NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 K 4.3477 8.3149 120.0818 56.3997 33.0582 174.7554 12 R 4.5288 7.4256 117.4251 52.0843 33.9439 175.3226 13 Q 4.2679 8.7942 121.5071 56.9869 26.6200 176.4972 14 V 3.6955 8.1486 128.8605 62.1479 29.6630 175.1085 15 A 3.9932 8.3910 124.6825 54.9965 18.7556 176.8039 16 S 4.4043 8.3304 117.9679 58.8063 64.1857 174.0168 17 G 4.3047 8.3515 111.7657 44.5185 0.0000 171.6578 18 R 4.5555 8.3496 116.9483 54.4089 33.8780 174.6044 19 A 4.7854 8.1802 125.9971 50.3934 21.4409 174.4793 20 Y 4.6550 8.5550 119.7034 57.3987 39.8697 175.1847 21 I 4.4790 8.1785 126.0631 59.8803 39.4080 174.5210 22 H 6.0365 8.9805 125.3523 53.4467 32.8565 171.8979 23 A 4.7405 8.7105 125.8549 50.8982 22.8330 174.2328 24 S 4.8065 8.3507 113.2315 57.6595 67.0063 173.5108 25 Y 4.6707 8.5532 117.3226 58.0466 38.3453 176.4556 26 N 4.8730 7.6480 114.3317 54.4771 41.7254 173.6380 27 N 4.6122 7.5941 111.1914 52.8322 41.4222 173.0340 28 T 4.6027 8.1865 120.4884 61.6894 72.2194 172.4809 29 I 4.4989 7.9410 126.1149 59.1954 40.4869 174.2040 30 V 4.4800 8.1924 127.2040 61.5189 33.8833 174.2970 31 T 4.9727 8.5292 122.7244 61.8217 72.4907 173.0684 32 I 4.8950 8.4074 124.5652 59.8729 40.6625 174.7528 33 T 5.0255 8.6282 116.4499 59.8508 72.6626 172.9763 34 D 4.7407 8.4561 122.1870 51.3290 41.7412 175.9673 35 P 4.6279 0.0000 0.0000 62.9415 30.7933 177.4735 36 D 4.5924 8.7796 116.1846 53.7387 40.1969 175.5591 37 G 4.7129 8.3359 112.7975 46.6703 0.0000 174.6009 38 N 3.9788 7.6132 114.6059 51.6325 38.7238 172.4577 39 P 4.5011 0.0000 0.0000 62.8835 31.9558 174.4226 40 I 4.5279 7.8579 119.9980 60.8383 40.5430 177.7082 41 T 5.0975 6.3134 115.8655 61.9986 72.0514 172.2654 42 W 4.7213 7.6200 115.8221 59.1497 31.4742 173.4559 43 S 4.1914 7.4085 114.7192 58.7933 66.2177 176.9906 44 S 4.7288 7.5607 118.7023 55.9130 66.0699 175.0722 45 G 3.6214 8.7132 109.9730 47.7360 0.0000 176.2630 46 G 4.2450 8.1433 108.1335 46.8179 0.0000 175.7271 47 V 3.7253 7.9064 113.5762 64.2574 31.7245 178.5009 48 I 3.9510 7.5247 117.4503 62.5355 36.8692 175.6992 49 G 3.6042 7.2216 109.6588 45.4413 0.0000 173.3240 50 Y 4.7570 8.4990 118.3604 55.9503 41.6263 174.3096 51 K 4.6741 9.0588 125.2688 56.6858 35.5845 179.0270 52 G 3.9377 8.7382 122.1421 46.6024 0.0000 171.9760 53 S 4.1634 7.9646 123.9522 57.3918 63.9208 172.7671 54 R 3.6322 8.1517 112.7034 58.2060 28.9658 176.2895 55 K 4.1596 5.6600 125.0828 56.0813 31.8508 175.3869 56 G 4.0021 7.6080 109.3310 44.4721 0.0000 172.1887 57 T 4.1835 8.2786 116.7454 61.0329 69.9986 171.7577 58 P 4.0353 0.0000 0.0000 66.1012 31.4664 177.5223 59 Y 4.2318 7.9407 119.3029 58.7275 38.7720 179.4478 60 A 2.5800 6.5579 117.8483 53.3735 20.8236 179.3268 61 A 3.8027 8.2338 116.4670 54.7097 18.6155 179.4995 62 Q 3.8594 8.6627 119.0881 59.5603 28.8606 178.9714 63 L 3.8484 7.6864 119.6717 57.4981 41.5580 178.9875 64 A 3.9839 7.4876 119.3463 54.7941 18.2118 178.4380 65 A 4.1545 8.1967 120.3862 53.0784 18.5208 179.9373 66 L 3.6541 7.1892 116.2031 57.5898 43.0641 179.4698 67 D 4.2139 7.9218 118.8165 57.4703 40.3796 178.3729 68 A 3.8708 7.6698 120.8229 55.6616 18.1144 179.2794 69 A 3.8953 8.7514 119.4049 55.2952 18.2808 180.2479 70 K 3.9949 7.5732 116.1156 59.2484 33.4448 178.4827 71 K 3.9541 8.2688 115.3927 58.0113 31.2389 177.8954 72 A 3.9397 5.8000 129.6848 54.6523 19.7971 180.5574 73 M 3.8241 7.9296 116.5208 58.5019 32.3688 177.8402 74 A 4.5723 6.8988 118.5481 52.5490 18.0895 177.3779 75 Y 4.8831 7.2035 114.7372 57.6526 40.4429 173.5930 76 G 3.9373 7.9657 109.3902 46.3431 0.0000 173.6336 77 M 4.3842 7.7628 124.2530 55.3286 30.8904 176.6464 78 Q 4.0900 8.3716 122.3763 57.0817 29.8806 178.6347 79 S 4.7041 5.8100 120.5136 58.5011 62.3830 175.1740 80 V 4.3027 7.2353 112.7465 60.0845 32.0379 176.7694 81 D 5.2079 8.6139 125.4581 54.4402 42.1350 176.6647 82 V 4.3944 8.7442 115.3940 59.8226 33.9655 174.6792 83 I 5.4926 8.0494 125.7576 58.5449 41.2183 175.6214 84 V 4.3556 8.0719 117.3505 60.3171 35.3107 175.2356 85 R 5.3835 8.2960 119.7697 58.1071 34.6788 176.0958 86 G 3.8977 9.4108 112.0838 44.6421 0.0000 171.7650 87 T 4.5338 8.2093 107.8823 59.8634 70.1463 173.3586 88 G 3.5423 8.1255 113.3133 43.9133 