NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.5709 8.1076 122.4753 52.0843 20.6461 175.1259 2 S 5.2953 8.4369 113.2639 55.4841 66.8350 170.4473 3 Y 4.9049 9.3429 118.5910 56.2655 41.8890 174.6379 4 K 5.0978 8.6836 118.5872 54.9341 35.2003 175.9783 5 V 4.6489 8.3353 114.6778 60.1796 37.2172 173.4485 6 N 5.3865 8.6863 118.8366 51.8749 40.9780 174.0554 7 I 4.5049 8.7219 124.3424 58.5276 40.0805 173.5762 8 P 4.7587 0.0000 0.0000 63.2152 31.8347 175.9519 9 A 4.4423 8.5899 122.0028 51.2542 21.4089 177.3507 10 G 3.7547 8.1803 107.4616 44.2089 0.0000 171.1273 11 P 4.2037 0.0000 0.0000 62.1679 31.7036 175.6020 12 L 4.3856 7.8262 122.3006 52.6556 43.0823 176.7282 13 W 4.5825 9.1139 125.0374 58.7066 29.6929 176.6911 14 S 4.8320 7.3215 111.9191 56.3666 66.2170 174.8438 15 N 4.5337 8.9722 119.5332 56.7078 38.8815 176.4881 16 A 3.9813 8.0368 121.9064 55.0316 18.4122 179.1071 17 E 3.8430 8.0412 117.1577 59.3481 29.7811 178.7513 18 A 3.4279 7.3758 120.7260 55.2049 17.9516 179.6303 19 Q 4.4445 8.0448 115.3409 58.6071 28.7799 178.2866 20 Q 4.1546 7.1656 117.3277 58.0956 29.4189 177.8862 21 V 3.7225 7.9009 119.6418 65.2863 31.5609 177.9628 22 G 2.3768 7.6559 105.9669 47.2419 0.0000 173.8044 23 P 4.2833 0.0000 0.0000 64.8234 31.2569 178.9842 24 K 3.9385 7.8493 117.5557 59.3115 31.7343 179.4493 25 I 3.6354 7.5036 119.3599 64.2145 37.0886 178.0736 26 A 4.0270 8.2338 121.6955 55.2751 18.2623 179.5257 27 A 3.9563 8.1164 118.9595 55.2732 18.2087 179.7229 28 A 3.9146 7.8934 118.1659 54.4258 18.3445 178.0069 29 H 4.6599 7.3748 112.6346 55.0863 29.2276 174.3688 30 Q 3.4725 7.8713 116.6196 57.2284 26.5145 172.7540 31 G 4.3266 8.3698 104.2581 44.8043 0.0000 171.9239 32 N 5.2268 8.8371 116.4475 51.0763 41.7049 174.3283 33 F 5.0246 9.0119 126.7428 58.6425 39.7632 175.0732 34 T 3.9460 8.1531 115.8606 62.0167 68.9984 175.6949 35 G 3.4725 5.6165 109.7353 44.8664 0.0000 173.6736 36 Q 4.6325 7.3257 118.8503 55.2622 30.3243 175.0239 37 W 5.2677 8.0646 116.5580 56.3734 30.8050 173.6860 38 T 4.3120 8.7978 117.3391 62.2269 72.7352 173.0404 39 T 4.6579 8.3058 122.3071 63.1518 68.8005 175.0496 40 V 4.0997 8.5963 120.0055 61.8860 33.2325 176.6841 41 V 4.1583 7.4681 119.6932 60.5356 33.3579 173.6424 42 E 3.9290 8.9555 127.8143 58.3318 29.6158 176.9112 43 S 3.7418 9.0142 119.1648 59.2545 60.8644 172.4373 44 A 4.6079 7.5607 119.0548 52.7487 22.0662 177.2219 45 M 4.6473 8.3934 114.4693 54.7043 36.2019 174.2071 46 S 5.2907 8.9132 120.6954 56.9581 68.0447 173.2028 47 V 4.9725 9.0283 114.2057 59.7710 35.6952 175.1584 48 V 5.0566 8.7832 116.2399 59.5662 35.1526 174.5371 49 E 4.9047 9.3650 126.2169 55.1918 31.0412 175.3255 50 V 4.9850 8.8390 126.9860 61.0073 34.9397 173.7953 51 E 4.5936 9.5386 129.7153 55.7883 30.7611 175.2141 52 L 4.9995 8.7738 126.2318 52.9012 45.7054 175.3662 53 Q 4.7798 8.4158 119.6895 54.7763 29.6123 176.4135 54 V 3.9526 8.8384 123.5495 65.3401 31.8257 176.2890 55 E 4.6961 7.9597 118.0062 54.4164 32.1854 174.7738 56 N 4.7606 8.8932 122.0809 52.7662 39.6002 174.5025 57 T 4.6910 9.4544 111.4927 59.0441 72.0413 173.0331 58 G 4.1881 7.8289 109.9290 44.8270 0.0000 172.3487 59 I 4.1210 7.5902 111.3988 60.8713 38.3557 174.9896 60 H 4.9634 7.8101 119.3626 54.1999 31.4312 173.1908 61 E 5.8146 8.2709 117.0309 54.4786 33.2607 174.3494 62 F 5.0763 8.9376 122.0330 57.1147 42.9230 172.9214 63 K 4.9099 7.8772 125.1581 55.3556 34.2936 175.2197 64 T 4.2623 8.1783 116.3920 61.6597 71.5490 171.3307 65 D 5.4105 8.5585 124.1871 52.9271 42.8250 176.4206 66 V 4.5739 8.3298 114.4097 59.0039 36.4921 174.9034 67 L 4.4464 8.7469 121.6691 55.5888 41.8567 177.0766 68 A 4.5922 8.8440 122.1453 50.8250 20.5956 177.1478 69 G 3.9477 8.3281 102.2285 43.9829 0.0000 171.2592 70 P 4.2108 0.0000 0.0000 62.3501 31.6821 175.8198 71 L 4.6705 8.4780 122.7623 52.7004 44.1981 176.6685 72 W 4.6562 9.5047 123.6280 58.4320 29.8960 176.7968 73 S 4.9038 7.4626 111.6890 56.0142 66.5796 174.4072 74 N 4.4918 8.9878 119.8861 56.9462 38.7236 176.5675 75 D 4.3365 8.0482 120.0276 57.2769 40.9248 178.1558 76 E 3.8596 8.1179 119.5889 59.0081 29.6110 178.7340 77 A 3.4172 7.6276 121.0101 55.0616 18.0029 