NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5376 8.3049 120.6145 55.5376 33.4087 174.8100 2 S 4.2088 8.6019 121.9941 55.3254 66.3405 172.5854 3 Q 4.4175 9.0143 126.1191 54.2771 29.1119 174.1754 4 W 4.5960 8.5021 125.5461 56.9180 28.8046 174.2708 5 K 4.3163 8.8588 126.7900 55.4496 33.1162 175.4861 6 D 4.5315 8.8326 127.8595 55.0995 40.8263 175.2296 7 I 4.2866 8.6841 125.5712 61.6133 37.9172 176.0057 8 C 4.6778 7.2592 113.3019 57.6064 32.9622 172.3963 9 K 4.5615 8.3065 118.3624 55.8773 32.2811 178.4402 10 I 3.7406 8.7475 122.9559 63.2038 38.1415 177.5707 11 D 4.3283 7.9807 118.7547 57.3810 41.3190 176.6242 12 D 4.3210 8.1444 118.4650 56.3871 41.3481 175.8427 13 I 4.1399 7.0938 120.2058 59.5358 36.7577 175.7045 14 L 4.1815 8.2346 125.4888 53.5693 42.1809 175.6229 15 P 4.1882 0.0000 0.0000 64.8658 31.9469 176.9876 16 E 4.4187 8.2181 116.6911 56.5691 28.6104 174.0109 17 T 4.8661 7.3551 119.0518 62.5783 74.0739 173.8250 18 G 4.3165 8.7704 109.6078 44.6219 0.0000 172.4937 19 V 4.6067 8.4799 115.7795 59.3859 36.4387 173.8417 20 C 4.9079 8.5232 122.4279 58.1054 32.9392 172.3891 21 A 4.8269 9.2267 127.1483 49.9726 22.8333 174.3331 22 L 4.8433 8.2703 117.6702 53.2964 44.4957 177.4587 23 L 4.3329 8.9532 128.0938 53.2623 42.8010 179.0087 24 G 3.8544 8.9457 117.8315 46.1457 0.0000 171.6275 25 D 4.7732 9.2664 118.9875 53.7595 42.7715 175.4975 26 E 4.2419 7.9857 121.2090 55.2373 29.9758 175.5975 27 Q 4.6590 8.5362 124.0565 55.5316 29.5492 174.8928 28 V 4.5021 8.4647 125.1048 61.1771 33.8711 174.5849 29 A 4.5445 9.2060 130.2488 50.6811 20.2918 176.3516 30 I 4.2689 8.6358 125.0434 61.0020 38.5304 175.3279 31 F 5.1057 9.3741 127.8185 55.8655 41.1061 175.4184 32 R 4.8140 9.1075 126.4790 54.4802 30.2523 174.0767 33 P 4.6852 0.0000 0.0000 63.2536 32.5019 174.8451 34 Y 4.9166 7.4989 117.4237 58.0568 41.9421 174.4784 35 H 4.7067 9.3568 114.7667 57.1477 30.4022 175.6561 36 S 4.5880 7.7564 115.8031 57.8266 64.7453 174.2583 37 D 4.7011 8.5182 123.1285 54.4635 39.3065 175.8539 38 Q 4.1948 7.5073 118.7106 55.8600 28.7845 175.8129 39 V 4.7304 7.9094 116.6128 59.5196 35.8461 175.1578 40 F 5.2372 9.5572 120.8756 55.8086 43.7951 173.7564 41 A 5.4672 8.9101 121.9652 50.5235 22.3267 175.1982 42 I 5.1538 8.6615 115.5564 58.8841 41.9252 174.2750 43 S 4.5896 8.5662 117.3216 58.8911 62.2785 174.0451 44 N 4.6116 9.4843 125.5437 54.9223 39.9128 174.1372 45 I 5.6367 7.8800 118.4345 58.8900 40.3721 174.6450 46 D 5.1064 8.7777 125.9288 51.8861 41.3015 175.3593 47 P 4.6093 0.0000 0.0000 63.7120 32.3929 176.7144 48 F 4.3653 8.5368 120.9693 60.2768 39.8473 175.9044 49 F 4.3874 9.6135 121.0041 57.5237 40.2247 173.1957 50 E 4.3232 8.6487 120.8054 56.5998 25.5779 171.4444 51 S 4.8118 9.3917 117.3305 56.5284 64.0503 175.5967 52 S 4.1830 8.9361 122.7309 60.7974 62.8464 175.5044 53 V 4.6319 7.5501 112.1719 59.6487 34.2167 175.3808 54 L 4.4208 8.6652 124.1800 55.8028 42.0862 178.3141 55 S 4.6245 7.8485 112.9760 59.5722 62.7558 174.2052 56 R 4.7207 7.5082 120.2944 56.1818 29.4834 175.6074 57 G 4.4197 8.1791 102.6937 44.3667 0.0000 172.3774 58 L 4.8992 8.5265 119.7738 52.9833 44.1459 176.0641 59 I 4.6186 8.3150 123.6143 60.7190 38.0729 175.1620 60 A 4.8009 9.4916 128.2003 50.2704 22.7863 175.0598 61 E 4.9768 8.8134 119.7154 56.5133 31.3326 175.9270 62 H 4.4132 9.6001 119.0215 56.8576 33.3318 174.5981 63 Q 3.5790 9.2507 124.3202 56.2730 26.0862 174.1776 64 G 3.9875 8.5481 105.3143 45.2915 0.0000 173.0653 65 E 4.6442 8.0832 118.5954 54.1871 32.4946 174.6776 66 L 4.8962 7.8656 120.3749 53.2724 43.5500 175.5358 67 W 5.2011 9.2272 124.6685 54.6624 32.4817 175.0468 68 V 4.5056 8.9426 124.6977 60.4181 32.8820 174.5730 69 A 5.1294 9.2631 128.5070 50.3796 21.1671 175.7698 70 S 4.8233 9.1667 120.4905 57.1686 63.6221 173.8814 71 P 4.4973 0.0000 0.0000 64.0229 31.4595 177.6970 72 L 4.3645 7.9356 118.4606 57.4224 43.2458 177.3751 73 K 4.7398 7.8773 114.5093 56.3839 34.1093 177.3130 74 K 4.5839 8.7373 122.5834 56.9032 33.9911 175.5606 75 Q 4.1793 8.1071 119.1647 56.0684 29.9655 