NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.4340 8.2876 121.7155 56.2214 32.3743 174.7289 3 Q 5.0396 7.2061 113.8792 55.9374 31.7228 171.6222 4 Y 5.0884 8.7345 114.6832 56.8504 43.1666 175.0508 5 Y 5.7565 8.3488 121.8837 55.3868 42.6963 174.1784 6 G 4.0712 6.7870 108.4875 45.6186 0.0000 173.2427 7 T 3.9147 8.2296 116.4115 62.8051 71.1962 176.3464 8 G 3.6220 7.9904 104.9619 46.5958 0.0000 172.1248 9 R 4.9538 7.9178 123.5878 54.8997 33.2386 174.4940 10 R 4.0554 9.3621 119.7648 56.4060 33.0267 174.1671 11 K 3.7944 9.6331 128.3914 57.6393 29.6508 174.3429 12 E 3.7811 8.0882 116.2917 56.1593 28.9194 172.5050 13 A 5.5096 7.5943 119.2837 49.6279 21.1464 175.8743 14 V 4.9656 8.1753 115.5710 59.4842 35.1696 175.0201 15 A 4.9677 8.4907 125.1094 50.3197 21.8835 176.0412 16 R 3.9802 9.1078 123.3870 56.1228 31.7517 176.0496 17 V 4.2499 7.6862 123.6749 61.0256 34.5521 174.1536 18 F 5.3843 9.0603 127.5410 56.0078 41.4824 174.6301 19 L 5.2043 9.3742 125.7931 53.5543 43.3136 176.1096 20 R 5.2282 9.1305 123.2845 52.4269 33.4203 173.6637 21 P 4.1341 0.0000 0.0000 62.9673 31.9671 176.6399 22 G 4.1722 8.0939 109.0696 45.5578 0.0000 172.8475 23 N 4.5255 9.4212 124.4427 54.0338 37.7164 176.1065 24 G 4.9287 8.9402 101.1046 45.5874 0.0000 174.3576 25 K 4.3137 8.0530 121.8313 56.7380 33.9332 176.0698 26 V 4.8698 8.4792 123.5087 61.2290 34.6289 173.7008 27 T 4.9440 9.5048 122.4925 60.2898 68.7951 172.3439 28 V 4.2893 8.3157 128.6362 61.3829 33.6877 175.0162 29 N 4.1006 9.8866 126.3319 54.0554 37.0509 174.4066 30 G 4.4812 8.3637 103.6579 45.7334 0.0000 173.1989 31 Q 4.5446 8.2482 114.6267 55.5089 36.9524 174.4892 32 D 5.5297 8.2363 118.1308 56.8851 41.3359 174.8693 33 F 3.3834 7.5230 123.4529 60.2048 42.1728 176.5986 34 N 4.4885 8.5855 120.0046 56.0375 39.2660 177.1914 35 E 3.8712 8.7419 119.3074 58.9098 29.8613 177.0498 36 Y 4.0499 7.6408 118.0592 58.6655 38.9040 174.4402 37 F 4.4917 7.5041 116.7749 55.7050 41.0091 176.5162 38 Q 2.9210 7.2332 119.0148 56.7824 28.3536 175.5828 39 G 3.8260 8.5769 113.9960 45.2999 0.0000 173.1882 40 L 4.4931 7.7102 120.3059 52.6046 42.4472 177.1607 41 V 3.5893 8.3952 124.5633 65.3872 31.3512 177.1717 42 R 3.8327 7.8668 119.2969 58.8255 30.6040 180.5640 43 A 3.2077 6.8881 119.1328 54.9677 19.8421 179.5148 44 V 3.6998 7.9642 114.2027 66.2566 31.8226 177.6340 45 A 4.0096 9.0530 122.8101 55.6246 18.4971 179.5615 46 A 3.9095 8.1288 118.0236 55.3176 18.8447 178.9876 47 L 4.4299 7.7472 112.9050 54.7974 42.0669 178.2672 48 E 3.8559 9.1846 123.7035 58.6021 29.1965 177.0014 49 P 3.3235 0.0000 0.0000 65.3672 31.2733 178.1325 50 L 3.7978 7.4266 118.6691 57.4283 41.5604 179.1352 51 R 3.7948 7.8152 117.0727 59.6752 29.8652 178.3740 52 A 3.9886 7.4659 118.7281 54.7529 18.3444 179.0909 53 V 3.9703 7.5109 107.4049 60.3599 32.2654 175.9487 54 D 4.4576 7.7461 117.2316 55.3347 38.3714 174.2008 55 A 4.6270 7.7072 118.8379 51.8199 19.3978 178.3120 56 L 4.0073 8.1695 122.0131 58.6175 42.5070 178.4055 57 G 4.2634 7.8521 107.0292 42.8377 0.0000 173.2063 58 H 5.0386 7.8150 111.9161 54.4909 33.6079 174.6540 59 F 5.3927 8.3940 116.2963 55.6737 43.6949 173.3406 60 D 5.4472 9.6463 120.4168 52.5532 44.4305 175.0267 61 A 5.9110 8.6999 122.6911 49.4089 22.4522 174.2229 62 Y 5.1812 8.9169 123.5396 56.4153 41.0907 174.3581 63 I 5.6055 8.5330 126.0487 58.9905 42.2099 174.0732 64 T 4.8086 8.3144 121.7564 61.6931 71.4143 173.1226 65 V 4.9861 8.7814 126.3706 61.1945 34.7899 174.9316 66 R 4.3803 8.5938 119.2926 56.5623 33.3307 174.4527 67 G 4.1868 8.7140 110.8649 47.8972 0.0000 172.1391 68 G 4.1180 9.0184 112.8156 45.4842 0.0000 173.3748 69 G 4.2971 8.2382 112.1510 42.9431 0.0000 172.7596 70 K 4.2005 8.6810 117.9939 58.8368 31.8094 179.3241 71 S 4.2267 8.0306 111.9152 