179.7157 78 Q 4.3116 8.0244 115.7924 58.8046 28.7909 178.8369 79 K 4.0952 7.8433 119.0467 59.2286 32.4828 178.8396 80 L 4.2631 8.1028 119.0231 56.2391 41.8263 179.1362 81 G 2.4343 7.7719 106.5497 47.0168 0.0000 173.6331 82 P 4.3408 0.0000 0.0000 65.4769 31.4720 178.8125 83 Q 3.9880 7.9067 116.1248 58.8210 28.4571 178.6428 84 I 3.7154 7.6412 120.0038 64.2565 37.3771 177.9314 85 A 4.2073 8.4630 121.8484 55.2536 18.2415 179.4873 86 A 4.1661 8.3592 119.7309 55.2663 18.1968 179.6419 87 S 4.2774 7.9673 111.1542 60.4581 63.2065 175.0822 88 Y 4.6143 8.1643 119.5085 56.7989 38.3297 175.3082 89 G 3.9748 8.6443 107.5961 46.4046 0.0000 173.2072 90 A 4.6788 7.9024 120.8707 50.7506 22.6098 175.4408 91 E 4.8207 8.5115 117.0974 54.8709 32.3438 175.6096 92 F 5.2166 8.7372 125.0952 57.9423 40.0247 175.5764 93 T 3.9064 7.9471 115.5378 61.9255 68.9584 175.3228 94 G 3.5033 5.6720 109.5359 45.1589 0.0000 173.9823 95 Q 4.4823 7.4112 118.9303 55.5255 29.9350 175.3419 96 W 5.1311 8.2716 118.0329 56.4885 30.6654 173.2873 97 R 3.7606 8.4281 115.2345 55.3913 32.4797 173.8252 98 T 4.6872 8.2133 117.9374 63.1897 68.9021 174.6817 99 I 4.2251 8.6581 119.4923 61.4392 39.6300 175.9656 100 V 4.2296 7.4733 122.2731 60.7805 34.3286 174.0028 101 E 3.8419 9.0242 128.8908 58.0235 29.5674 177.0777 102 G 3.7922 8.7736 112.9370 45.9656 0.0000 173.2050 103 V 4.2302 8.0636 117.8683 64.0918 33.8349 175.5158 104 M 4.8219 7.6232 118.0375 54.4162 35.7722 173.3046 105 S 5.3243 8.6166 120.1321 56.9503 67.9591 173.1133 106 V 5.0991 8.9935 113.6628 59.6937 36.0595 174.9202 107 I 5.2099 8.3875 115.4304 59.2522 41.3382 174.0370 108 Q 5.0288 9.2505 126.1916 55.4398 30.4106 174.5932 109 I 5.0291 8.8239 119.4946 58.9956 41.6630 174.0439 110 K 4.8766 9.0455 124.2112 54.9383 34.9166 174.4888 111 Y 5.0972 9.3854 125.7554 57.4776 39.9261 174.6158 112 T 5.3225 8.7792 119.4003 61.7215 71.6315 174.0157 113 F 4.6210 8.7913 120.8154 57.3113 38.1770 174.1588 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 8.11 4.57 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 2 S 8.44 5.30 0.00 4.01 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 3 Y 9.34 4.90 0.00 3.03 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 4 K 8.68 5.10 0.00 1.64 1.72 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.72 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.28 1.40 7.81 5 V 8.34 4.65 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 0.93 0.00 0.00 6 N 8.69 5.39 0.00 2.65 2.74 0.00 0.00 6.61 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 7 I 8.72 4.50 1.83 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 1.16 0.72 0.73 0.00 0.00 8 P 0.00 4.76 0.00 1.91 1.98 0.00 3.57 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 9 A 8.59 4.44 1.10 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 0.00 0.00 10 G 8.18 3.75 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 0.00 0.00 0.00 11 P 0.00 4.20 0.00 0.84 1.50 0.00 3.64 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 1.82 1.91 0.00 12 L 7.83 4.39 0.00 1.34 0.80 0.61 0.55 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 13 W 9.11 4.58 0.00 3.24 3.26 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 14 S 7.32 4.83 0.00 4.12 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 0.00 15 N 8.97 4.53 0.00 3.19 3.05 0.00 0.00 6.75 7.90 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 16 A 8.04 3.98 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 17 E 8.04 3.84 0.00 2.06 1.91 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 2.14 2.26 0.00 18 A 7.38 3.43 0.09 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 19 Q 8.04 4.44 0.00 2.05 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.78 2.64 0.00 20 Q 7.17 4.15 0.00 2.17 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.96 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 21 V 7.90 3.72 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.84 0.00 0.00 22 G 7.66 2.38 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 0.00 23 P 0.00 4.28 0.00 2.12 2.15 0.00 3.41 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 24 K 