NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4076 8.2649 123.5905 51.8666 19.9407 176.8622 2 F 4.1771 9.0506 118.4026 59.8092 39.3305 175.5061 3 S 4.4602 8.4691 115.7444 59.5863 64.1810 172.5381 4 G 3.6298 8.2240 109.1377 44.1117 0.0000 172.0685 5 T 4.6965 7.8127 115.3843 61.4620 70.8561 174.1481 6 W 5.4430 8.9238 125.5081 54.8779 33.0547 174.2704 7 Q 4.9597 9.1750 124.4450 53.9333 31.3699 174.7077 8 V 4.4217 8.9929 127.1319 63.0080 31.8747 174.8533 9 Y 4.9369 8.5096 123.3453 56.1612 39.7823 175.1078 10 A 4.3288 6.9200 119.9190 51.1528 22.6757 175.5164 11 Q 4.6623 8.4404 120.7099 54.7316 30.9479 173.8208 12 E 4.4331 8.5033 125.1165 55.2112 32.0091 175.5918 13 N 4.3264 8.9463 120.5746 54.4217 36.9442 175.3231 14 Y 4.0529 7.7965 120.4441 61.0616 38.6439 178.4097 15 E 3.8920 8.3070 118.6278 59.5233 29.4742 178.6842 16 E 3.9109 8.1689 116.6526 59.4393 29.8732 178.4776 17 F 4.1007 8.5564 120.5650 61.5588 39.3167 177.0736 18 L 3.6509 7.8851 118.1036 57.9601 41.5650 179.5433 19 K 3.6029 8.2270 118.2437 59.8833 31.7918 178.9588 20 A 4.0350 7.4835 119.4055 54.6791 18.3279 179.2988 21 L 2.4400 7.7648 117.7064 55.2648 41.4487 177.6837 22 A 3.6446 7.3822 119.5564 52.7752 16.3605 177.9351 23 L 4.2836 7.5105 118.4884 54.7034 42.7099 175.0735 24 P 4.4420 0.0000 0.0000 62.4838 32.2922 177.1157 25 E 3.9093 9.0087 121.5512 59.9958 29.1337 179.3334 26 D 4.3829 8.2135 118.0041 57.0526 40.7991 178.1357 27 L 4.1277 8.0918 120.3458 56.8417 42.3568 178.7053 28 I 3.8107 7.7752 120.5398 64.0600 36.9179 178.2202 29 K 4.1503 7.9973 117.6663 59.4335 32.7588 178.1907 30 M 4.3000 7.5104 118.5169 56.2637 32.5748 177.0928 31 A 4.7148 7.9462 119.1538 51.7147 19.5106 177.7837 32 R 4.5935 7.7032 113.5113 57.2189 30.1856 176.8345 33 D 4.5274 7.7907 119.6594 53.4049 41.5784 175.4354 34 I 4.4170 7.5367 119.1178 59.5871 39.5476 176.9960 35 K 4.2742 8.3438 126.8809 54.3106 30.6240 173.2830 36 P 4.5109 0.0000 0.0000 62.5312 32.5275 176.9112 37 I 4.3116 8.2098 124.3584 60.9709 39.3991 175.1857 38 V 4.6943 8.7316 123.0589 61.6437 34.7733 173.4134 39 E 5.1112 8.9228 129.2076 54.9898 31.6425 174.5972 40 I 5.1012 8.9151 126.9492 59.1122 40.5759 175.2034 41 Q 4.5147 8.1246 126.7987 54.4862 27.5302 173.8995 42 Q 3.9650 8.0129 121.3879 56.7469 30.2093 176.1221 43 K 4.3341 7.3462 116.1734 55.0398 35.3471 176.0409 44 G 3.9310 8.3466 108.0854 44.8635 0.0000 174.6538 45 D 5.0321 9.2915 125.4913 54.0313 43.8398 176.5462 46 D 5.3066 7.7072 118.4730 52.8180 43.9166 175.2657 47 F 4.5192 8.5281 118.1561 55.6965 43.6565 174.2016 48 V 4.3173 8.3805 122.3730 61.3215 33.6436 173.7988 49 V 4.7176 8.3730 128.6597 61.6246 33.8473 174.6975 50 T 4.8998 8.6938 123.8235 61.8787 71.5450 173.0386 51 S 4.9319 8.8122 123.4669 57.9143 64.6788 174.0502 52 K 4.5766 8.8293 122.6459 55.0350 35.0180 176.0855 53 T 4.4590 8.9291 116.8713 59.4409 70.8100 174.4083 54 P 4.4276 0.0000 0.0000 65.1173 31.6600 177.3595 55 R 4.2669 7.8009 117.5206 57.2472 30.8618 175.0543 56 Q 4.5953 7.2987 114.7704 55.4699 31.5419 172.6507 57 T 4.9014 8.2871 107.8967 59.9401 71.5094 173.2897 58 V 4.4658 8.6203 125.6175 61.2564 34.2881 174.2316 59 T 5.0368 8.6365 123.7211 62.0975 71.5043 173.3407 60 N 5.2163 9.5045 120.8035 51.9775 43.5528 173.4754 61 S 5.0035 8.6671 115.6050 56.8300 65.9478 172.6348 62 F 5.0909 8.0831 119.9449 56.3008 41.6340 172.8442 63 T 5.1153 8.5893 115.2115 61.4846 71.5452 173.8192 64 L 4.6382 8.6867 127.3304 55.4613 42.5227 177.0475 65 G 4.0652 10.2577 114.3112 45.1874 0.0000 172.6909 66 K 4.5925 7.4927 117.0011 54.0463 36.0406 175.6688 67 E 3.9957 8.9493 124.2767 56.2816 30.2346 175.5777 68 A 4.9722 8.1948 126.1197 50.0915 22.7689 174.4448 69 D 