NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.5078 8.1233 122.4787 51.9650 20.4650 175.6190 2 F 4.7115 8.9389 119.0227 55.2006 41.4173 169.9297 3 V 4.5410 9.2079 121.1508 61.1847 34.9987 174.2082 4 V 4.6442 9.1781 128.5184 62.5827 32.4936 175.4947 5 T 4.1694 8.5692 119.1958 59.9175 71.2129 173.6430 6 D 4.0838 7.8860 118.2568 57.9910 41.1786 178.8896 7 N 4.6250 8.0403 114.8720 55.4120 39.5187 175.1745 8 C 4.4027 8.2308 118.3873 62.5928 31.9345 173.8227 9 I 4.1895 7.6336 120.5590 62.7914 36.8671 175.9169 10 K 3.7333 8.7662 122.9933 57.2340 30.0559 175.2816 11 C 4.2793 8.1231 114.7446 60.1322 31.0558 173.6433 12 K 3.9248 7.7915 117.3398 57.8079 29.8682 175.0484 13 Y 3.9928 7.7852 117.5194 59.2716 38.8156 177.5666 14 T 3.2880 8.1554 106.6112 62.1213 68.2775 172.9717 15 D 4.3745 8.0626 123.3076 58.0548 40.1115 178.3903 16 C 4.0425 7.8213 114.3754 61.2316 29.3062 176.0704 17 V 3.4165 7.3911 114.1604 63.2827 30.7995 178.1719 18 E 3.9479 7.7230 118.2537 58.8164 29.4113 178.6561 19 V 4.1560 7.0630 114.9060 60.8537 31.4987 175.5513 20 C 4.3547 7.4653 122.2846 58.4863 31.6825 172.4030 21 P 4.4201 0.0000 0.0000 65.0507 31.2596 177.4397 22 V 4.1546 7.1571 106.5249 60.0534 32.4496 175.4568 23 D 4.4548 7.9080 118.6034 55.9293 37.9472 173.1812 24 C 5.0576 7.5203 108.2811 58.1081 31.4481 174.8452 25 F 5.2694 8.1674 117.5136 57.3481 41.1959 174.6904 26 Y 5.0536 9.0693 119.5574 56.2250 42.0067 173.8347 27 E 4.6201 9.5486 125.1282 54.6027 30.9735 175.3518 28 G 2.2145 7.5040 115.0055 41.7476 0.0000 170.9656 29 P 4.2913 0.0000 0.0000 65.2381 31.4156 177.7655 30 N 5.0125 7.5506 114.3491 51.7537 37.9820 173.1905 31 F 5.1172 7.6873 117.1081 58.4916 42.1786 171.9980 32 L 5.3312 8.0196 124.8779 53.1036 44.5609 175.9844 33 V 4.6353 8.8781 113.8079 59.7405 36.0696 174.3998 34 I 4.6114 8.4079 122.6542 59.8163 39.2568 174.9794 35 H 4.4305 9.3500 128.2098 54.9658 29.9221 174.3043 36 P 4.3539 0.0000 0.0000 66.0542 31.1693 177.7719 37 D 4.5235 8.1938 117.5328 56.8910 40.9836 177.8316 38 E 4.1521 8.0617 117.8908 57.7045 30.1607 176.9944 39 C 4.1146 7.5435 119.0125 59.8099 31.7200 173.0342 40 I 4.3047 8.4040 118.3122 59.9559 37.3076 175.2562 41 D 5.2270 8.2020 119.0739 55.7700 38.5916 175.0904 42 C 3.8344 7.5322 113.5654 58.9303 29.7241 174.3445 43 A 2.7582 6.9767 122.0490 52.5414 16.4804 179.0350 44 L 4.1020 7.1980 117.1624 57.9087 42.1548 178.9545 45 C 4.2755 7.8639 113.8830 60.6456 29.6950 175.4711 46 A 4.0026 7.3784 123.6300 54.7723 17.7611 177.8922 47 P 4.3177 0.0000 0.0000 65.1426 31.5609 178.0201 48 E 4.2512 7.7546 115.8717 56.6228 29.9764 176.3039 49 C 4.2244 7.3299 119.8205 58.3636 31.9103 172.4357 50 P 3.9916 0.0000 0.0000 65.4451 30.9593 177.2467 51 A 4.4017 8.0831 117.6481 52.5379 18.7455 176.9726 52 Q 3.0711 7.5365 114.5885 56.8053 26.8481 174.6684 53 A 4.5941 7.7194 119.0672 52.6518 20.7669 178.0345 54 I 4.9208 7.5308 116.2635 59.9907 38.9224 175.3516 55 F 4.8272 9.0066 123.9057 55.2899 43.7387 174.4823 56 S 2.8511 8.3342 116.0521 57.5520 63.0113 174.4427 57 E 3.8563 8.4275 128.5497 59.5723 29.2939 178.2372 58 D 4.7409 7.8560 114.0325 53.9500 39.7458 176.0353 59 E 4.6068 8.2548 118.0136 55.8560 30.8351 176.0146 60 V 3.1965 7.4050 120.1325 61.9984 32.0750 174.3427 61 P 4.2515 0.0000 0.0000 62.4227 31.6657 176.7486 62 E 3.8665 8.8324 121.6311 59.5307 29.5877 178.0830 63 D 4.8505 7.9860 114.7098 53.9289 39.5967 176.0314 64 M 5.1842 8.0578 117.0876 53.9555 33.6648 177.3192 65 Q 4.0042 7.9272 120.4059 59.2189 28.2734 178.7721 66 E 3.9462 8.2038 119.1047 59.2912 29.4197 179.0429 67 F 4.1661 8.5329 117.7721 59.8534 38.6956 177.7738 68 I 3.7548 7.7309 119.8810 64.6049 36.9956 178.1759 69 Q 3.9403 7.9878 119.7833 58.7485 28.9014 177.5349 70 L 3.8691 7.8363 121.5368 58.0767 42.1765 178.6454 71 N 4.3526 8.5069 116.3048 56.2596 38.2724 177.2466 72 A 3.8529 