NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 Q 4.4182 8.3449 118.8260 56.4470 28.5275 175.0836 5 K 4.3934 8.0598 117.9663 55.8770 33.3803 175.7611 6 C 4.3836 8.4397 113.3382 57.9624 37.5421 172.8981 7 N 4.5704 7.5320 118.6407 53.3014 38.6305 175.4787 8 L 4.1640 8.6934 126.1227 55.7227 41.9863 177.5680 9 Q 3.9288 7.3563 117.3858 56.8423 28.8644 175.9935 10 G 3.5276 8.0529 107.4270 44.0543 0.0000 171.5767 11 Q 4.9329 7.9486 118.3586 54.2594 30.3329 175.5818 12 W 5.3697 9.3652 122.4471 55.0583 34.0944 174.1296 13 R 5.3451 9.5766 122.0324 54.9055 33.5870 174.2822 14 N 5.6782 8.4766 122.4366 50.3391 39.8722 175.8331 15 K 4.1116 8.4982 117.2368 59.1245 32.2463 178.7755 16 L 4.0608 7.9606 117.4942 56.1055 41.7826 177.9074 17 G 3.9837 8.2101 106.6058 45.1108 0.0000 173.7280 18 S 4.5266 8.5245 115.9704 58.4231 64.4370 172.8355 19 N 5.3426 9.0113 120.9613 51.5572 40.8494 173.4993 20 L 4.7288 8.9087 126.3847 53.1286 44.7596 174.8952 21 I 4.9828 8.5898 127.0070 59.5223 40.4748 174.4283 22 I 4.6957 8.5929 127.9892 59.4902 39.8832 175.8624 23 E 4.5033 8.9334 127.2629 54.8403 31.2598 176.4134 24 S 3.9670 8.6354 115.5903 59.5033 63.1154 174.9485 25 V 4.0230 8.2459 125.0084 62.4492 32.0727 175.9924 26 S 4.5214 9.0599 124.1526 57.7685 63.5216 175.2114 27 Q 3.9916 8.6523 119.6650 59.0038 28.1617 177.0952 28 N 4.6256 8.1981 113.3135 52.5795 38.0111 175.6438 29 G 4.2630 8.4261 108.3008 46.2223 0.0000 173.0866 30 E 4.5471 8.4784 121.9698 56.0434 30.9510 175.5003 31 F 5.3938 8.4264 120.3116 55.5149 42.1734 173.0927 32 T 4.8883 8.5444 109.0342 59.8863 72.8877 172.5620 33 G 3.7611 7.4501 106.0522 46.2344 0.0000 171.7849 34 T 5.2230 7.7872 108.8607 60.1934 72.9019 172.4807 35 Y 4.8884 9.3598 124.0823 55.9109 42.3839 173.8569 36 F 5.2909 9.1831 129.0926 56.5412 41.3557 173.8907 37 T 4.5612 8.8384 120.6488 61.7985 67.9285 174.6492 38 S 4.3008 8.4057 121.7152 59.2605 63.8373 174.5325 39 V 4.4810 7.3514 113.2513 59.8177 35.1809 174.4007 40 S 4.5197 7.9579 115.1961 56.8571 65.8624 174.2906 41 L 4.0452 8.3862 120.9735 57.0173 41.5517 176.7766 42 T 4.7551 7.3926 106.5394 59.8051 71.4353 172.9232 43 N 4.6000 8.5749 116.8513 53.9406 38.9652 175.9574 44 S 4.2245 7.4097 114.6858 58.7734 63.4776 174.4679 45 T 3.8638 8.2849 120.6669 63.3468 68.6494 174.5529 46 I 2.2457 7.8916 127.8037 60.7960 37.6261 175.6252 47 R 4.9174 7.6749 123.1446 53.7413 33.3215 175.2090 48 I 4.4137 8.6535 120.8367 62.2044 38.6736 175.1764 49 S 5.0626 9.1995 124.0022 56.0448 67.1545 171.8817 50 P 5.0724 0.0000 0.0000 62.6595 32.9318 174.8456 51 L 5.7485 8.6761 120.2017 53.5922 44.4966 174.9876 52 T 4.6576 8.0029 113.1567 61.0470 71.3271 173.3562 53 G 3.9713 7.3390 111.3459 46.5409 0.0000 171.4778 54 Y 5.4667 8.0944 116.3280 56.3732 42.7797 174.5230 55 Q 5.4874 9.5268 120.1529 54.1776 32.0067 175.3071 56 K 4.2107 9.1042 120.7957 56.6745 32.9031 176.9557 57 L 4.5636 8.4656 120.7389 54.8114 41.9584 176.7480 58 T 4.4778 7.4808 109.6633 59.4396 70.6083 174.1151 59 E 3.8826 8.5609 119.9405 57.8204 30.2755 177.1352 60 K 4.0072 8.8832 119.9738 55.8671 29.2735 173.5058 61 P 4.5887 0.0000 0.0000 62.8213 33.2050 178.1785 62 T 4.7234 8.5447 113.0117 62.0181 70.8065 172.6530 63 F 5.3026 8.2570 115.9608 56.9193 41.7731 172.7799 64 G 4.8197 9.4244 105.4016 45.7031 0.0000 172.0161 65 F 5.4634 8.8644 115.2945 56.1485 42.0291 172.8063 66 T 5.1062 8.9835 116.1745 61.8355 71.5549 173.3131 67 V 4.4066 8.9114 126.0544 61.5434 33.6982 174.3692 68 H 4.8796 8.3758 129.2332 53.7822 