NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 D 4.5567 8.3644 120.4441 53.7160 41.3780 176.1008 4 C 4.2626 8.9042 119.2067 53.3457 44.4299 171.2652 5 S 4.7357 8.5868 120.9674 56.0902 65.5031 173.4245 6 F 4.7054 8.2611 118.6079 55.7199 40.7065 176.3568 7 Q 4.3003 8.8668 125.9341 57.7587 28.9704 176.2794 8 H 4.9319 7.2292 111.2777 53.3411 29.4070 174.7850 9 S 4.2825 8.4063 116.7576 57.1899 60.8614 172.5559 10 P 4.4270 0.0000 0.0000 64.8686 31.4001 177.6106 11 I 4.0314 6.4868 118.2604 60.6592 37.7699 174.7823 12 S 4.9365 8.1698 116.1163 57.0486 65.5509 173.6821 13 S 4.7987 8.7355 113.6706 58.5446 62.6623 173.9041 14 D 4.8455 8.1838 117.4348 52.7399 40.3332 177.5331 15 F 4.4837 8.5221 118.3386 60.5131 37.8577 176.6629 16 A 3.8289 6.7335 120.8176 54.8702 18.0342 179.4427 17 V 3.4772 7.5833 116.0283 66.1645 31.1679 178.1189 18 K 3.9568 7.6185 116.9124 59.7864 31.9596 179.4542 19 I 3.8050 7.8755 119.9458 64.0282 36.9114 178.6083 20 R 3.8352 8.1969 119.7770 59.6500 29.8432 178.3331 21 E 3.9915 8.0969 116.9053 59.2253 29.6748 179.1949 22 L 4.1859 7.5632 119.8515 58.2402 42.2578 178.8734 23 S 4.1797 8.1414 112.7136 61.1779 62.0160 175.6052 24 D 4.4209 8.2026 120.6562 56.1903 40.5030 176.4741 25 Y 4.6203 7.6526 114.9560 57.4416 38.6411 175.2389 26 L 4.6644 7.3777 119.7122 53.1360 44.0344 177.0042 27 L 4.4544 8.0918 121.2347 53.4033 40.1712 177.5727 28 Q 3.9683 7.9014 123.9916 56.4408 30.1451 177.9950 29 D 4.7744 7.8280 118.5418 53.0383 40.1465 176.1622 30 Y 4.2533 8.0554 121.2905 57.5115 40.1605 172.5778 31 P 4.6242 0.0000 0.0000 63.2614 31.9099 175.8406 32 V 3.8199 8.7687 117.2470 59.8243 36.6511 173.5181 33 T 5.2165 8.2781 111.3963 60.2512 71.9627 173.1758 34 V 4.8733 8.5678 119.6012 61.1096 35.6649 173.7567 35 A 4.3957 8.8237 127.6823 51.9344 18.3588 177.8379 36 S 4.3722 9.6565 119.8643 60.1596 64.3357 174.5238 37 N 4.9067 7.9963 118.5532 50.4928 38.6008 173.0588 38 L 4.9353 8.3021 122.4789 52.5571 45.0839 176.3237 39 Q 4.1521 8.9694 126.0245 56.3562 29.5698 177.1520 40 D 4.5778 8.4075 127.8612 56.2705 43.9160 173.0902 41 D 4.5318 8.5152 121.7896 54.2931 41.4704 175.6595 42 E 3.8250 8.6090 123.7953 57.4897 29.0177 177.5974 43 L 4.3338 7.8444 121.1475 56.5899 43.3183 177.3277 44 C 4.4614 7.8134 116.1227 59.4858 38.9151 175.6776 45 G 3.4655 7.3645 104.1316 47.9312 0.0000 175.7226 46 G 3.7415 7.8702 107.4645 46.5833 0.0000 175.1176 47 L 3.9120 7.5819 121.3747 57.7911 42.5282 178.3628 48 W 4.5303 8.1892 119.1893 60.0581 28.9781 178.5089 49 R 3.9878 7.7255 116.1979 59.5991 29.5409 178.9236 50 L 3.8866 7.7177 118.1742 57.9329 41.5060 180.0416 51 V 3.3639 7.4957 117.9624 66.0237 31.3551 178.2294 52 L 4.0503 7.8067 117.8958 57.3372 41.4008 179.3418 53 A 4.1243 8.2241 121.3162 55.3255 18.5804 179.2831 54 Q 3.8608 8.2054 118.2758 59.3934 28.9860 178.6341 55 R 3.8210 7.8993 119.6624 59.3115 30.0009 178.6300 56 W 4.1476 7.9024 118.7775 59.9436 29.1654 178.4264 57 M 4.0552 8.5084 118.9717 58.4915 31.1236 178.7428 58 E 3.9917 7.9392 117.6363 59.1489 30.0766 178.9630 59 R 3.9868 7.8281 118.6755 59.6443 30.2423 178.6752 60 L 4.1578 8.9554 119.0939 57.6837 41.3155 179.5670 61 K 3.9680 7.7108 117.7129 59.6471 32.0133 178.9490 62 T 4.1701 7.7868 108.5310 63.3820 68.8917 175.6082 63 V 4.3673 7.4929 114.3085 60.9014 32.2801 175.0796 64 A 4.7403 7.7908 121.3987 49.9618 21.6417 178.1622 65 G 3.8376 8.3021 106.9723 43.9304 0.0000 174.9938 66 S 4.2307 8.5707 116.3074 61.8186 62.5270 177.0570 67 K 3.7153 7.8727 120.9303 58.6011 31.9729 178.7790 68 M 4.0004 7.7639 118.1881 58.1939 32.0915 178.1069 69 Q 4.0414 8.2056 118.7288 58.7559 28.8243 178.7580 70 G 3.6820 7.4909 106.2957 47.9344 0.0000 175.5577 71 L 3.9968 7.5828 121.7502 57.4314 41.6912 179.7373 72 L 4.0380 8.2536 119.2590 57.6174 41.4689 179.2427 73 E 3.8820 8.8427 119.8710 59.4532 