7.85 3.94 0.00 1.80 1.76 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.54 7.81 25 I 7.50 3.64 1.86 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 1.60 0.91 0.88 0.00 0.00 26 A 8.23 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.12 3.96 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 28 A 7.89 3.91 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 29 H 7.37 4.66 0.00 3.14 3.34 0.00 5.81 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.87 3.47 0.00 2.28 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.63 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 31 G 8.37 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 0.00 0.00 0.00 0.00 32 N 8.84 5.23 0.00 2.60 2.71 0.00 0.00 7.10 8.59 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 33 F 9.01 5.02 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 34 T 8.15 3.95 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 1.17 0.00 0.00 35 G 5.62 3.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 7.33 4.63 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.65 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 37 W 8.06 5.27 0.00 3.62 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 38 T 8.80 4.31 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 1.11 0.00 0.00 39 T 8.31 4.66 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 1.22 0.00 0.00 40 V 8.60 4.10 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 0.61 0.00 0.00 0.97 0.00 0.00 41 V 7.47 4.16 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 1.09 0.00 0.00 0.92 0.00 0.00 42 E 8.96 3.93 0.00 2.05 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 2.46 2.43 0.00 43 S 9.01 3.74 0.00 4.18 4.29 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 44 A 7.56 4.61 1.21 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 45 M 8.39 4.65 0.00 2.06 1.82 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 46 S 8.91 5.29 0.00 3.90 4.04 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 47 V 9.03 4.97 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 0.85 0.00 0.00 0.97 0.00 0.00 48 V 8.78 5.06 2.26 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 0.57 0.00 0.00 0.96 0.00 0.00 49 E 9.36 4.90 0.00 2.15 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 2.28 2.10 0.00 50 V 8.84 4.99 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 0.91 0.00 0.00 1.06 0.00 0.00 51 E 9.54 4.59 0.00 2.00 1.76 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 2.21 2.23 0.00 52 L 8.77 5.00 0.00 0.45 1.19 0.87 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 53 Q 8.42 4.78 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 7.06 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 54 V 8.84 3.95 2.17 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 0.79 0.00 0.00 1.09 0.00 0.00 55 E 7.96 4.70 0.00 1.99 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 2.25 2.34 0.00 56 N 8.89 4.76 0.00 2.85 3.00 0.00 0.00 6.93 7.54 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 57 T 9.45 4.69 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 1.25 0.00 0.00 58 G 7.83 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 59 I 7.59 4.12 1.73 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.13 0.84 0.00 0.00 60 H 7.81 4.96 0.00 1.63 2.41 0.00 5.77 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.27 5.81 0.00 2.02 1.87 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 2.17 2.20 0.00 62 F 8.94 5.08 0.00 3.42 3.26 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 63 K 7.88 4.91 0.00 1.44 1.51 0.00 1.76 0.00 0.00 1.54 0.00 0.00 2.60 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.27 1.50 7.81 64 T 8.18 4.26 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 1.36 0.00 0.00 65 D 8.56 5.41 0.00 2.57 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 66 V 8.33 4.57 1.60 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 0.52 0.00 0.00 -0.19 0.00 0.00 67 L 8.75 4.45 0.00 1.68 1.69 0.97 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.84 4.59 1.20 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 0.00 0.00 69 G 