59.9572 63.1265 175.9901 72 G 3.4835 7.9888 106.8624 47.9275 0.0000 175.4560 73 Q 4.0503 8.2424 121.6441 58.7780 28.5930 179.2228 74 I 3.7346 7.8136 119.5115 64.7794 37.4449 177.8332 75 D 4.4729 7.5798 118.5920 57.2876 40.6948 178.2122 76 A 3.9369 8.4662 121.5598 55.6647 18.2447 179.3990 77 I 3.6185 8.3504 117.8567 64.7863 37.2173 178.3439 78 K 4.2055 7.9693 121.3281 58.6519 31.7328 178.6069 79 L 4.2675 8.4302 121.0837 58.0133 41.7133 178.5481 80 G 3.9917 8.0401 105.1420 48.3626 0.0000 175.1999 81 I 3.6735 7.9394 122.6052 63.5706 36.7948 178.2526 82 A 4.0724 7.1527 119.2562 54.5199 18.9591 179.6526 83 R 3.9429 8.7428 117.5303 59.4959 30.2903 179.0126 84 A 4.8362 8.9626 122.4573 54.6945 18.2803 179.4418 85 L 3.8326 7.4403 117.4658 58.0204 41.9272 178.9627 86 V 4.5582 7.5417 118.0639 64.8282 31.5115 177.4210 87 Q 4.1295 7.7368 117.4557 58.8326 28.6923 176.9520 88 Y 3.2016 7.1325 121.1059 59.5533 39.0555 176.5523 89 N 4.0689 7.3821 114.7248 50.8292 42.0967 173.0518 90 P 4.4614 0.0000 0.0000 65.0555 30.8295 177.3184 91 D 4.6105 8.0573 118.0803 56.0223 40.8581 177.2263 92 Y 4.6441 7.6927 117.1365 59.8660 38.0179 177.7629 93 R 3.9120 7.9937 119.3485 59.3415 30.0726 178.4343 94 A 3.9295 7.1751 119.4905 54.8823 18.2161 178.9207 95 K 4.3329 7.7634 114.6994 58.4182 33.8426 178.4569 96 L 4.3278 8.4056 118.9319 56.7326 41.3657 179.2873 97 K 4.0121 8.7880 120.9104 59.1395 32.0569 176.8532 98 P 3.7317 0.0000 0.0000 65.2827 31.3638 177.1964 99 L 4.0419 7.9690 115.2243 54.0339 42.1848 176.6494 100 G 4.0073 9.0353 108.1068 46.2330 0.0000 175.4225 101 F 4.2113 7.4886 117.5095 59.0850 38.8388 176.0983 102 L 4.4295 7.8473 119.4509 55.9590 40.8625 176.4313 103 T 4.3745 7.7843 116.8484 62.3464 69.8671 174.1887 104 R 4.2504 8.2029 125.1279 54.3815 30.4825 175.3557 105 D 4.3275 8.5813 125.4624 54.4824 40.2171 176.3832 106 A 3.9608 8.3590 129.7459 53.9543 18.7859 177.9668 107 R 3.9541 7.1479 115.7703 56.6709 30.3866 176.3593 108 V 4.4126 7.9682 121.0786 60.5153 34.7923 174.2426 109 V 3.4532 8.4790 123.4503 63.4414 31.4260 175.4305 110 E 4.1545 8.5896 128.0287 55.2211 30.3450 176.0308 111 R 3.8112 8.4621 125.2127 56.7193 30.4961 175.7966 112 K 4.2326 8.3695 125.0105 55.1029 32.0604 176.6419 113 K 4.1642 8.2679 126.1866 55.7957 33.3583 176.4312 114 Y 4.4153 7.4954 118.5458 57.5552 39.1074 176.8348 115 G 4.0794 9.0774 109.0574 45.5561 0.0000 172.7040 116 K 4.7187 7.2574 116.9731 55.0312 35.4778 174.5655 117 H 4.8498 9.1769 114.8932 57.4640 30.3415 176.3144 118 K 4.5460 7.5686 115.6367 55.8673 32.7900 176.3357 119 A 4.2548 8.4196 127.4999 52.2573 17.3298 179.5093 120 R 4.2309 7.6490 110.8347 57.6051 32.0332 175.7530 121 R 3.7981 7.9932 120.9898 56.4240 29.5731 174.6756 122 A 4.5874 8.2745 128.2057 50.1791 19.7215 175.3695 123 P 4.5095 0.0000 0.0000 62.9182 31.9247 175.9316 124 Q 4.7695 8.4410 117.8311 55.2010 30.3871 174.0232 125 Y 4.9625 8.0594 116.0982 55.5938 41.1523 175.1546 126 S 4.3915 8.6580 112.7911 56.7626 64.3868 175.2871 127 K 3.8963 8.3475 121.4111 57.7842 31.8989 174.6201 128 R 4.0966 8.5815 120.0270 56.6152 30.0201 175.6819 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 2 E 8.29 4.43 0.00 2.02 1.92 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 2.22 2.28 0.00 3 Q 7.21 5.04 0.00 2.28 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.61 0.00 0.00 0.00 0.00 0.00 2.16 2.26 0.00 4 Y 8.73 5.09 0.00 3.11 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 5 Y 8.35 5.76 0.00 3.14 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 6 G 6.79 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.23 3.91 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 1.18 0.00 0.00 8 G 7.99 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.92 4.95 