0.0000 171.7949 89 A 3.8812 6.8929 121.3031 52.5698 19.2246 179.1658 90 G 4.5391 8.7081 108.3384 45.6710 0.0000 176.2153 91 R 3.8725 7.7892 110.7590 58.3061 28.1762 178.4013 92 E 3.9458 9.4269 114.3369 59.2440 29.5933 176.6747 93 Q 3.8220 7.8295 116.3707 59.6179 29.6522 178.9639 94 A 3.9782 8.5702 119.8735 55.7447 19.1854 178.6241 95 I 4.3218 8.2841 116.8778 59.6438 33.8443 174.6384 96 R 4.2441 7.0978 132.1572 57.1435 33.3522 175.5206 97 A 4.0723 8.0870 122.3988 53.9133 18.1896 178.1384 98 L 3.8040 7.4969 114.1991 56.9413 42.0884 179.0705 99 Q 3.7984 8.3350 121.4703 59.5284 29.1058 177.7102 100 A 4.4822 7.3156 120.5682 51.5313 18.6421 176.6217 101 S 4.5329 7.7803 121.3230 59.6771 67.9870 176.3101 102 G 4.2711 8.7935 110.4088 43.3884 0.0000 172.7413 103 L 4.0806 8.1467 120.7197 54.1082 43.0985 176.1626 104 Q 3.9229 7.8088 118.5197 55.5892 29.5662 178.1572 105 V 4.1338 8.1354 119.6268 61.2336 31.7886 177.1452 106 K 3.8030 7.3339 117.3141 57.8178 33.7925 173.4066 107 S 3.9112 8.7228 123.2318 57.9816 60.9793 169.5808 108 I 4.6208 8.0415 128.4164 60.1571 38.0978 175.5943 109 V 4.4734 8.1772 125.4215 61.9697 35.3395 171.7528 110 D 5.3001 8.3756 123.3480 52.8546 44.5981 174.1388 111 D 4.6830 8.5875 119.8282 53.7750 45.3528 174.6420 112 T 4.9103 8.2951 120.3640 62.5771 71.8924 171.3251 113 P 4.6991 0.0000 0.0000 61.8639 33.0543 175.4910 114 V 4.2935 7.6487 116.7148 61.7134 34.0940 171.2681 115 P 4.5029 0.0000 0.0000 64.8594 31.7814 176.4298 116 H 3.8010 9.1541 109.8140 58.0153 26.9434 173.1340 117 N 4.1253 7.8952 120.5375 53.9912 36.5836 175.3994 118 G 4.0887 7.8858 116.2456 44.8811 0.0000 170.8300 119 C 4.2750 8.5672 123.6443 59.3068 28.6566 173.0401 120 R 4.1047 8.4460 120.0889 56.0736 30.1927 174.6294 121 P 5.2358 0.0000 0.0000 61.3845 33.4580 173.7516 122 K 4.4911 7.7918 115.6644 54.6219 35.4865 177.5011 123 K 3.8840 8.4286 122.5942 59.4341 32.4358 177.6028 124 K 3.7017 7.2264 120.8895 59.2604 32.1247 177.1124 125 F 4.6090 6.7546 112.7437 57.1254 38.9340 175.6808 126 R 4.2287 7.0800 126.1577 56.7560 29.8031 175.5978 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 11 K 8.31 4.35 0.00 1.72 1.89 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.44 1.34 7.81 12 R 7.43 4.53 0.00 1.84 1.79 0.00 3.21 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 13 Q 8.79 4.27 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 7.38 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 14 V 8.15 3.70 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 1.01 0.00 0.00 1.02 0.00 0.00 15 A 8.39 3.99 1.25 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 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.33 4.40 0.00 3.80 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 17 G 8.35 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 0.00 0.00 0.00 0.00 18 R 8.35 4.56 0.00 2.13 1.84 0.00 3.11 0.00 0.00 3.50 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.62 0.00 19 A 8.18 4.79 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 20 Y 8.56 4.66 0.00 3.02 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 21 I 8.18 4.48 2.08 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 1.13 0.65 0.93 0.00 0.00 22 H 8.98 6.04 0.00 3.30 3.09 0.00 5.60 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.71 4.74 1.11 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 0.00 0.00 24 S 8.35 4.81 0.00 3.90 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 25 Y 8.55 4.67 0.00 2.96 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 26 N 7.65 4.87 0.00 2.76 2.80 0.00 0.00 6.79 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 27 N 7.59 4.61 0.00 2.67 2.62 0.00 0.00 6.75 7.70 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 28 T 8.19 4.60 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 1.19 0.00 0.00 29 I 7.94 4.50 1.84 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 1.16 1.74 0.53 0.00 0.00 30 V 8.19 4.48 2.31 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 0.99 0.00 0.00 0.96 0.00 0.00 31 T 8.53 4.97 4.31 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 1.15 0.00 0.00 32 I 8.41 4.90 2.12 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.66 