7.4335 120.9188 55.1176 18.6721 179.3286 73 E 3.9202 8.1066 117.0111 59.6021 29.5824 179.5333 74 L 3.5834 8.0685 118.2222 56.5681 41.3146 179.1404 75 A 3.8129 7.4092 120.2311 54.6320 18.3059 179.0372 76 E 3.9303 7.5468 116.3639 58.2658 29.6400 177.9962 77 V 4.2998 7.3242 109.5083 60.9533 33.8334 175.9102 78 W 5.0271 8.0667 119.6949 54.9579 30.3179 174.2851 79 P 4.7206 0.0000 0.0000 62.5212 32.3196 175.0990 80 N 4.1596 8.8843 120.9763 53.8004 39.5945 173.5418 81 I 4.5887 8.2182 126.4986 59.4787 39.7051 175.1116 82 T 4.5280 8.7621 117.2223 61.0116 70.2076 173.4345 83 E 4.6111 7.7649 121.5531 53.8868 32.1992 175.6934 84 K 3.9542 7.6144 122.0679 56.8508 32.7732 175.5935 85 K 4.5471 8.3829 121.1474 55.6502 35.5022 175.4277 86 D 4.5807 8.3359 117.9931 53.4868 41.3302 174.8812 87 P 4.7075 0.0000 0.0000 61.5956 32.2987 176.5615 88 L 4.1191 7.7997 120.1491 54.6355 42.1585 177.1042 89 P 4.3426 0.0000 0.0000 65.0022 31.6869 177.2837 90 D 4.9482 7.9089 116.5514 53.7916 41.3601 177.9818 91 A 4.1629 7.8719 125.8071 55.0981 18.2903 180.0508 92 E 4.5086 8.0433 110.7200 57.0594 30.5998 177.1288 93 D 4.3773 7.9531 119.8467 57.0992 41.0911 177.4562 94 W 4.3462 8.0550 117.0469 57.3771 29.7042 175.2395 95 D 4.7355 7.6697 118.7258 57.3939 40.1516 175.9502 96 G 4.1171 9.7349 116.1661 45.1431 0.0000 173.3655 97 V 3.7857 7.6648 120.3228 62.5038 32.0925 175.5981 98 K 4.4569 8.5398 125.6672 56.8434 34.1824 175.8642 99 G 3.9107 8.7871 105.6991 46.8930 0.0000 174.8344 100 K 4.3538 8.7210 118.8885 57.0078 32.6379 179.1769 101 L 3.9343 8.0347 122.4956 57.8767 42.0997 178.7801 102 Q 3.9931 8.0077 115.0797 58.5175 28.5926 176.3241 103 H 4.5438 7.9408 114.8410 55.4335 29.1421 175.1852 104 L 4.2116 7.9479 123.2320 55.0250 42.4112 175.7669 105 E 4.7309 8.4814 125.2013 54.4468 31.7327 176.1723 106 R 4.5335 8.6827 121.9875 56.8036 30.2150 175.9074 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 8.12 4.51 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.94 4.71 0.00 2.93 3.05 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 3 V 9.21 4.54 2.19 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 1.10 0.00 0.00 0.97 0.00 0.00 4 V 9.18 4.64 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 0.94 0.00 0.00 1.08 0.00 0.00 5 T 8.57 4.17 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 1.22 0.00 0.00 6 D 7.89 4.08 0.00 2.59 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 7 N 8.04 4.63 0.00 2.79 3.02 0.00 0.00 6.91 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 8 C 8.23 4.40 0.00 3.19 3.46 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 9 I 7.63 4.19 1.94 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.49 0.83 0.00 0.00 10 K 8.77 3.73 0.00 1.47 1.31 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.57 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.93 0.80 7.81 11 C 8.12 4.28 0.00 3.07 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 12 K 7.79 3.92 0.00 1.85 1.63 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.40 7.81 13 Y 7.79 3.99 0.00 2.99 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 14 T 8.16 3.29 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 1.19 0.00 0.00 15 D 8.06 4.37 0.00 2.63 2.71 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 16 C 7.82 4.04 0.00 2.81 3.05 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 17 V 7.39 3.42 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 0.36 0.00 0.00 0.85 0.00 0.00 18 E 7.72 3.95 0.00 2.04 1.97 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 2.31 2.32 0.00 19 V 7.06 4.16 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 0.82 0.00 0.00 0.90 0.00 0.00 20 C 7.47 4.35 0.00 3.30 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 21 P 0.00 4.42 0.00 2.21 2.16 0.00 3.77 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 22 V 7.16 