NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1930 8.3044 118.1942 53.0919 33.3183 172.3316 2 L 3.2118 8.1155 125.3608 54.2276 40.8899 171.8196 3 T 3.7696 8.1556 125.9146 63.7242 69.8799 173.4381 4 D 4.7389 7.8258 129.1726 52.2466 42.2732 175.5072 5 P 4.3492 0.0000 0.0000 65.3880 31.1681 178.7256 6 I 3.7257 7.7985 118.3605 64.2041 37.2733 177.6000 7 A 3.9307 9.0138 121.8516 55.5888 18.0385 178.7172 8 D 4.2557 8.0611 116.0675 57.9016 41.2140 178.0178 9 M 4.1744 8.0582 118.1150 58.8507 32.2642 177.9196 10 L 3.8808 7.9797 118.8979 58.3833 41.7928 179.8168 11 T 3.7832 8.3811 115.3490 66.7892 68.5329 176.5694 12 R 3.8145 8.7382 121.0439 59.7027 30.0341 179.1475 13 I 3.6697 7.8296 119.1898 64.1869 36.9566 178.5403 14 R 3.7415 7.8662 119.5355 59.5769 29.7536 178.4169 15 N 4.3216 8.7717 115.5620 55.8033 38.7925 177.1310 16 A 4.1407 7.8625 122.3833 55.0840 18.7842 179.3256 17 T 3.8579 7.8763 108.5854 65.5302 68.3161 176.3522 18 R 3.8184 7.3506 119.4037 58.2834 30.1538 178.4253 19 V 4.1756 7.4364 108.9844 60.5893 32.2407 175.5160 20 Y 3.7665 7.8487 115.1339 59.0653 35.2219 169.7865 21 K 4.1929 8.1319 117.8696 56.6314 33.1200 176.8047 22 E 4.2919 8.6694 120.4181 58.8667 30.0539 176.2265 23 S 4.9120 7.4752 108.9993 58.5626 65.0929 174.7334 24 T 4.5271 8.4865 124.0162 62.2019 70.3317 174.4930 25 D 5.4316 8.5811 125.1818 53.5788 43.0505 175.6142 26 V 4.5023 8.1685 115.1613 60.2540 34.2061 170.9525 27 P 4.2232 0.0000 0.0000 63.0870 31.5698 176.0874 28 A 4.2099 8.5069 127.0532 52.1107 19.4416 176.9756 29 S 4.3444 8.5286 110.1189 56.2658 65.7855 176.2682 30 R 3.8805 8.7442 128.6304 60.0173 29.5045 178.1135 31 F 4.1844 8.1778 118.1141 61.1692 39.2725 176.5258 32 K 3.9179 8.1551 117.7109 59.9731 31.7633 177.9756 33 E 3.5496 8.2753 117.8167 59.6305 29.2993 179.2255 34 E 3.7997 7.8550 116.8957 59.7593 29.8034 179.8756 35 I 3.5112 6.9885 118.7740 64.5962 37.0563 178.0867 36 L 3.8442 7.8769 119.5824 57.6019 41.3395 179.3409 37 R 4.3914 7.7958 117.8325 59.9165 30.0510 178.3859 38 I 3.7131 8.1773 119.5317 64.4528 37.2286 178.0121 39 L 4.0194 8.3920 121.2994 58.1759 41.6345 179.0143 40 A 4.0697 9.0955 121.6121 55.0045 18.5655 179.2027 41 R 3.7939 8.1423 116.5938 59.8054 30.0934 177.4489 42 E 4.0528 8.3039 115.2653 57.4936 29.6525 177.5452 43 G 3.9859 8.6566 108.1711 45.5725 0.0000 174.6584 44 F 4.5258 7.9167 119.4100 58.2153 39.5075 176.3000 45 I 4.6776 7.4646 112.6649 58.8288 40.1833 174.9968 46 K 3.9118 8.5824 123.4991 57.8648 32.4782 177.5638 47 G 3.9817 7.1720 104.2593 45.6610 0.0000 169.8796 48 Y 6.1040 7.3816 117.2514 56.7046 41.4050 173.7911 49 E 4.9089 8.8567 113.2267 55.3740 32.0406 175.7994 50 R 4.6463 9.0871 121.5899 57.5510 30.7794 176.8790 51 V 4.3240 7.9022 114.5466 61.8512 35.8734 174.2720 52 D 4.4668 8.5882 119.5689 54.9216 43.5932 176.0800 53 V 4.1836 8.6954 127.9974 62.1014 32.1454 175.2637 54 D 4.6895 9.9356 128.5012 55.3002 38.5554 173.6938 55 G 3.8291 8.7072 102.0415 46.1294 0.0000 174.8877 56 K 4.4210 8.0573 117.7682 53.4914 35.9858 174.4040 57 P 4.6056 0.0000 0.0000 63.2232 32.5979 175.2199 58 Y 5.0714 8.4331 121.3036 56.7526 43.1747 173.6906 59 L 5.0984 9.0291 119.2413 53.6499 45.7725 176.6480 60 R 4.1308 9.0150 124.3657 56.1698 31.4969 176.3676 61 V 4.7760 7.8982 122.4589 61.1005 34.0902 173.4820 62 Y 4.5418 9.4119 126.6651 57.4102 38.5175 175.3817 63 L 4.4074 8.6893 125.4201 54.4193 42.5562 176.8118 64 K 4.6565 8.1868 122.9905 55.6288 34.6939 174.4376 65 Y 4.8656 8.1808 119.9974 56.6769 42.9354 174.5672 66 G 4.5167 9.1395 109.9536 44.7489 0.0000 171.5991 67 P 4.6976 0.0000 0.0000 62.1311 32.1404 176.4667 68 R 4.0299 8.4899 120.3752 56.5113 30.3687 175.8301 69 R 4.6424 8.1708 121.0725 54.6430 32.2769 175.9351 70 Q 4.1857 8.3702 119.3798 56.1147 30.0048 176.7105 71 G 3.8485 8.5274 107.1803 43.7067 0.0000 171.1361 72 P 4.1687 0.0000 0.0000 64.3026 31.7642 176.1020 73 D 4.3054 8.7423 