28.6226 172.8125 69 W 4.4610 7.7207 118.4560 56.7990 29.1720 176.0493 70 A 4.2862 9.4080 127.7573 53.2823 18.2707 177.4981 71 F 5.0145 7.5754 108.5126 56.0092 39.0265 174.2143 72 S 4.5336 7.2197 114.3796 57.7929 65.6212 173.1210 73 D 4.7096 8.4194 117.7958 54.5725 39.8959 176.9917 74 S 4.8635 7.5791 116.5524 58.1019 65.1396 172.9294 75 I 5.1133 8.7124 120.7961 60.1360 41.4345 174.7756 76 T 5.0776 8.4630 122.0430 61.8146 72.0421 173.3882 77 V 4.9749 8.4690 118.1595 59.3832 35.1402 174.7508 78 W 5.2932 8.8968 123.4030 55.2520 32.6868 174.5232 79 T 4.8832 8.7769 116.7104 60.9808 71.1178 173.4328 80 G 4.1864 7.3555 111.0245 46.2878 0.0000 171.5476 81 Q 4.9219 8.2842 119.7042 54.5705 33.0152 173.7084 82 C 5.3204 9.0473 126.0344 55.6959 44.9817 172.3604 83 F 5.2113 9.1451 123.7819 55.5397 43.1922 173.9632 84 L 4.9093 8.7022 121.2484 53.9531 42.5519 177.3129 85 N 4.7390 9.1630 123.0734 52.3793 38.3364 175.3903 86 E 4.0403 8.7486 116.5199 59.2459 29.5302 178.0576 87 K 4.3295 8.3212 116.1159 55.8976 32.2362 177.5474 88 G 4.0786 8.1589 108.7670 45.4519 0.0000 174.3689 89 E 4.2679 8.0581 119.9697 56.2203 30.6099 176.4484 90 E 4.8480 8.7710 122.9596 56.5730 30.8384 176.1362 91 I 4.9906 9.1299 123.0092 59.5898 42.2487 173.5640 92 L 4.9761 9.2809 129.8110 53.7878 43.4893 175.1825 93 H 5.3956 9.2989 122.9329 54.7949 30.2659 174.6792 94 T 5.3914 9.1778 113.3560 60.2190 72.6252 172.7740 95 M 5.3764 9.0320 121.6202 53.3715 36.1672 174.7476 96 W 5.3556 8.5088 117.6403 54.6812 32.3681 173.7566 97 L 5.2435 8.6663 120.7724 52.9295 44.5685 175.1466 98 L 4.9155 9.2835 126.4920 53.3548 44.3860 174.9030 99 R 4.9371 9.2020 128.9783 55.3781 31.2503 175.1906 100 S 5.0691 8.7054 121.9477 56.5496 65.3389 173.8493 101 S 4.3017 8.5399 117.2752 58.3992 62.6103 173.3788 102 Q 4.6032 8.5354 126.2138 54.1728 30.4988 175.6703 103 E 4.1835 8.5665 118.4855 58.3778 30.5360 177.2007 104 K 4.6789 7.5348 117.1951 54.0215 36.4047 176.5865 105 E 3.9930 8.9005 122.6642 59.3015 29.7063 179.0864 106 Q 4.1789 8.1116 115.4196 58.4728 29.0299 176.3917 107 D 4.6965 8.0623 117.8025 53.9057 41.3748 177.5308 108 N 4.2686 8.2050 120.9899 56.2832 38.9985 176.9434 109 W 4.2885 8.2808 114.1390 59.0031 28.1845 176.6649 110 T 3.4899 6.8508 107.7475 61.9963 68.6653 175.4188 111 G 3.7714 8.0327 111.4292 46.0496 0.0000 173.0468 112 T 4.9731 7.5160 116.0788 61.8774 71.3233 173.7419 113 R 4.7611 9.1410 126.4677 54.8591 32.6719 175.9756 114 V 4.3616 7.7179 119.4931 60.2798 34.8257 174.4964 115 G 3.1411 6.2412 107.2485 45.5806 0.0000 171.4882 116 A 5.3448 8.3171 120.8402 50.2223 21.7202 175.9648 117 N 5.2740 9.3076 116.3909 51.8633 43.6984 173.7085 118 T 5.1720 8.3963 117.7794 61.9831 71.8692 172.7471 119 F 5.5737 9.2477 125.7119 56.0644 41.7458 175.0678 120 T 5.4561 9.2595 112.1708 59.7269 72.7055 173.3680 121 R 4.1180 8.5767 120.9201 55.6350 30.9543 177.0939 122 L 4.1095 8.3459 120.8824 55.4435 41.6231 177.2821 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 4 Q 8.34 4.42 0.00 2.41 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.44 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 5 K 8.06 4.39 0.00 1.85 1.79 0.00 1.84 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.48 7.81 6 C 8.44 4.38 0.00 3.10 3.20 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 0.00 7 N 7.53 4.57 0.00 2.82 2.70 0.00 0.00 7.28 6.54 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 8 L 8.69 4.16 0.00 1.27 1.18 0.04 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 