5.0003 8.7280 119.9424 53.9491 42.0460 176.1041 70 I 4.7467 9.0216 123.7314 59.7688 40.9818 174.5825 71 T 5.1582 8.4649 121.1326 62.0325 71.4608 173.9256 72 T 4.4739 8.7695 116.2614 60.8723 70.8308 175.6797 73 M 4.2670 8.6838 121.1478 57.0353 32.2900 177.2034 74 D 4.4960 7.8297 117.2766 53.5613 40.2929 176.9781 75 G 4.1933 7.6839 109.6584 45.4528 0.0000 173.0645 76 K 4.6219 9.2040 120.3294 54.2235 34.2870 175.5993 77 K 5.1403 8.3432 124.3140 54.7782 34.3508 175.5108 78 L 4.4891 8.4326 121.5645 55.2540 43.9241 173.6439 79 K 5.0408 8.6674 119.6398 55.8969 34.5375 175.8460 80 C 4.6360 8.6849 118.6257 59.2217 33.3491 173.5039 81 T 4.4438 8.4519 120.8985 62.0688 68.6416 174.6752 82 V 3.6684 7.8943 127.4943 62.9025 33.0019 174.3966 83 H 5.1938 8.1056 120.5749 54.1600 32.4673 171.7510 84 L 5.1112 8.4957 119.0447 53.2913 43.0264 176.2484 85 A 4.4358 8.6040 125.8158 51.5846 21.3776 175.7593 86 N 4.0844 9.8142 119.8442 54.5748 36.1649 174.3303 87 G 3.9260 9.2638 102.9067 46.0666 0.0000 174.7970 88 K 4.6611 7.6850 116.6785 54.4328 36.8485 175.5043 89 L 4.3406 7.7569 126.3561 54.8329 42.9971 175.7631 90 V 4.7425 8.4059 125.3973 61.7140 35.0881 174.0371 91 T 4.6012 8.9444 125.7041 61.5080 69.3857 173.8362 92 K 4.3705 8.3692 125.2566 56.6524 34.5067 176.4736 93 S 4.1869 7.6805 112.1214 58.1464 64.3541 174.0346 94 E 4.5156 7.6830 117.3421 55.9631 29.8046 175.7390 95 K 4.1440 6.7186 118.2177 55.6283 34.5645 174.0350 96 F 4.4116 5.7653 113.9290 56.8053 39.6129 172.8396 97 S 5.3200 8.5834 116.3322 57.3317 67.0508 172.4401 98 H 4.9814 8.7611 120.3056 54.9661 33.5541 172.1530 99 E 5.1645 8.8409 123.6366 55.3508 33.7552 173.9896 100 Q 5.0018 9.0192 125.1004 54.7396 33.1574 173.6805 101 E 5.4132 9.2023 121.4190 55.3790 34.6125 174.7038 102 V 4.1711 7.5752 121.7562 59.5392 33.7329 175.7247 103 K 4.3401 8.4950 122.1837 55.2945 34.7683 177.9234 104 G 4.0117 8.4209 117.6882 46.9396 0.0000 172.5837 105 N 4.9594 9.0713 122.7682 52.6616 39.0402 173.2934 106 E 5.4179 8.0368 118.0961 54.8720 33.4419 174.7796 107 M 4.7004 9.7605 121.2867 53.3848 36.0981 174.8098 108 V 4.7564 9.0319 122.5168 61.1258 34.9437 173.7842 109 E 5.0887 9.4240 127.9309 54.6470 32.3489 174.9480 110 T 5.5205 9.9499 114.2655 59.0858 71.4752 172.9932 111 I 5.0384 8.0638 126.5413 59.3295 41.5755 174.2266 112 T 5.4720 8.4806 115.5538 60.1197 71.4620 173.1547 113 F 4.5276 9.8576 128.0204 57.2124 43.2678 174.3431 114 G 3.7101 9.1442 115.1751 46.9338 0.0000 174.2247 115 G 3.8856 8.4684 104.8817 45.3563 0.0000 173.9348 116 V 4.5450 7.6158 119.7199 61.1250 34.2021 174.4312 117 T 5.3079 8.6863 123.3343 61.8038 70.9304 173.2406 118 L 4.6293 8.9219 127.7375 53.3129 44.9447 175.3136 119 I 4.6553 8.0775 125.0272 59.4483 39.4887 173.3896 120 R 4.5129 8.7016 127.8841 55.2358 31.8735 174.8778 121 R 4.9995 8.6788 125.6058 54.6402 32.5458 175.3340 122 S 5.7269 9.7051 120.5856 56.7280 66.8479 173.0720 123 K 5.0507 8.9019 122.9196 54.5530 35.4350 174.9230 124 R 4.5282 8.3878 125.2150 55.1553 30.8016 176.4734 125 V 3.9679 7.8060 124.5722 62.9924 31.5020 174.9869 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 A 8.26 4.41 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 2 F 9.05 4.18 0.00 3.34 3.35 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 3 S 8.47 4.46 0.00 3.96 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 4 G 8.22 3.63 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 5 T 7.81 4.70 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 1.16 0.00 0.00 6 W 8.92 5.44 0.00 3.48 3.12 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 7 Q 9.18 4.96 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.00 