1.04 0.00 0.00 33 T 8.63 5.03 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 34 D 8.46 4.74 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 35 P 0.00 4.63 0.00 2.08 2.19 0.00 3.77 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.26 0.00 36 D 8.78 4.59 0.00 2.70 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 37 G 8.34 4.71 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 38 N 7.61 3.98 0.00 3.55 2.73 0.00 0.00 6.75 7.91 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 39 P 0.00 4.50 0.00 2.12 1.97 0.00 3.70 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 1.96 1.94 0.00 40 I 7.86 4.53 1.92 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 1.70 0.94 0.92 0.00 0.00 41 T 6.31 5.10 4.40 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 1.27 0.00 0.00 42 W 7.62 4.72 0.00 3.61 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 43 S 7.41 4.19 0.00 3.74 3.61 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 44 S 7.56 4.73 0.00 4.19 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 45 G 8.71 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.14 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 0.00 0.00 0.00 0.00 47 V 7.91 3.73 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 1.20 0.00 0.00 0.80 0.00 0.00 48 I 7.52 3.95 2.08 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 1.39 0.56 1.03 0.00 0.00 49 G 7.22 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.50 4.76 0.00 3.03 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 51 K 9.06 4.67 0.00 1.83 1.12 0.00 1.58 0.00 0.00 1.82 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.54 7.81 52 G 8.74 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 53 S 7.96 4.16 0.00 4.06 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 54 R 8.15 3.63 0.00 1.98 1.66 0.00 3.62 0.00 0.00 3.31 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.71 0.00 55 K 5.66 4.16 0.00 2.32 1.98 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.72 7.81 56 G 7.61 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.28 4.18 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 58 P 0.00 4.04 0.00 2.27 2.05 0.00 3.69 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 2.16 2.14 0.00 59 Y 7.94 4.23 0.00 2.88 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 60 A 6.56 2.58 1.04 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 0.00 0.00 0.00 0.00 0.00 0.00 61 A 8.23 3.80 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 62 Q 8.66 3.86 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 63 L 7.69 3.85 0.00 1.38 1.47 0.95 -0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 64 A 7.49 3.98 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 65 A 8.20 4.15 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 66 L 7.19 3.65 0.00 1.67 1.74 0.89 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 67 D 7.92 4.21 0.00 2.57 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.67 3.87 1.37 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 0.00 0.00 0.00 69 A 8.75 3.90 1.32 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 0.00 0.00 70 K 7.57 3.99 0.00 1.70 1.83 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.43 1.72 7.81 71 K 8.27 3.95 0.00 1.93 1.80 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.65 1.46 7.81 72 A 5.80 3.94 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 73 M 7.93 3.82 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.44 0.00 74 A 6.90 4.57 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 75 Y 7.20 4.88 0.00 2.97 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 76 G 7.97 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 77 M 7.76 4.38 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.45 0.00 78 Q 8.37 4.09 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.29 0.00 0.00 0.00 0.00 0.00 2.61 2.31 0.00 79 S 5.81 4.70 0.00 3.84 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 80 V 7.24 4.30 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 0.85 0.00 0.00 1.06 0.00 0.00 81 D 8.61 5.21 0.00 2.59 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.74 4.39 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 