7.36 3.93 0.00 2.19 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.50 0.00 0.00 0.00 0.00 0.00 2.48 2.27 0.00 10 G 8.05 3.53 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 0.00 11 Q 7.95 4.93 0.00 1.76 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.74 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 12 W 9.37 5.37 0.00 3.02 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 13 R 9.58 5.35 0.00 1.88 1.80 0.00 3.10 0.00 0.00 3.26 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 14 N 8.48 5.68 0.00 2.48 1.47 0.00 0.00 6.89 6.22 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 15 K 8.50 4.11 0.00 1.79 1.94 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.46 7.81 16 L 7.96 4.06 0.00 1.89 1.77 1.02 1.02 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 17 G 8.21 3.98 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 0.00 0.00 0.00 18 S 8.52 4.53 0.00 4.12 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 19 N 9.01 5.34 0.00 2.70 2.71 0.00 0.00 6.49 7.47 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 20 L 8.91 4.73 0.00 1.29 1.34 0.21 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 21 I 8.59 4.98 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.51 0.84 0.00 0.00 22 I 8.59 4.70 1.82 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.35 0.31 0.00 0.00 23 E 8.93 4.50 0.00 1.83 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 2.30 2.36 0.00 24 S 8.64 3.97 0.00 3.85 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 25 V 8.25 4.02 2.12 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 0.97 0.00 0.00 0.99 0.00 0.00 26 S 9.06 4.52 0.00 4.13 3.82 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 0.00 0.00 0.00 27 Q 8.65 3.99 0.00 2.18 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 28 N 8.20 4.63 0.00 2.90 3.00 0.00 0.00 6.30 7.00 0.00 0.00 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 G 8.43 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 0.00 0.00 0.00 0.00 30 E 8.48 4.55 0.00 2.28 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 2.03 1.68 0.00 31 F 8.43 5.39 0.00 2.99 3.01 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 32 T 8.54 4.89 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 1.14 0.00 0.00 33 G 7.45 3.76 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 0.00 0.00 0.00 34 T 7.79 5.22 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 1.21 0.00 0.00 35 Y 9.36 4.89 0.00 2.94 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 36 F 9.18 5.29 0.00 3.04 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 37 T 8.84 4.56 4.79 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 1.24 0.00 0.00 38 S 8.41 4.30 0.00 4.01 4.11 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 39 V 7.35 4.48 2.03 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 0.73 0.00 0.00 0.90 0.00 0.00 40 S 7.96 4.52 0.00 3.97 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 41 L 8.39 4.05 0.00 1.57 1.70 0.82 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 42 T 7.39 4.76 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 43 N 8.57 4.60 0.00 2.71 2.88 0.00 0.00 6.80 7.57 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 44 S 7.41 4.22 0.00 3.99 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 45 T 8.28 3.86 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 1.18 0.00 0.00 46 I 7.89 2.25 1.43 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 -0.17 0.31 0.00 0.00 47 R 7.67 