4.15 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 0.72 0.00 0.00 0.99 0.00 0.00 23 D 7.91 4.45 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 24 C 7.52 5.06 0.00 3.04 3.13 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 25 F 8.17 5.27 0.00 2.98 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 26 Y 9.07 5.05 0.00 3.15 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 27 E 9.55 4.62 0.00 1.86 1.74 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 2.01 2.11 0.00 28 G 7.50 2.21 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 0.00 29 P 0.00 4.29 0.00 2.00 2.07 0.00 3.62 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.96 0.00 30 N 7.55 5.01 0.00 2.72 2.87 0.00 0.00 5.71 8.12 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 31 F 7.69 5.12 0.00 3.06 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 32 L 8.02 5.33 0.00 1.48 1.65 0.85 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.88 4.64 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 0.82 0.00 0.00 1.24 0.00 0.00 34 I 8.41 4.61 1.96 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 0.19 0.19 0.79 0.00 0.00 35 H 9.35 4.43 0.00 3.18 3.27 0.00 5.59 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.35 0.00 2.27 2.18 0.00 3.62 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 1.97 2.01 0.00 37 D 8.19 4.52 0.00 2.66 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 38 E 8.06 4.15 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 2.25 2.15 0.00 39 C 7.54 4.11 0.00 2.96 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 40 I 8.40 4.30 1.88 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 1.40 0.72 0.97 0.00 0.00 41 D 8.20 5.23 0.00 2.96 2.98 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 42 C 7.53 3.83 0.00 2.91 3.13 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 43 A 6.98 2.76 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 44 L 7.20 4.10 0.00 1.60 1.68 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 45 C 7.86 4.28 0.00 3.30 3.33 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 0.00 46 A 7.38 4.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.32 0.00 2.00 2.10 0.00 3.78 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.15 0.00 48 E 7.75 4.25 0.00 2.04 1.93 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 2.45 2.40 0.00 49 C 7.33 4.22 0.00 3.00 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 50 P 0.00 3.99 0.00 0.65 1.54 0.00 3.47 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 1.27 1.72 0.00 51 A 8.08 4.40 1.51 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 0.00 0.00 52 Q 7.54 3.07 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 53 A 7.72 4.59 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 54 I 7.53 4.92 1.93 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.75 1.19 0.00 0.00 55 F 9.01 4.83 0.00 2.95 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 56 S 8.33 2.85 0.00 3.21 3.49 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 57 E 8.43 3.86 0.00 2.23 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 2.29 2.27 0.00 58 D 7.86 4.74 0.00 2.78 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 59 E 8.25 4.61 0.00 2.09 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 2.24 2.18 0.00 60 V 7.40 3.20 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 0.70 0.00 0.00 0.99 0.00 0.00 61 P 0.00 4.25 0.00 2.10 1.83 0.00 2.92 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 62 E 8.83 3.87 0.00 1.93 1.93 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 2.36 2.24 0.00 63 D 7.99 4.85 0.00 2.84 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 64 M 8.06 5.18 0.00 2.19 1.97 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.58 0.00 65 Q 7.93 4.00 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.19 6.79 