0.00 1.70 1.73 0.00 3.28 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 10 R 9.36 4.06 0.00 1.84 1.78 0.00 3.34 0.00 0.00 3.09 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.54 0.00 11 K 9.63 3.79 0.00 1.87 1.77 0.00 1.92 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.40 7.81 12 E 8.09 3.78 0.00 2.27 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 2.26 2.36 0.00 13 A 7.59 5.51 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 14 V 8.18 4.97 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 0.81 0.00 0.00 1.01 0.00 0.00 15 A 8.49 4.97 1.15 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 0.00 0.00 16 R 9.11 3.98 0.00 1.89 1.66 0.00 3.33 0.00 0.00 3.38 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.64 0.00 17 V 7.69 4.25 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 0.90 0.00 0.00 0.85 0.00 0.00 18 F 9.06 5.38 0.00 3.42 3.07 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 0.00 0.00 0.00 0.00 19 L 9.37 5.20 0.00 1.91 1.94 0.54 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 20 R 9.13 5.23 0.00 1.79 1.93 0.00 3.19 0.00 0.00 3.26 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 21 P 0.00 4.13 0.00 1.88 1.89 0.00 3.78 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 22 G 8.09 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 0.00 0.00 0.00 0.00 23 N 9.42 4.53 0.00 2.76 2.58 0.00 0.00 6.67 8.09 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 24 G 8.94 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 25 K 8.05 4.31 0.00 1.91 1.98 0.00 1.28 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.66 1.43 7.81 26 V 8.48 4.87 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 1.05 0.00 0.00 0.83 0.00 0.00 27 T 9.50 4.94 4.34 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 1.54 0.00 0.00 28 V 8.32 4.29 1.66 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 0.27 0.00 0.00 0.88 0.00 0.00 29 N 9.89 4.10 0.00 2.59 2.76 0.00 0.00 7.04 7.35 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 30 G 8.36 4.48 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 0.00 31 Q 8.25 4.54 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 5.31 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 32 D 8.24 5.53 0.00 2.87 2.91 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 33 F 7.52 3.38 0.00 3.10 2.90 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 0.00 0.00 0.00 0.00 34 N 8.59 4.49 0.00 2.94 2.93 0.00 0.00 6.51 7.66 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 35 E 8.74 3.87 0.00 1.88 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 2.43 2.32 0.00 36 Y 7.64 4.05 0.00 2.64 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 0.00 0.00 0.00 0.00 37 F 7.50 4.49 0.00 2.66 2.51 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 38 Q 7.23 2.92 0.00 2.17 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.29 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 39 G 8.58 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 40 L 7.71 4.49 0.00 1.55 1.49 0.83 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.40 3.59 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 0.79 0.00 0.00 0.92 0.00 0.00 42 R 7.87 3.83 0.00 1.70 1.74 0.00 3.32 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 43 A 6.89 3.21 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.96 3.70 2.14 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 1.03 0.00 0.00 1.01 0.00 0.00 45 A 9.05 4.01 1.38 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 46 A 8.13 3.91 1.75 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 47 L 7.75 4.43 0.00 1.60 1.45 0.07 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 48 E 9.18 3.86 0.00 2.08 