29.4739 179.1129 74 R 4.0035 8.1159 116.7274 58.7072 30.4873 178.3951 75 V 4.0046 7.3517 116.4233 64.4634 31.7247 177.5388 76 N 4.3807 7.9661 117.4263 56.8660 38.3884 176.9147 77 T 3.8756 8.2860 111.5863 64.9926 68.4001 176.0923 78 E 4.2617 7.7115 119.5199 58.0556 29.5066 177.5396 79 I 3.6322 7.5170 110.3013 59.8598 38.4717 176.3407 80 H 4.2468 7.7148 120.0655 58.0670 29.6719 176.7597 81 F 4.4516 7.4941 115.8008 60.2558 37.7572 177.3068 82 V 4.2589 6.9716 113.1758 63.9525 31.0715 177.9038 83 T 4.3045 7.7167 108.6741 63.7431 68.8883 176.0363 84 K 4.1562 7.9802 120.7540 59.0272 32.3821 176.6207 85 C 4.5582 7.7339 113.9940 55.6068 41.3190 174.4272 86 A 4.2684 7.9572 127.3425 51.1653 16.6634 175.2632 87 F 4.5314 8.1066 118.7870 56.7140 39.9467 175.5131 88 Q 4.3165 8.9897 124.4414 54.9377 29.2150 174.6679 89 P 4.3438 0.0000 0.0000 62.4401 31.7301 174.0819 90 P 4.0590 0.0000 0.0000 62.3878 31.5530 174.4244 91 P 4.6103 0.0000 0.0000 61.8934 32.5842 177.3473 92 S 4.2410 8.4291 114.3803 61.4496 62.8763 175.1649 93 C 4.2324 8.0585 114.0590 57.7039 41.5644 173.2374 94 L 3.9540 7.2784 120.9700 55.2516 41.3044 175.8070 95 R 4.4727 8.2911 125.5295 54.5480 32.5748 175.6550 96 F 5.6803 8.5897 121.6870 55.7002 41.2068 175.4196 97 V 4.0576 9.1226 125.4845 60.7848 32.8560 175.7187 98 Q 4.3887 8.8492 124.7951 56.7126 29.2333 175.4391 99 T 4.8003 9.3577 118.7610 60.5817 71.9621 171.4676 100 N 5.2600 8.4040 118.8058 50.9998 39.6205 175.6631 101 I 3.4762 8.7099 121.6714 64.8595 38.0451 178.1816 102 S 4.0706 7.7965 112.5421 61.2143 62.1408 176.4869 103 R 3.8722 8.1812 120.9856 59.1607 29.8886 178.5040 104 L 3.9521 7.8991 119.5891 58.4381 41.7806 178.9246 105 L 4.1165 7.9525 117.5860 57.3405 41.6825 179.0165 106 Q 4.0742 7.9074 119.8745 59.0065 29.0338 177.4401 107 E 4.1294 8.2703 119.4461 60.2774 29.7815 179.7330 108 T 3.8676 7.9720 115.1670 66.7933 68.1887 176.5783 109 S 4.3282 8.3442 115.3325 61.2304 62.4654 175.9066 110 E 4.0781 8.0878 120.7643 59.6554 29.3499 179.0373 111 Q 4.0092 8.2850 118.0024 59.2395 28.6248 179.1894 112 L 3.9742 7.6511 118.1880 57.2658 41.4294 179.2505 113 V 4.1850 7.6979 118.1545 63.5325 31.8150 178.2782 114 A 3.9086 8.3600 121.1424 55.2886 18.6005 179.5112 115 L 4.2047 8.6971 117.5003 57.3061 41.3787 179.9155 116 K 4.1092 7.1730 120.7347 58.8517 32.1697 175.3967 117 P 4.4163 0.0000 0.0000 63.4353 32.1409 176.7907 118 W 4.6018 7.7983 118.1835 57.3929 30.7692 177.2021 119 I 3.9408 8.4706 119.4975 63.8470 37.6192 176.7405 120 T 4.5408 7.8460 109.2828 63.9996 69.5162 177.0332 121 R 4.0945 8.1069 119.1902 56.6018 30.4607 176.2469 122 Q 4.4957 7.2790 116.3159 53.6550 32.1076 174.1743 123 N 4.4726 8.1677 118.7354 52.5950 39.9156 174.8828 124 F 5.0291 8.6881 124.8732 57.5022 39.4039 178.2499 125 S 4.2135 8.1781 120.2993 61.5849 62.7177 176.9838 126 R 4.1577 7.9349 117.8429 58.6296 30.2439 178.3387 127 C 5.2236 8.5049 115.5109 59.5229 39.0642 175.7947 128 L 4.1365 7.8145 116.4172 55.2120 40.4990 176.2392 129 E 4.7781 8.6195 119.2189 54.5882 32.4967 175.0920 130 L 2.8373 8.2621 124.8070 54.2164 42.4018 176.6814 131 Q 4.4688 6.2337 121.4761 54.0484 33.0276 176.2271 132 C 5.0044 8.5009 117.7390 56.3659 41.2990 173.8304 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 3 D 8.36 4.56 0.00 2.61 2.70 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 0.00 0.00 0.00 0.00 4 C 8.90 4.26 0.00 2.68 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 5 S 8.59 4.74 0.00 3.85 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 F 8.26 4.71 0.00 3.07 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 7 Q 8.87 4.30 0.00 2.07 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 8 H 7.23 4.93 0.00 3.20 3.30 0.00 5.57 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.41 4.28 0.00 3.86 3.80 