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 66 E 8.20 3.95 0.00 1.71 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.34 0.00 67 F 8.53 4.17 0.00 3.33 3.39 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 68 I 7.73 3.75 1.99 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 1.44 0.73 0.92 0.00 0.00 69 Q 7.99 3.94 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.90 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 70 L 7.84 3.87 0.00 1.98 1.71 0.80 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 71 N 8.51 4.35 0.00 3.02 3.06 0.00 0.00 6.92 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 72 A 7.43 3.85 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 73 E 8.11 3.92 0.00 1.85 1.86 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 2.42 2.39 0.00 74 L 8.07 3.58 0.00 1.19 0.17 0.62 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 75 A 7.41 3.81 0.99 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 0.00 0.00 76 E 7.55 3.93 0.00 1.92 1.93 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 2.35 2.37 0.00 77 V 7.32 4.30 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 0.68 0.00 0.00 0.71 0.00 0.00 78 W 8.07 5.03 0.00 3.59 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 79 P 0.00 4.72 0.00 2.16 2.25 0.00 3.96 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.97 0.00 80 N 8.88 4.16 0.00 2.66 2.67 0.00 0.00 6.77 7.94 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 81 I 8.22 4.59 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.00 0.93 0.00 0.00 82 T 8.76 4.53 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 1.26 0.00 0.00 83 E 7.76 4.61 0.00 1.90 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 2.16 2.21 0.00 84 K 7.61 3.95 0.00 1.94 1.69 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.49 7.81 85 K 8.38 4.55 0.00 1.79 1.71 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.29 1.36 7.81 86 D 8.34 4.58 0.00 2.67 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 87 P 0.00 4.71 0.00 2.02 1.78 0.00 3.77 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.36 0.00 88 L 7.80 4.12 0.00 1.72 1.53 0.83 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.34 0.00 2.05 2.10 0.00 3.64 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 90 D 7.91 4.95 0.00 2.92 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 91 A 7.87 4.16 1.16 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 92 E 8.04 4.51 0.00 2.15 2.22 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 2.30 2.46 0.00 93 D 7.95 4.38 0.00 2.71 2.43 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 0.00 94 W 8.05 4.35 0.00 3.36 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 95 D 7.67 4.74 0.00 2.99 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 96 G 9.73 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 0.00 0.00 0.00 97 V 7.66 3.79 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 1.03 0.00 0.00 0.86 0.00 0.00 98 K 8.54 4.46 0.00 1.95 1.84 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.48 7.81 99 G 8.79 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 0.00 100 K 8.72 4.35 0.00 2.06 1.86 0.00 1.85 0.00 0.00 2.04 0.00 0.00 3.28 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.65 1.66 7.81 101 L 8.03 3.93 0.00 1.97 1.69 0.65 0.47 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 0.00 102 Q 8.01 3.99 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.11 0.00 103 H 7.94 4.54 0.00 3.12 3.15 0.00 5.86 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.95 4.21 0.00 1.45 1.60 0.80 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.48 4.73 0.00 1.96 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 2.25 2.19 0.00 106 R 8.68 4.53 0.00 1.87 1.93 0.00 3.27 0.00 0.00 3.32 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.76 0.00