8.33 3.95 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 0.00 0.00 0.00 70 P 0.00 4.21 0.00 1.70 1.92 0.00 3.66 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.91 0.00 71 L 8.48 4.67 0.00 1.45 1.09 0.63 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 72 W 9.50 4.66 0.00 3.22 3.31 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 73 S 7.46 4.90 0.00 4.10 4.05 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 74 N 8.99 4.49 0.00 3.16 3.03 0.00 0.00 6.88 8.49 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 75 D 8.05 4.34 0.00 2.73 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 76 E 8.12 3.86 0.00 2.05 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 2.18 2.29 0.00 77 A 7.63 3.42 -0.01 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 78 Q 8.02 4.31 0.00 2.03 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.92 0.00 0.00 0.00 0.00 0.00 2.77 2.63 0.00 79 K 7.84 4.10 0.00 1.86 1.81 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.62 7.81 80 L 8.10 4.26 0.00 1.51 1.55 0.89 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 81 G 7.77 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 0.00 0.00 0.00 82 P 0.00 4.34 0.00 2.17 2.18 0.00 3.58 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.38 0.00 83 Q 7.91 3.99 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 84 I 7.64 3.72 1.74 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.51 1.00 0.00 0.00 85 A 8.46 4.21 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 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.36 4.17 1.43 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 0.00 0.00 87 S 7.97 4.28 0.00 3.99 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 88 Y 8.16 4.61 0.00 3.06 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 89 G 8.64 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 90 A 7.90 4.68 0.89 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 91 E 8.51 4.82 0.00 1.95 1.87 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 2.28 2.27 0.00 92 F 8.74 5.22 0.00 3.03 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 93 T 7.95 3.91 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 1.09 0.00 0.00 94 G 5.67 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 Q 7.41 4.48 0.00 1.91 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.64 0.00 0.00 0.00 0.00 0.00 2.26 2.47 0.00 96 W 8.27 5.13 0.00 3.70 3.28 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 97 R 8.43 3.76 0.00 1.61 1.69 0.00 2.65 0.00 0.00 3.06 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.50 0.00 98 T 8.21 4.69 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 1.25 0.00 0.00 99 I 8.66 4.23 1.86 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 1.22 0.62 0.90 0.00 0.00 100 V 7.47 4.23 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 1.03 0.00 0.00 0.92 0.00 0.00 101 E 9.02 3.84 0.00 1.96 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 2.33 2.37 0.00 102 G 8.77 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 0.00 0.00 0.00 103 V 8.06 4.23 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 0.76 0.00 0.00 0.95 0.00 0.00 104 M 7.62 4.82 0.00 2.12 1.80 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.64 0.00 105 S 8.62 5.32 0.00 3.95 4.04 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 0.00 106 V 8.99 5.10 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 0.80 0.00 0.00 0.96 0.00 0.00 107 I 8.39 5.21 2.22 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 1.07 0.90 0.83 0.00 0.00 108 Q 9.25 5.03 0.00 2.23 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.69 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 109 I 8.82 5.03 1.66 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.20 0.76 0.00 0.00 110 K 9.05 4.88 0.00 1.72 1.63 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.37 1.40 7.81 111 Y 9.39 5.10 0.00 3.30 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 0.00 112 T 8.78 5.32 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 1.25 0.00 0.00 113 F 8.79 4.62 0.00 3.08 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