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 0.00 2.57 2.40 0.00 49 P 0.00 3.32 0.00 1.88 1.53 0.00 3.51 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.98 0.00 50 L 7.43 3.80 0.00 1.68 1.69 0.78 1.00 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 51 R 7.82 3.79 0.00 1.90 1.97 0.00 3.55 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 52 A 7.47 3.99 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 53 V 7.51 3.97 1.26 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 0.19 0.00 0.00 0.56 0.00 0.00 54 D 7.75 4.46 0.00 2.84 2.81 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 0.00 0.00 0.00 55 A 7.71 4.63 1.26 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 56 L 8.17 4.01 0.00 1.57 1.71 0.87 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 57 G 7.85 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 58 H 7.82 5.04 0.00 3.09 2.98 0.00 6.04 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.39 5.39 0.00 2.91 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 60 D 9.65 5.45 0.00 2.58 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 61 A 8.70 5.91 1.26 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 62 Y 8.92 5.18 0.00 3.12 3.11 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 63 I 8.53 5.61 1.85 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 1.30 0.63 0.91 0.00 0.00 64 T 8.31 4.81 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 65 V 8.78 4.99 1.90 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 0.91 0.00 0.00 0.83 0.00 0.00 66 R 8.59 4.38 0.00 1.90 1.97 0.00 2.80 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 67 G 8.71 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 68 G 9.02 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 0.00 0.00 0.00 0.00 69 G 8.24 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 0.00 0.00 0.00 0.00 70 K 8.68 4.20 0.00 1.79 1.91 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.13 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.72 1.37 7.81 71 S 8.03 4.23 0.00 3.78 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 72 G 7.99 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 0.00 0.00 0.00 73 Q 8.24 4.05 0.00 2.45 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.65 0.00 0.00 0.00 0.00 0.00 2.47 2.78 0.00 74 I 7.81 3.73 1.85 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.19 0.77 0.00 0.00 75 D 7.58 4.47 0.00 2.73 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 76 A 8.47 3.94 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.35 3.62 2.21 0.00 0.00 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 1.47 0.84 1.03 0.00 0.00 78 K 7.97 4.21 0.00 2.02 2.09 0.00 1.97 0.00 0.00 2.13 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.39 7.81 79 L 8.43 4.27 0.00 1.81 1.62 0.93 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 80 G 8.04 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 81 I 7.94 3.67 1.73 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 1.36 1.22 0.69 0.00 0.00 82 A 7.15 4.07 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 83 R 8.74 3.94 0.00 1.83 1.90 0.00 3.13 0.00 0.00 3.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.74 0.00 84 A 8.96 4.84 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 85 L 7.44 3.83 0.00 1.82 1.78 0.71 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.54 4.56 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 1.21 0.00 0.00 1.06 0.00 0.00 87 Q 7.74 4.13 0.00 2.53 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.61 0.00 0.00 0.00 0.00 0.00 2.52 2.92 0.00 88 Y 7.13 3.20 0.00 1.68 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 89 N 7.38 4.07 0.00 2.04 1.62 0.00 0.00 6.90 8.31 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 