0.00 0.00 1.77 0.00 0.00 2.73 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.08 1.34 7.81 65 Y 7.49 5.08 0.00 3.08 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 66 F 7.96 4.09 0.00 3.25 2.92 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 67 L 8.02 4.16 0.00 1.90 1.75 0.91 0.69 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 68 Q 8.13 4.40 0.00 2.32 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 69 K 7.71 3.97 0.00 1.41 1.51 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.40 1.47 7.81 70 F 8.11 4.44 0.00 3.24 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 71 Q 7.51 4.57 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 72 S 9.12 4.33 0.00 3.93 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 73 D 7.95 4.69 0.00 2.78 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 74 A 7.86 4.25 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 75 R 8.18 4.21 0.00 1.95 1.97 0.00 3.05 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 76 E 8.38 4.47 0.00 1.91 1.92 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 2.57 2.47 0.00 77 L 8.38 4.36 0.00 1.36 1.40 0.31 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 78 T 9.08 4.17 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 1.26 0.00 0.00 79 E 8.81 3.89 0.00 2.01 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 2.36 2.34 0.00 80 S 7.96 4.10 0.00 3.88 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 81 E 8.37 4.11 0.00 2.22 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 0.00 2.46 2.50 0.00 82 T 8.13 3.81 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 1.17 0.00 0.00 83 K 8.16 3.94 0.00 1.85 2.03 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.59 1.45 7.81 84 S 8.21 4.18 0.00 4.11 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.92 3.97 0.00 1.97 1.87 0.93 0.31 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 86 M 8.13 4.09 0.00 2.30 2.06 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.65 0.00 87 D 8.42 4.34 0.00 2.81 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 88 A 8.09 4.15 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 89 A 7.55 4.56 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 90 D 8.03 4.61 0.00 2.76 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 N 9.86 5.02 0.00 2.77 2.87 0.00 0.00 6.82 7.92 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 92 D 8.20 4.80 0.00 2.90 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 93 G 8.29 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 94 D 7.60 4.60 0.00 2.68 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 95 G 8.53 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 0.00 0.00 0.00 96 K 8.12 4.86 0.00 1.96 1.73 0.00 1.43 0.00 0.00 1.49 0.00 0.00 2.13 0.00 0.00 2.23 0.00 0.00 0.00 0.00 1.52 1.19 7.81 97 I 8.92 4.67 2.11 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.75 1.26 0.00 0.00 98 G 9.63 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.04 2.67 0.53 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 0.00 0.00 100 D 7.78 4.21 0.00 2.86 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 0.00 101 E 8.09 4.26 0.00 2.31 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 0.00 2.46 2.29 0.00 102 F 8.46 4.23 0.00 3.40 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 0.00 103 Q 8.21 3.86 0.00 2.25 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.57 0.00 0.00 0.00 0.00 0.00 2.51 2.51 0.00 104 E 8.25 3.96 0.00 2.14 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 2.32 2.40 0.00 105 M 8.01 3.98 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.57 0.00 106 V 7.04 2.77 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 0.45 0.00 0.00 -0.69 0.00 0.00 107 H 7.45 4.64 0.00 3.27 3.28 0.00 5.72 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 S 7.75 4.45 0.00 4.04 3.78 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