4.92 0.00 2.06 1.98 0.00 3.47 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 48 I 8.65 4.41 1.88 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 1.37 0.73 0.97 0.00 0.00 49 S 9.20 5.06 0.00 3.91 3.82 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 0.00 0.00 0.00 50 P 0.00 5.07 0.00 2.11 2.17 0.00 3.82 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 2.06 1.95 0.00 51 L 8.68 5.75 0.00 1.91 1.71 0.80 0.16 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 52 T 8.00 4.66 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 1.11 0.00 0.00 53 G 7.34 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 54 Y 8.09 5.47 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 55 Q 9.53 5.49 0.00 2.26 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 56 K 9.10 4.21 0.00 1.86 1.83 0.00 1.60 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.49 7.81 57 L 8.47 4.56 0.00 1.64 1.70 0.98 0.91 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 58 T 7.48 4.48 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 59 E 8.56 3.88 0.00 2.12 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 0.00 2.30 2.37 0.00 60 K 8.88 4.01 0.00 1.83 1.56 0.00 2.08 0.00 0.00 0.61 0.00 0.00 3.10 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.41 7.81 61 P 0.00 4.59 0.00 2.23 2.34 0.00 3.67 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 62 T 8.54 4.72 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 1.16 0.00 0.00 63 F 8.26 5.30 0.00 3.60 3.32 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 64 G 9.42 4.82 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 0.00 0.00 0.00 0.00 0.00 0.00 65 F 8.86 5.46 0.00 3.25 3.15 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 66 T 8.98 5.11 4.25 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 1.18 0.00 0.00 67 V 8.91 4.41 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 -0.51 0.00 0.00 0.73 0.00 0.00 68 H 8.38 4.88 0.00 3.07 3.13 0.00 6.02 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 W 7.72 4.46 0.00 2.96 2.40 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 70 A 9.41 4.29 1.48 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 0.00 0.00 71 F 7.58 5.01 0.00 3.20 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 72 S 7.22 4.53 0.00 3.79 3.51 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 73 D 8.42 4.71 0.00 2.67 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 74 S 7.58 4.86 0.00 3.68 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 75 I 8.71 5.11 1.89 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 1.26 0.92 0.94 0.00 0.00 76 T 8.46 5.08 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 -0.07 0.00 0.00 77 V 8.47 4.97 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 0.81 0.00 0.00 0.94 0.00 0.00 78 W 8.90 5.29 0.00 2.11 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 79 T 8.78 4.88 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 1.16 0.00 0.00 80 G 7.36 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 81 Q 8.28 4.92 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.82 0.00 0.00 0.00 0.00 0.00 1.32 2.15 0.00 82 C 9.05 5.32 0.00 3.06 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 83 F 9.15 5.21 0.00 3.14 2.96 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 84 L 8.70 4.91 0.00 1.64 1.70 0.98 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 85 N 9.16 4.74 0.00 2.92 3.10 0.00 0.00 6.55 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 86 E 8.75 4.04 0.00 2.01 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 0.00 2.33 2.35 0.00 87 K 8.32 4.33 0.00 2.02 1.85 0.00 1.81 0.00 0.00 1.94 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.45 7.81 88 G 8.16 4.08 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 0.00 0.00 0.00 89 E 8.06 4.27 0.00 2.16 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 2.34 2.32 0.00 90 E 8.77 4.85 0.00 2.05 2.24 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 2.45 2.39 0.00 91 I 9.13 4.99 2.