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 0.00 0.00 0.00 0.00 10 P 0.00 4.43 0.00 1.20 2.11 0.00 3.21 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 0.58 1.71 0.00 11 I 6.49 4.03 1.65 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 -0.18 0.52 0.00 0.00 12 S 8.17 4.94 0.00 4.02 3.93 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 13 S 8.74 4.80 0.00 3.88 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 14 D 8.18 4.85 0.00 2.75 2.78 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 15 F 8.52 4.48 0.00 3.38 3.48 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 16 A 6.73 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.58 3.48 2.22 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 1.05 0.00 0.00 0.87 0.00 0.00 18 K 7.62 3.96 0.00 2.21 1.90 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.74 1.57 7.81 19 I 7.88 3.81 2.04 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.23 0.94 0.00 0.00 20 R 8.20 3.84 0.00 1.85 2.06 0.00 3.08 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 21 E 8.10 3.99 0.00 2.17 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 2.38 2.66 0.00 22 L 7.56 4.19 0.00 1.80 1.87 0.92 0.77 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 23 S 8.14 4.18 0.00 4.02 3.93 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 24 D 8.20 4.42 0.00 2.80 2.37 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 25 Y 7.65 4.62 0.00 3.06 2.88 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 26 L 7.38 4.66 0.00 1.74 1.56 0.88 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.09 4.45 0.00 1.77 1.67 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 28 Q 7.90 3.97 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.02 0.00 0.00 0.00 0.00 0.00 2.45 2.36 0.00 29 D 7.83 4.77 0.00 2.65 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 30 Y 8.06 4.25 0.00 3.18 2.78 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 31 P 0.00 4.62 0.00 1.86 1.86 0.00 2.70 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.67 0.00 32 V 8.77 3.82 0.67 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 0.16 0.00 0.00 0.65 0.00 0.00 33 T 8.28 5.22 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 1.41 0.00 0.00 34 V 8.57 4.87 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 0.84 0.00 0.00 1.07 0.00 0.00 35 A 8.82 4.40 1.16 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 0.00 0.00 0.00 36 S 9.66 4.37 0.00 3.73 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 37 N 8.00 4.91 0.00 2.91 2.93 0.00 0.00 6.00 6.67 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 38 L 8.30 4.94 0.00 1.59 1.79 1.03 1.12 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 39 Q 8.97 4.15 0.00 2.44 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.85 0.00 0.00 0.00 0.00 0.00 2.58 2.52 0.00 40 D 8.41 4.58 0.00 2.72 2.47 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 41 D 8.52 4.53 0.00 2.80 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 42 E 8.61 3.83 0.00 1.76 1.69 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 2.18 2.19 0.00 43 L 7.84 4.33 0.00 1.41 1.48 0.65 0.92 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 44 C 7.81 4.46 0.00 1.66 2.16 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 0.00 45 G 7.36 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 46 G 7.87 3.74 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 0.00 0.00 0.00 47 L 7.58 3.91 0.00 1.40 1.80 1.01 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 48 W 8.19 4.53 0.00 3.54 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 49 R 7.73 3.99 0.00 2.09 2.05 0.00 3.37 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.94 0.00 50 L 7.72 3.89 0.00 1.82 1.60 1.04 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 51 V 7.50 3.36 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 