118.7968 54.5880 37.4175 173.1511 74 P 4.7593 0.0000 0.0000 61.7868 30.9391 177.4832 75 R 3.6711 8.0166 119.4635 56.7296 30.0906 174.8288 76 P 4.4989 0.0000 0.0000 62.5002 31.8111 175.8543 77 E 4.1547 9.1894 125.4205 56.9148 30.6346 176.3124 78 Q 4.6677 8.8288 123.4466 55.9051 29.5650 175.9198 79 V 3.8363 8.2769 119.7439 63.8928 32.4543 175.7271 80 I 4.2906 7.3349 120.4874 59.9900 37.0247 174.7886 81 H 4.4777 8.4182 123.5397 57.8766 29.4924 175.6138 82 H 4.3912 7.9458 118.6686 54.5852 33.2147 172.3044 83 I 4.7405 7.3941 123.7709 60.0177 41.2458 173.5778 84 R 4.4161 8.1950 126.7161 55.3438 34.0537 173.9644 85 R 4.3361 8.6894 127.0345 56.4376 30.1740 174.9599 86 I 3.9901 7.7916 126.5500 62.9372 38.3461 175.6517 87 S 4.1280 8.2462 118.9712 58.5071 62.3439 174.7053 88 K 4.4836 8.1699 127.6647 53.9655 33.8566 175.8750 89 P 4.2167 0.0000 0.0000 65.5751 31.3331 177.3917 90 G 3.9098 7.7939 105.8018 44.6525 0.0000 173.7771 91 R 4.4730 7.0453 115.5859 55.6445 32.2580 172.7469 92 R 4.0357 8.2917 121.8787 55.3631 31.2301 176.1125 93 V 4.2400 8.0247 122.2782 61.2334 33.9192 173.9658 94 Y 5.4359 8.3504 124.0514 56.4425 41.5909 175.0646 95 V 4.6791 8.9378 116.5607 59.4195 35.7354 175.8597 96 G 4.1068 9.0402 113.5289 44.6923 0.0000 174.4162 97 V 3.7467 8.3350 120.1413 64.5608 31.4974 178.3975 98 K 4.3662 8.0725 116.4522 56.2221 31.5580 176.8020 99 E 4.9134 8.0014 112.4981 55.6667 30.9393 176.0649 100 I 4.3881 7.6727 119.1260 59.7817 39.1853 174.7942 101 P 4.2891 0.0000 0.0000 62.7658 31.7356 176.4274 102 R 4.3966 8.1671 120.5685 54.1985 30.5682 176.1029 103 V 3.4954 8.2526 123.9997 63.8635 32.7557 175.9328 104 R 3.1742 9.0471 126.8578 59.3158 27.8549 175.5609 105 R 3.8072 8.6649 110.0797 57.3388 28.4561 177.7210 106 G 4.1258 8.2882 107.1583 45.7990 0.0000 175.8899 107 L 4.0464 8.0933 119.7965 57.5492 41.6894 177.8473 108 G 4.2505 8.0424 104.8536 45.5278 0.0000 172.8108 109 I 4.9347 8.8948 119.6726 59.2968 41.3274 174.3951 110 A 5.1972 8.5749 127.1492 48.6651 20.1156 175.0440 111 I 4.3193 8.0812 114.6645 61.4576 39.3469 175.2805 112 L 4.7876 8.3805 122.4539 54.7993 44.0608 174.4125 113 S 4.7239 8.8854 116.6973 59.1911 63.9673 172.5213 114 T 4.7109 8.1947 116.7260 61.3290 70.7159 174.5060 115 S 4.2236 8.8977 120.4739 61.1681 62.9526 176.0600 116 K 4.1435 8.7523 118.0089 56.8340 32.5019 176.7210 117 G 4.1354 7.1027 105.3387 43.1853 0.0000 171.6847 118 V 4.1134 7.8426 120.8891 62.8331 32.0636 175.6291 119 L 5.0255 8.7581 126.8862 52.9059 46.6102 176.0439 120 T 4.4756 8.4644 111.9866 61.4446 69.8572 174.9515 121 D 4.3873 8.4098 122.0421 56.9619 39.0493 179.3679 122 R 3.9175 7.8818 118.7575 59.0896 30.4501 178.6659 123 E 4.2064 8.4999 118.2084 59.1427 29.3385 179.3506 124 A 3.9949 8.1766 121.1990 55.4457 18.5243 179.8956 125 R 3.8923 7.8281 116.4544 59.5459 29.8721 178.3998 126 K 3.7089 8.3024 117.8280 60.4903 32.1595 177.4460 127 L 4.3143 8.1161 118.2822 53.9963 42.8793 176.8214 128 G 3.9082 7.9767 106.8534 46.9144 0.0000 174.3870 129 V 4.4439 8.0234 109.8808 59.2587 35.4996 176.3918 130 G 4.0833 8.2182 111.8121 43.9087 0.0000 172.6731 131 G 4.4469 7.7018 104.2075 45.5866 0.0000 171.5323 132 E 5.1635 8.3353 121.5992 55.3213 30.7512 176.8033 133 L 4.0049 8.5722 130.4241 55.9275 42.8054 177.4034 134 I 3.9317 8.7365 128.1561 62.8860 37.5773 175.7934 135 C 5.1468 7.5578 114.5091 57.7817 33.1771 171.6610 136 E 5.0022 8.3837 116.5286 54.8405 33.0324 175.0988 137 V 4.6307 8.8415 120.3413 61.3944 35.5831 174.3030 138 W 5.0145 8.5359 124.2488 57.1344 28.1952 174.3197 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 M 8.30 4.19 0.00 2.14 2.27 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 2 L 8.12 3.21 0.00 1.86 1.70 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.16 3.77 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 1.20 0.00 0.00 4 D 7.83 4.74 0.00 2.72 2.54 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 