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.67 1.15 0.00 0.00 92 L 9.28 4.98 0.00 1.76 1.79 -0.65 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 93 H 9.30 5.40 0.00 3.35 3.38 0.00 5.56 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 94 T 9.18 5.39 4.73 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 1.82 0.00 0.00 95 M 9.03 5.38 0.00 1.79 1.91 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.59 0.00 96 W 8.51 5.36 0.00 2.46 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 0.00 0.00 0.00 97 L 8.67 5.24 0.00 1.56 1.57 0.89 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 98 L 9.28 4.92 0.00 1.59 1.78 0.89 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 99 R 9.20 4.94 0.00 1.93 1.89 0.00 3.34 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 100 S 8.71 5.07 0.00 3.82 3.77 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 0.00 101 S 8.54 4.30 0.00 4.03 3.79 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 0.00 102 Q 8.54 4.60 0.00 2.02 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.90 0.00 0.00 0.00 0.00 0.00 2.20 2.33 0.00 103 E 8.57 4.18 0.00 2.07 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 2.25 2.31 0.00 104 K 7.53 4.68 0.00 1.78 1.68 0.00 1.84 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.42 1.40 7.81 105 E 8.90 3.99 0.00 2.01 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 0.00 2.41 2.33 0.00 106 Q 8.11 4.18 0.00 2.28 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 107 D 8.06 4.70 0.00 2.81 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 0.00 108 N 8.20 4.27 0.00 2.94 2.90 0.00 0.00 6.93 7.96 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 0.00 109 W 8.28 4.29 0.00 3.58 3.21 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 0.00 110 T 6.85 3.49 3.59 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 -0.77 0.00 0.00 111 G 8.03 3.77 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 0.00 0.00 0.00 112 T 7.52 4.97 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 1.21 0.00 0.00 113 R 9.14 4.76 0.00 1.96 2.06 0.00 3.12 0.00 0.00 3.35 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 114 V 7.72 4.36 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 0.53 0.00 0.00 0.61 0.00 0.00 115 G 6.24 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 0.00 0.00 0.00 116 A 8.32 5.34 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 0.00 117 N 9.31 5.27 0.00 3.28 2.50 0.00 0.00 6.90 7.19 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 0.00 118 T 8.40 5.17 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 1.27 0.00 0.00 119 F 9.25 5.57 0.00 2.86 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 0.00 120 T 9.26 5.46 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 1.35 0.00 0.00 121 R 8.58 4.12 0.00 1.54 1.59 0.00 2.51 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.25 0.00 122 L 8.35 4.11 0.00 1.55 1.57 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00