175.3429 76 R 5.1421 9.6549 123.4213 54.5001 33.5982 174.4164 77 F 5.0446 9.2376 123.7119 55.4181 41.5861 175.2057 78 R 3.5947 8.6958 125.9803 55.9943 29.9952 177.1199 79 L 4.0001 8.4270 127.5864 56.9794 41.6483 178.7622 80 S 3.4166 7.5587 114.6283 61.0874 62.9288 173.9532 81 D 4.3356 7.8941 116.0947 54.0474 44.8447 177.4949 82 G 4.9312 7.1714 122.7265 45.8766 0.0000 172.0412 83 L 4.1238 7.1163 124.2184 53.2832 41.5046 174.3481 84 C 4.6294 8.3725 127.1190 58.7384 31.9626 174.1661 85 M 4.2593 8.7989 127.3356 57.7656 32.0345 176.6562 86 E 4.1087 7.8412 116.5944 57.7123 30.5273 176.2504 87 D 4.7765 7.7622 116.6077 53.5236 41.3662 177.2416 88 E 4.1435 8.1886 116.5033 59.1937 29.4778 178.3773 89 Q 3.9055 8.0630 118.1011 58.2099 29.0820 176.5702 90 F 4.5573 8.6912 114.5044 58.4457 40.6564 175.1812 91 S 4.3410 8.2768 116.4644 58.5299 62.8183 170.0920 92 V 4.3052 7.8952 116.7156 59.7731 33.5414 175.8123 93 K 3.9801 8.5962 123.2295 57.0911 32.9958 174.7007 94 H 5.3933 8.5646 126.7229 54.5975 32.1055 172.2544 95 Y 4.6905 9.0249 122.7447 56.0229 41.3644 174.6272 96 E 4.5879 8.7555 122.7223 55.3058 31.4019 174.7960 97 A 5.6751 8.8108 127.8410 50.2178 21.7942 175.2563 98 R 4.5667 9.2518 118.2112 54.3844 33.4873 175.0497 99 V 4.4057 8.3377 121.1526 61.5705 31.9045 174.4752 100 K 4.1810 9.1424 130.2699 55.3899 32.5287 175.9888 101 D 4.3887 9.6442 125.3561 55.3647 38.4494 174.8670 102 G 3.8800 8.3521 105.6292 45.2016 0.0000 173.0384 103 V 4.7302 7.8171 120.5446 60.6315 34.1178 174.8675 104 V 4.3505 9.0883 128.8001 62.9344 32.5435 174.6326 105 Q 5.3371 9.3896 127.2119 54.1606 32.3773 174.4653 106 L 5.3608 8.6790 122.0707 52.9681 45.0834 175.3336 107 R 4.3825 8.7871 123.3819 54.2550 32.3059 174.0107 108 G 4.0261 8.5157 117.3611 43.8258 0.0000 173.0239 109 G 3.9535 8.7694 103.6642 46.7209 0.0000 173.1757 110 S 4.3241 7.8143 117.1855 58.4690 63.0467 174.9261 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 4.54 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 2 S 8.60 4.21 0.00 3.98 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 3 Q 9.01 4.42 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 7.25 0.00 0.00 0.00 0.00 0.00 2.15 2.26 0.00 4 W 8.50 4.60 0.00 3.20 3.38 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 5 K 8.86 4.32 0.00 1.85 1.66 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.42 7.81 6 D 8.83 4.53 0.00 2.62 2.61 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 7 I 8.68 4.29 1.94 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.78 0.88 0.00 0.00 8 C 7.26 4.68 0.00 2.93 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 9 K 8.31 4.56 0.00 1.84 1.75 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.41 7.81 10 I 8.75 3.74 1.86 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 1.19 1.35 0.96 0.00 0.00 11 D 7.98 4.33 0.00 2.67 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.14 4.32 0.00 2.64 2.76 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 13 I 7.09 4.14 1.87 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 1.27 0.67 0.92 0.00 0.00 14 L 8.23 4.18 0.00 1.64 1.60 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.19 0.00 1.89 1.45 0.00 3.77 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 1.97 0.00 16 E 8.22 4.42 0.00 2.14 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 0.00 2.26 2.39 0.00 17 T 7.36 4.87 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 1.24 0.00 0.00 18 G 8.77 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 0.00 0.00 0.00 0.00 19 V 8.48 4.61 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 0.74 0.00 0.00 0.89 0.00 0.00 20 C 8.52 4.91 0.00 2.89 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 21 A 9.23 4.83 1.12 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 22 L 8.27 4.84 0.00 1.44 1.51 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.95 4.33 0.00 1.37 1.23 0.82 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.95 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 25 D 9.27 4.77 0.00 2.64 