0.80 0.00 0.00 0.14 0.00 0.00 52 L 7.81 4.05 0.00 1.96 1.86 1.08 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.22 4.12 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.21 3.86 0.00 2.13 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.74 0.00 0.00 0.00 0.00 0.00 2.53 2.57 0.00 55 R 7.90 3.82 0.00 2.01 1.99 0.00 3.00 0.00 0.00 2.87 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.52 0.00 56 W 7.90 4.15 0.00 3.55 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 57 M 8.51 4.06 0.00 2.04 2.27 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.94 0.00 58 E 7.94 3.99 0.00 2.10 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 2.46 2.46 0.00 59 R 7.83 3.99 0.00 1.84 2.10 0.00 2.21 0.00 0.00 2.58 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.39 0.00 60 L 8.96 4.16 0.00 1.73 1.65 0.85 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 61 K 7.71 3.97 0.00 1.97 1.88 0.00 1.81 0.00 0.00 1.87 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.45 7.81 62 T 7.79 4.17 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 1.26 0.00 0.00 63 V 7.49 4.37 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 0.78 0.00 0.00 1.04 0.00 0.00 64 A 7.79 4.74 1.24 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 65 G 8.30 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 0.00 0.00 0.00 66 S 8.57 4.23 0.00 4.02 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 0.00 67 K 7.87 3.72 0.00 1.66 1.69 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.41 7.81 68 M 7.76 4.00 0.00 2.24 1.98 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 69 Q 8.21 4.04 0.00 2.30 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.51 2.61 0.00 70 G 7.49 3.68 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 0.00 0.00 0.00 71 L 7.58 4.00 0.00 1.75 1.74 0.87 0.97 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 72 L 8.25 4.04 0.00 1.89 1.71 0.91 0.66 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 73 E 8.84 3.88 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 2.29 2.38 0.00 74 R 8.12 4.00 0.00 2.02 2.01 0.00 3.20 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 75 V 7.35 4.00 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 1.04 0.00 0.00 1.00 0.00 0.00 76 N 7.97 4.38 0.00 3.03 2.95 0.00 0.00 6.79 7.21 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 77 T 8.29 3.88 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 78 E 7.71 4.26 0.00 2.25 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 0.00 2.66 2.58 0.00 79 I 7.52 3.63 1.47 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 1.29 0.92 0.79 0.00 0.00 80 H 7.71 4.25 0.00 3.30 3.32 0.00 5.59 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 81 F 7.49 4.45 0.00 3.32 3.36 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 0.00 82 V 6.97 4.26 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 0.86 0.00 0.00 0.76 0.00 0.00 83 T 7.72 4.30 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 1.11 0.00 0.00 84 K 7.98 4.16 0.00 2.26 2.06 0.00 1.67 0.00 0.00 1.85 0.00 0.00 3.21 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.69 1.58 7.81 85 C 7.73 4.56 0.00 2.66 2.45 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 0.00 0.00 0.00 86 A 7.96 4.27 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 87 F 8.11 4.53 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 88 Q 8.99 4.32 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.77 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 89 P 0.00 4.34 0.00 2.06 2.07 0.00 3.82 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 1.99 2.02 0.00 90 P 0.00 4.06 0.00 2.14 2.17 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 91 P 0.00 4.61 0.00 2.14 2.12 0.00 3.59 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.11 