0.82 0.00 0.00 1.03 0.00 0.00 83 I 8.05 5.49 1.74 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 1.20 1.26 0.88 0.00 0.00 84 V 8.07 4.36 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 0.82 0.00 0.00 0.96 0.00 0.00 85 R 8.30 5.38 0.00 2.07 1.79 0.00 3.20 0.00 0.00 3.30 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.46 0.00 86 G 9.41 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 0.00 0.00 0.00 87 T 8.21 4.53 4.40 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 1.25 0.00 0.00 88 G 8.13 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 89 A 6.89 3.88 1.02 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 0.00 0.00 90 G 8.71 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.79 3.87 0.00 1.94 1.68 0.00 2.92 0.00 0.00 3.10 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.58 0.00 92 E 9.43 3.95 0.00 1.93 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 2.30 2.45 0.00 93 Q 7.83 3.82 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.64 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 94 A 8.57 3.98 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 95 I 8.28 4.32 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 1.17 0.65 0.90 0.00 0.00 96 R 7.10 4.24 0.00 1.90 2.09 0.00 3.19 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.42 0.00 97 A 8.09 4.07 1.29 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 98 L 7.50 3.80 0.00 1.70 1.55 0.91 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.33 3.80 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.70 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 100 A 7.32 4.48 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 0.00 101 S 7.78 4.53 0.00 3.92 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 0.00 102 G 8.79 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 0.00 0.00 0.00 0.00 103 L 8.15 4.08 0.00 1.58 1.78 0.99 0.62 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 0.00 104 Q 7.81 3.92 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 105 V 8.14 4.13 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 0.71 0.00 0.00 0.91 0.00 0.00 106 K 7.33 3.80 0.00 1.73 1.74 0.00 1.78 0.00 0.00 1.56 0.00 0.00 2.75 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.55 7.81 107 S 8.72 3.91 0.00 4.00 3.85 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 0.00 108 I 8.04 4.62 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 1.22 0.56 0.90 0.00 0.00 109 V 8.18 4.47 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 0.89 0.00 0.00 0.90 0.00 0.00 110 D 8.38 5.30 0.00 2.66 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 0.00 111 D 8.59 4.68 0.00 2.75 2.53 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 0.00 112 T 8.30 4.91 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 1.19 0.00 0.00 113 P 0.00 4.70 0.00 2.16 2.03 0.00 3.77 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.93 0.00 114 V 7.65 4.29 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 0.73 0.00 0.00 0.88 0.00 0.00 115 P 0.00 4.50 0.00 2.16 2.10 0.00 3.88 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 116 H 9.15 3.80 0.00 3.37 3.48 0.00 5.68 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 N 7.90 4.13 0.00 2.89 2.92 0.00 0.00 7.01 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 0.00 118 G 7.89 4.09 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 0.00 0.00 0.00 119 C 8.57 4.27 0.00 2.98 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 0.00 120 R 8.45 4.10 0.00 1.81 1.89 0.00 3.17 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 121 P 0.00 5.24 0.00 2.45 2.25 0.00 3.73 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.08 0.00 122 K 7.79 4.49 0.00 1.58 1.47 0.00 1.55 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.36 7.81 123 K 8.43 3.88 0.00 1.87 2.03 0.00 1.48 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.39 7.81 124 K 7.23 3.70 0.00 1.53 1.51 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.50 7.81 125 F 6.75 4.61 0.00 3.08 3.19 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 0.00 126 R 7.08 4.23 0.00 1.94 1.74 0.00 3.41 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00