5 P 0.00 4.35 0.00 2.22 2.10 0.00 3.65 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 6 I 7.80 3.73 2.09 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.05 1.00 0.00 0.00 7 A 9.01 3.93 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 8 D 8.06 4.26 0.00 2.81 2.82 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 9 M 8.06 4.17 0.00 2.24 2.04 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 10 L 7.98 3.88 0.00 1.83 1.64 0.87 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.38 3.78 4.36 0.00 0.00 0.00 0.00 0.00 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 12 R 8.74 3.81 0.00 1.87 1.97 0.00 3.26 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.93 0.00 13 I 7.83 3.67 1.93 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 1.34 0.75 0.81 0.00 0.00 14 R 7.87 3.74 0.00 1.77 1.94 0.00 3.00 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.52 0.00 15 N 8.77 4.32 0.00 2.72 2.83 0.00 0.00 7.08 5.12 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 16 A 7.86 4.14 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 17 T 7.88 3.86 4.32 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 1.17 0.00 0.00 18 R 7.35 3.82 0.00 1.66 2.00 0.00 3.06 0.00 0.00 3.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 19 V 7.44 4.18 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 0.78 0.00 0.00 1.04 0.00 0.00 20 Y 7.85 3.77 0.00 2.97 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 21 K 8.13 4.19 0.00 1.78 1.78 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.38 7.81 22 E 8.67 4.29 0.00 2.06 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 2.53 2.44 0.00 23 S 7.48 4.91 0.00 3.17 3.37 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 24 T 8.49 4.53 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 1.15 0.00 0.00 25 D 8.58 5.43 0.00 2.30 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 26 V 8.17 4.50 2.10 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 0.69 0.00 0.00 0.95 0.00 0.00 27 P 0.00 4.22 0.00 1.94 1.92 0.00 3.78 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.38 0.00 28 A 8.51 4.21 1.18 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 0.00 0.00 29 S 8.53 4.34 0.00 3.80 3.67 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 0.00 0.00 0.00 0.00 30 R 8.74 3.88 0.00 1.94 2.00 0.00 3.27 0.00 0.00 3.30 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.77 0.00 31 F 8.18 4.18 0.00 3.02 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 K 8.16 3.92 0.00 2.05 1.78 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.61 7.81 33 E 8.28 3.55 0.00 2.20 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 2.25 2.51 0.00 34 E 7.86 3.80 0.00 1.86 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 2.23 2.46 0.00 35 I 6.99 3.51 1.75 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.52 0.79 0.00 0.00 36 L 7.88 3.84 0.00 1.24 1.44 0.43 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.80 4.39 0.00 2.06 2.11 0.00 3.26 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.85 0.00 38 I 8.18 3.71 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 1.42 0.59 0.95 0.00 0.00 39 L 8.39 4.02 0.00 1.92 1.81 0.70 1.22 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 40 A 9.10 4.07 1.50 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 41 R 8.14 3.79 0.00 1.84 2.24 0.00 3.30 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 42 E 8.30 4.05 0.00 2.20 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 2.51 2.54 0.00 43 G 8.66 3.99 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 0.00 44 F 7.92 4.53 0.00 3.40 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 45 I 7.46 4.68 2.08 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.60 0.93 0.00 0.00 46 K 8.58 3.91 0.00 2.09 1.98 0.00 1.91 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.52 1.48 7.81 47 G 7.17 