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 8 V 8.99 4.42 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 0.84 0.00 0.00 1.02 0.00 0.00 9 Y 8.51 4.94 0.00 3.05 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 10 A 6.92 4.33 0.57 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 11 Q 8.44 4.66 0.00 2.01 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.61 5.93 0.00 0.00 0.00 0.00 0.00 2.05 2.16 0.00 12 E 8.50 4.43 0.00 1.99 1.81 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 2.24 2.27 0.00 13 N 8.95 4.33 0.00 3.02 2.92 0.00 0.00 6.70 7.50 0.00 0.00 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 Y 7.80 4.05 0.00 3.09 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 15 E 8.31 3.89 0.00 2.11 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 2.53 2.60 0.00 16 E 8.17 3.91 0.00 2.14 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 2.33 2.40 0.00 17 F 8.56 4.10 0.00 3.06 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 18 L 7.89 3.65 0.00 1.72 1.48 -0.53 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.23 3.60 0.00 1.93 1.84 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.58 7.81 20 A 7.48 4.03 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 21 L 7.76 2.44 0.00 1.10 1.34 0.15 -0.73 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 22 A 7.38 3.64 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 23 L 7.51 4.28 0.00 1.54 1.56 0.76 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.44 0.00 2.20 2.16 0.00 3.68 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 2.05 1.97 0.00 25 E 9.01 3.91 0.00 1.99 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 2.39 2.35 0.00 26 D 8.21 4.38 0.00 2.68 2.74 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 27 L 8.09 4.13 0.00 1.73 1.82 0.93 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 28 I 7.78 3.81 2.01 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 1.52 0.94 0.91 0.00 0.00 29 K 8.00 4.15 0.00 1.92 1.95 0.00 1.57 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.63 1.53 7.81 30 M 7.51 4.30 0.00 1.91 2.30 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.71 0.00 31 A 7.95 4.71 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 32 R 7.70 4.59 0.00 2.10 2.43 0.00 3.12 0.00 0.00 3.18 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.66 0.00 33 D 7.79 4.53 0.00 2.55 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 34 I 7.54 4.42 1.88 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 1.42 0.88 0.92 0.00 0.00 35 K 8.34 4.27 0.00 1.71 1.90 0.00 1.59 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.38 1.39 7.81 36 P 0.00 4.51 0.00 2.11 2.08 0.00 3.65 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 37 I 8.21 4.31 1.91 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 1.15 1.05 1.06 0.00 0.00 38 V 8.73 4.69 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 1.04 0.00 0.00 1.02 0.00 0.00 39 E 8.92 5.11 0.00 2.15 1.83 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 2.27 2.28 0.00 40 I 8.92 5.10 2.40 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 1.49 1.22 1.19 0.00 0.00 41 Q 8.12 4.51 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.91 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 42 Q 8.01 3.97 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.71 7.37 0.00 0.00 0.00 0.00 0.00 1.80 1.16 0.00 43 K 7.35 4.33 0.00 1.62 1.63 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.28 1.42 7.81 44 G 8.35 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 45 D 9.29 5.03 0.00 2.61 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 46 D 7.71 5.31 0.00 2.44 2.46 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 