0.00 92 S 8.43 4.24 0.00 3.86 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 93 C 8.06 4.23 0.00 3.02 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 94 L 7.28 3.95 0.00 1.58 1.40 0.81 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 95 R 8.29 4.47 0.00 1.74 1.75 0.00 3.10 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.50 0.00 96 F 8.59 5.68 0.00 3.01 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 97 V 9.12 4.06 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 0.79 0.00 0.00 0.96 0.00 0.00 98 Q 8.85 4.39 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 99 T 9.36 4.80 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 1.19 0.00 0.00 100 N 8.40 5.26 0.00 2.97 2.86 0.00 0.00 5.55 7.74 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 0.00 101 I 8.71 3.48 2.00 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 1.31 1.35 0.95 0.00 0.00 102 S 7.80 4.07 0.00 4.17 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 0.00 103 R 8.18 3.87 0.00 2.05 1.95 0.00 3.36 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.77 0.00 104 L 7.90 3.95 0.00 1.65 1.79 1.01 0.43 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 0.00 105 L 7.95 4.12 0.00 1.80 1.73 0.92 0.89 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 0.00 106 Q 7.91 4.07 0.00 2.31 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 107 E 8.27 4.13 0.00 2.09 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 0.00 2.36 2.60 0.00 108 T 7.97 3.87 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 1.23 0.00 0.00 109 S 8.34 4.33 0.00 4.10 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 0.00 110 E 8.09 4.08 0.00 2.17 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 2.44 2.71 0.00 111 Q 8.28 4.01 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 112 L 7.65 3.97 0.00 1.80 0.64 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.70 4.19 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 1.02 0.00 0.00 1.09 0.00 0.00 114 A 8.36 3.91 1.42 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 0.00 115 L 8.70 4.20 0.00 1.69 1.69 0.84 0.78 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 0.00 116 K 7.17 4.11 0.00 2.01 2.11 0.00 1.62 0.00 0.00 1.78 0.00 0.00 3.15 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.48 7.81 117 P 0.00 4.42 0.00 1.84 2.04 0.00 4.09 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 118 W 7.80 4.60 0.00 3.49 3.39 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.47 3.94 1.88 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.09 0.81 0.00 0.00 120 T 7.85 4.54 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 1.30 0.00 0.00 121 R 8.11 4.09 0.00 1.88 2.11 0.00 2.84 0.00 0.00 2.94 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 122 Q 7.28 4.50 0.00 1.37 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.70 0.00 0.00 0.00 0.00 0.00 2.65 2.53 0.00 123 N 8.17 4.47 0.00 2.54 2.57 0.00 0.00 6.91 7.02 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 0.00 124 F 8.69 5.03 0.00 3.29 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 0.00 125 S 8.18 4.21 0.00 3.91 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 0.00 126 R 7.93 4.16 0.00 1.87 2.11 0.00 3.27 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 127 C 8.50 5.22 0.00 3.60 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 0.00 128 L 7.81 4.14 0.00 1.69 1.75 0.80 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.62 4.78 0.00 1.90 1.78 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 2.24 2.30 0.00 130 L 8.26 2.84 0.00 1.23 1.18 0.86 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 6.23 4.47 0.00 1.85 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.24 2.21 0.00 132 C 8.50 5.00 0.00 2.79 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