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 48 Y 7.38 6.10 0.00 3.14 2.99 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 49 E 8.86 4.91 0.00 2.05 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 0.00 2.51 2.44 0.00 50 R 9.09 4.65 0.00 1.77 1.99 0.00 3.35 0.00 0.00 3.30 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.86 0.00 51 V 7.90 4.32 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 0.70 0.00 0.00 1.12 0.00 0.00 52 D 8.59 4.47 0.00 2.61 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.70 4.18 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 0.91 0.00 0.00 0.74 0.00 0.00 54 D 9.94 4.69 0.00 2.83 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 55 G 8.71 3.83 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 0.00 0.00 0.00 56 K 8.06 4.42 0.00 2.07 1.45 0.00 1.94 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.57 7.81 57 P 0.00 4.61 0.00 1.94 1.94 0.00 3.37 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 2.04 2.08 0.00 58 Y 8.43 5.07 0.00 2.94 2.82 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 59 L 9.03 5.10 0.00 1.56 1.56 0.82 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 60 R 9.02 4.13 0.00 2.01 1.36 0.00 3.08 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.83 0.00 61 V 7.90 4.78 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 1.00 0.00 0.00 0.97 0.00 0.00 62 Y 9.41 4.54 0.00 2.97 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 63 L 8.69 4.41 0.00 1.68 1.30 1.03 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.19 4.66 0.00 1.73 1.60 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.47 7.81 65 Y 8.18 4.87 0.00 3.06 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 66 G 9.14 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 P 0.00 4.70 0.00 2.11 2.10 0.00 3.84 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 2.02 2.00 0.00 68 R 8.49 4.03 0.00 1.76 1.85 0.00 3.15 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.78 0.00 69 R 8.17 4.64 0.00 1.86 1.81 0.00 3.35 0.00 0.00 3.36 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.59 0.00 70 Q 8.37 4.19 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.50 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 71 G 8.53 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 0.00 0.00 0.00 72 P 0.00 4.17 0.00 2.05 2.01 0.00 3.83 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 73 D 8.74 4.31 0.00 2.85 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 74 P 0.00 4.76 0.00 2.11 2.10 0.00 3.36 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 1.92 1.90 0.00 75 R 8.02 3.67 0.00 1.83 1.99 0.00 3.27 0.00 0.00 3.54 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.76 0.00 76 P 0.00 4.50 0.00 2.14 1.99 0.00 3.26 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.45 0.00 77 E 9.19 4.15 0.00 2.21 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 0.00 2.50 2.60 0.00 78 Q 8.83 4.67 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.68 0.00 0.00 0.00 0.00 0.00 2.47 2.31 0.00 79 V 8.28 3.84 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 0.80 0.00 0.00 0.90 0.00 0.00 80 I 7.33 4.29 1.72 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 1.31 0.75 0.64 0.00 0.00 81 H 8.42 4.48 0.00 3.06 3.30 0.00 5.90 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.95 4.39 0.00 1.50 1.31 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.39 4.74 1.60 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.54 0.71 0.00 0.00 84 R 8.19 4.42 0.00 1.69 1.68 0.00 3.15 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.50 0.00 85 R 8.69 4.34 0.00 1.78 1.79 0.00 3.28 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 86 I 7.79 3.99 2.03 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 1.19 1.00 0.89 0.00 0.00 87 S 8.25 4.13 0.00 3.76 3.78 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 88 K 8.17 4.48 0.00 1.82 