90 P 0.00 4.46 0.00 2.28 2.26 0.00 3.56 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 1.99 1.99 0.00 91 D 8.06 4.61 0.00 2.81 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 92 Y 7.69 4.64 0.00 3.28 2.87 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 93 R 7.99 3.91 0.00 1.95 2.00 0.00 3.18 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 94 A 7.18 3.93 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 95 K 7.76 4.33 0.00 1.76 1.86 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.50 7.81 96 L 8.41 4.33 0.00 1.98 1.80 0.83 0.66 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 97 K 8.79 4.01 0.00 2.06 1.81 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.63 7.81 98 P 0.00 3.73 0.00 2.08 2.12 0.00 3.89 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 2.05 2.13 0.00 99 L 7.97 4.04 0.00 1.76 0.91 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 100 G 9.04 4.01 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 0.00 101 F 7.49 4.21 0.00 3.11 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 0.00 102 L 7.85 4.43 0.00 1.75 1.81 0.92 0.68 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 0.00 103 T 7.78 4.37 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 1.19 0.00 0.00 104 R 8.20 4.25 0.00 1.75 1.83 0.00 3.40 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.53 0.00 105 D 8.58 4.33 0.00 2.78 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.36 3.96 1.28 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 0.00 0.00 107 R 7.15 3.95 0.00 1.89 1.90 0.00 3.12 0.00 0.00 3.13 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 108 V 7.97 4.41 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 0.77 0.00 0.00 0.95 0.00 0.00 109 V 8.48 3.45 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 0.81 0.00 0.00 0.93 0.00 0.00 110 E 8.59 4.15 0.00 1.96 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 2.26 2.27 0.00 111 R 8.46 3.81 0.00 1.79 1.82 0.00 3.39 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 112 K 8.37 4.23 0.00 1.75 1.73 0.00 1.86 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.41 7.81 113 K 8.27 4.16 0.00 1.79 1.43 0.00 1.76 0.00 0.00 1.84 0.00 0.00 3.06 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.25 1.29 7.81 114 Y 7.50 4.42 0.00 3.13 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 0.00 115 G 9.08 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 0.00 116 K 7.26 4.72 0.00 1.77 1.85 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.77 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.28 1.61 7.81 117 H 9.18 4.85 0.00 3.26 3.28 0.00 5.60 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.57 4.55 0.00 1.70 1.74 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.43 7.81 119 A 8.42 4.25 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.65 4.23 0.00 1.78 1.95 0.00 3.23 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 121 R 7.99 3.80 0.00 1.82 1.94 0.00 3.41 0.00 0.00 3.38 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.63 0.00 122 A 8.27 4.59 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 0.00 123 P 0.00 4.51 0.00 2.21 1.90 0.00 3.72 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.90 0.00 124 Q 8.44 4.77 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.85 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 125 Y 8.06 4.96 0.00 3.11 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 0.00 126 S 8.66 4.39 0.00 3.95 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 0.00 127 K 8.35 3.90 0.00 1.95 1.70 0.00 1.79 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.51 7.81 128 R 8.58 4.10 0.00 1.82 1.79 0.00 3.32 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00