47 F 8.53 4.52 0.00 1.74 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 48 V 8.38 4.32 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 1.06 0.00 0.00 0.85 0.00 0.00 49 V 8.37 4.72 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 0.98 0.00 0.00 1.16 0.00 0.00 50 T 8.69 4.90 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 1.24 0.00 0.00 51 S 8.81 4.93 0.00 4.02 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 52 K 8.83 4.58 0.00 1.71 1.71 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.54 7.81 53 T 8.93 4.46 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 1.24 0.00 0.00 54 P 0.00 4.43 0.00 2.20 2.23 0.00 3.76 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 55 R 7.80 4.27 0.00 1.79 2.00 0.00 3.28 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 56 Q 7.30 4.60 0.00 2.33 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.73 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 57 T 8.29 4.90 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 1.23 0.00 0.00 58 V 8.62 4.47 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 1.00 0.00 0.00 0.95 0.00 0.00 59 T 8.64 5.04 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 1.31 0.00 0.00 60 N 9.50 5.22 0.00 2.67 2.75 0.00 0.00 6.50 7.05 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 61 S 8.67 5.00 0.00 3.82 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 62 F 8.08 5.09 0.00 3.13 3.18 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 63 T 8.59 5.12 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 1.35 0.00 0.00 64 L 8.69 4.64 0.00 2.17 1.72 0.71 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 65 G 10.26 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 0.00 0.00 0.00 66 K 7.49 4.59 0.00 1.78 1.72 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.47 7.81 67 E 8.95 4.00 0.00 1.94 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 2.31 2.32 0.00 68 A 8.19 4.97 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 69 D 8.73 5.00 0.00 2.62 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 70 I 9.02 4.75 2.03 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 1.40 0.95 0.89 0.00 0.00 71 T 8.46 5.16 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 1.23 0.00 0.00 72 T 8.77 4.47 4.34 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 1.22 0.00 0.00 73 M 8.68 4.27 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.55 0.00 74 D 7.83 4.50 0.00 2.74 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 75 G 7.68 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 76 K 9.20 4.62 0.00 1.99 1.73 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.49 7.81 77 K 8.34 5.14 0.00 1.64 1.73 0.00 1.80 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.42 7.81 78 L 8.43 4.49 0.00 1.84 1.82 1.18 0.79 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 79 K 8.67 5.04 0.00 1.68 1.79 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.75 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.48 7.81 80 C 8.68 4.64 0.00 2.85 2.70 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 0.00 0.00 0.00 81 T 8.45 4.44 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 1.24 0.00 0.00 82 V 7.89 3.67 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 0.50 0.00 0.00 -0.74 0.00 0.00 83 H 8.11 5.19 0.00 3.15 3.30 0.00 5.30 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 84 L 8.50 5.11 0.00 1.58 1.66 1.13 0.54 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 85 A 8.60 4.44 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 86 N 9.81 4.08 0.00 2.92 2.95 0.00 0.00 7.23 7.67 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 