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.99 4.24 0.00 1.98 1.84 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 2.30 2.53 0.00 27 Q 8.54 4.66 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.90 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 28 V 8.46 4.50 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 0.92 0.00 0.00 0.24 0.00 0.00 29 A 9.21 4.54 1.06 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 0.00 0.00 30 I 8.64 4.27 1.76 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.63 0.90 0.00 0.00 31 F 9.37 5.11 0.00 3.04 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 32 R 9.11 4.81 0.00 1.92 1.89 0.00 3.10 0.00 0.00 3.49 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.62 0.00 33 P 0.00 4.69 0.00 1.81 2.14 0.00 4.24 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.44 0.00 34 Y 7.50 4.92 0.00 2.93 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 35 H 9.36 4.71 0.00 3.18 3.40 0.00 5.71 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 S 7.76 4.59 0.00 3.84 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 37 D 8.52 4.70 0.00 2.74 2.73 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 0.00 38 Q 7.51 4.19 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.72 6.38 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 39 V 7.91 4.73 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 0.72 0.00 0.00 0.88 0.00 0.00 40 F 9.56 5.24 0.00 3.03 3.03 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 0.00 0.00 0.00 41 A 8.91 5.47 1.33 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 42 I 8.66 5.15 2.06 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 1.49 1.12 1.09 0.00 0.00 43 S 8.57 4.59 0.00 4.05 3.88 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 0.00 0.00 0.00 44 N 9.48 4.61 0.00 2.79 2.82 0.00 0.00 6.62 7.79 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 45 I 7.88 5.64 1.90 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 1.16 1.72 1.00 0.00 0.00 46 D 8.78 5.11 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 47 P 0.00 4.61 0.00 2.22 2.24 0.00 3.96 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 2.02 2.00 0.00 48 F 8.54 4.37 0.00 3.05 3.25 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 49 F 9.61 4.39 0.00 3.22 3.38 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 50 E 8.65 4.32 0.00 2.13 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 2.21 2.26 0.00 51 S 9.39 4.81 0.00 4.02 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 52 S 8.94 4.18 0.00 3.88 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 53 V 7.55 4.63 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 0.83 0.00 0.00 0.96 0.00 0.00 54 L 8.67 4.42 0.00 1.77 1.70 0.17 0.78 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 55 S 7.85 4.62 0.00 3.82 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 56 R 7.51 4.72 0.00 1.89 1.94 0.00 3.24 0.00 0.00 3.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 57 G 8.18 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 L 8.53 4.90 0.00 1.61 1.59 0.96 0.77 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 59 I 8.32 4.62 1.85 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 0.51 0.83 0.00 0.00 60 A 9.49 4.80 1.19 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 61 E 8.81 4.98 0.00 1.90 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 2.35 2.41 0.00 62 H 9.60 4.41 0.00 2.92 2.75 0.00 5.67 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 9.25 3.58 0.00 2.47 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 5.62 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 64 G 8.55 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 65 E 8.08 4.64 0.00 2.30 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 66 L 7.87 4.90 0.00 1.36 1.43 0.62 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 67 W 9.23 5.20 0.00 3.28 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 68 V 8.94 4.51 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 0.45 0.00 0.00 0.76 