1.70 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.50 7.81 89 P 0.00 4.22 0.00 2.15 2.15 0.00 3.73 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 1.96 1.94 0.00 90 G 7.79 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 91 R 7.05 4.47 0.00 1.78 1.73 0.00 3.07 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.41 0.00 92 R 8.29 4.04 0.00 1.59 1.35 0.00 3.54 0.00 0.00 3.12 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 93 V 8.02 4.24 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 0.92 0.00 0.00 0.88 0.00 0.00 94 Y 8.35 5.44 0.00 2.89 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 95 V 8.94 4.68 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 0.86 0.00 0.00 1.05 0.00 0.00 96 G 9.04 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 0.00 0.00 0.00 97 V 8.34 3.75 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 0.95 0.00 0.00 0.97 0.00 0.00 98 K 8.07 4.37 0.00 1.78 1.87 0.00 1.81 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.38 7.81 99 E 8.00 4.91 0.00 2.00 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 0.00 2.11 2.32 0.00 100 I 7.67 4.39 1.89 0.00 0.00 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 1.44 0.91 0.93 0.00 0.00 101 P 0.00 4.29 0.00 2.06 1.99 0.00 3.66 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 2.04 2.12 0.00 102 R 8.17 4.40 0.00 1.73 1.86 0.00 3.24 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 103 V 8.25 3.50 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 1.17 0.00 0.00 1.08 0.00 0.00 104 R 9.05 3.17 0.00 1.12 1.55 0.00 2.52 0.00 0.00 2.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.09 0.00 105 R 8.66 3.81 0.00 1.82 1.88 0.00 3.35 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 106 G 8.29 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 0.00 0.00 0.00 0.00 107 L 8.09 4.05 0.00 1.75 1.80 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.04 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 0.00 0.00 0.00 0.00 109 I 8.89 4.93 2.11 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.80 1.06 0.00 0.00 110 A 8.57 5.20 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 0.00 111 I 8.08 4.32 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.94 0.90 0.00 0.00 112 L 8.38 4.79 0.00 2.08 1.79 0.97 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.89 4.72 0.00 4.23 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 0.00 114 T 8.19 4.71 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 1.35 0.00 0.00 115 S 8.90 4.22 0.00 3.91 3.92 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 0.00 116 K 8.75 4.14 0.00 1.76 1.88 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.38 7.81 117 G 7.10 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 0.00 0.00 0.00 0.00 118 V 7.84 4.11 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 0.72 0.00 0.00 0.86 0.00 0.00 119 L 8.76 5.03 0.00 1.62 1.49 0.94 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.46 4.48 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 1.35 0.00 0.00 121 D 8.41 4.39 0.00 2.98 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 0.00 122 R 7.88 3.92 0.00 1.90 2.03 0.00 3.15 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 123 E 8.50 4.21 0.00 2.11 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 0.00 2.35 2.36 0.00 124 A 8.18 3.99 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 0.00 125 R 7.83 3.89 0.00 1.98 2.00 0.00 3.18 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 126 K 8.30 3.71 0.00 1.85 1.96 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.53 7.81 127 L 8.12 4.31 0.00 1.70 1.70 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 128 G 7.98 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 0.00 129 V 8.02 4.44 2.10 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 0.73 0.00 0.00 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