87 G 9.26 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 88 K 7.69 4.66 0.00 2.02 1.88 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.66 7.81 89 L 7.76 4.34 0.00 1.00 1.26 0.52 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 90 V 8.41 4.74 2.08 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 1.04 0.00 0.00 1.04 0.00 0.00 91 T 8.94 4.60 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 1.15 0.00 0.00 92 K 8.37 4.37 0.00 1.73 1.84 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.41 7.81 93 S 7.68 4.19 0.00 3.39 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 94 E 7.68 4.52 0.00 1.79 1.78 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 2.10 2.12 0.00 95 K 6.72 4.14 0.00 1.66 1.65 0.00 2.12 0.00 0.00 1.85 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.75 0.34 7.81 96 F 5.77 4.41 0.00 3.18 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.58 5.32 0.00 3.84 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 98 H 8.76 4.98 0.00 3.16 3.13 0.00 5.58 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.84 5.16 0.00 2.11 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 2.23 2.27 0.00 100 Q 9.02 5.00 0.00 2.16 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.73 0.00 0.00 0.00 0.00 0.00 2.40 2.29 0.00 101 E 9.20 5.41 0.00 1.94 1.78 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 2.31 2.46 0.00 102 V 7.58 4.17 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 0.03 0.00 0.00 0.69 0.00 0.00 103 K 8.49 4.34 0.00 1.71 1.72 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.29 1.27 7.81 104 G 8.42 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 0.00 105 N 9.07 4.96 0.00 2.86 2.84 0.00 0.00 6.59 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.04 5.42 0.00 1.91 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 2.22 2.29 0.00 107 M 9.76 4.70 0.00 1.24 1.37 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.16 0.00 108 V 9.03 4.76 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 0.97 0.00 0.00 0.90 0.00 0.00 109 E 9.42 5.09 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 2.38 2.15 0.00 110 T 9.95 5.52 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 0.00 111 I 8.06 5.04 1.34 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.32 1.25 0.00 0.00 112 T 8.48 5.47 4.33 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 1.29 0.00 0.00 113 F 9.86 4.53 0.00 2.75 1.83 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 0.00 114 G 9.14 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 8.47 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 0.00 0.00 0.00 116 V 7.62 4.55 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 1.05 0.00 0.00 1.00 0.00 0.00 117 T 8.69 5.31 4.30 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 1.28 0.00 0.00 118 L 8.92 4.63 0.00 0.79 0.14 0.98 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 119 I 8.08 4.66 1.82 0.00 0.00 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 1.18 0.78 0.85 0.00 0.00 120 R 8.70 4.51 0.00 1.82 1.71 0.00 3.05 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 121 R 8.68 5.00 0.00 1.39 1.58 0.00 3.15 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.46 0.00 122 S 9.71 5.73 0.00 3.78 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 0.00 123 K 8.90 5.05 0.00 1.41 1.52 0.00 1.17 0.00 0.00 1.38 0.00 0.00 2.70 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.25 1.21 7.81 124 R 8.39 4.53 0.00 1.04 1.53 0.00 2.74 0.00 0.00 2.63 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.61 0.00 125 V 7.81 3.97 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 0.86 0.00 0.00 0.94 0.00 0.00