0.00 0.00 69 A 9.26 5.13 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 70 S 9.17 4.82 0.00 3.87 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 71 P 0.00 4.50 0.00 2.07 2.12 0.00 3.78 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 72 L 7.94 4.36 0.00 1.67 1.85 0.99 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 73 K 7.88 4.74 0.00 1.34 0.74 0.00 1.77 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.24 0.53 7.81 74 K 8.74 4.58 0.00 1.56 1.61 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.73 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.26 1.37 7.81 75 Q 8.11 4.18 0.00 2.13 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.40 7.49 0.00 0.00 0.00 0.00 0.00 2.30 2.19 0.00 76 R 9.65 5.14 0.00 1.52 1.91 0.00 2.86 0.00 0.00 2.74 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.62 0.00 77 F 9.24 5.04 0.00 2.92 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 78 R 8.70 3.59 0.00 0.67 1.33 0.00 2.45 0.00 0.00 2.76 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.61 0.00 79 L 8.43 4.00 0.00 1.17 1.49 0.77 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 80 S 7.56 3.42 0.00 3.55 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 81 D 7.89 4.34 0.00 2.39 2.42 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.17 4.93 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 0.00 0.00 0.00 83 L 7.12 4.12 0.00 1.64 1.38 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 84 C 8.37 4.63 0.00 2.68 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 M 8.80 4.26 0.00 1.75 1.76 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 2.44 2.17 0.00 86 E 7.84 4.11 0.00 1.74 1.77 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 2.08 2.18 0.00 87 D 7.76 4.78 0.00 2.72 2.60 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 88 E 8.19 4.14 0.00 2.07 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 0.00 2.25 2.50 0.00 89 Q 8.06 3.91 0.00 1.61 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.79 0.00 0.00 0.00 0.00 0.00 2.22 2.15 0.00 90 F 8.69 4.56 0.00 3.22 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 91 S 8.28 4.34 0.00 4.11 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 92 V 7.90 4.31 2.23 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 0.90 0.00 0.00 1.22 0.00 0.00 93 K 8.60 3.98 0.00 1.89 1.73 0.00 1.34 0.00 0.00 1.68 0.00 0.00 2.55 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.46 0.77 7.81 94 H 8.56 5.39 0.00 3.23 3.07 0.00 5.74 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 Y 9.02 4.69 0.00 2.79 2.85 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 96 E 8.76 4.59 0.00 2.05 1.67 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 2.52 2.60 0.00 97 A 8.81 5.68 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 98 R 9.25 4.57 0.00 1.64 1.81 0.00 2.21 0.00 0.00 2.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.24 0.00 99 V 8.34 4.41 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 0.85 0.00 0.00 0.93 0.00 0.00 100 K 9.14 4.18 0.00 1.58 1.58 0.00 1.73 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.25 7.81 101 D 9.64 4.39 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 0.00 102 G 8.35 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 103 V 7.82 4.73 2.18 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 0.76 0.00 0.00 0.99 0.00 0.00 104 V 9.09 4.35 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 0.94 0.00 0.00 0.97 0.00 0.00 105 Q 9.39 5.34 0.00 2.16 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.55 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 106 L 8.68 5.36 0.00 1.53 1.44 0.78 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.79 4.38 0.00 0.67 0.66 0.00 2.73 0.00 0.00 2.42 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.74 0.00 108 G 8.52 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 109 G 8.77 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 0.00 110 S 7.81 4.32 0.00 3.80 3.73 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 0.00