NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9515 8.3549 109.7340 44.4988 0.0000 174.4118 2 S 4.4497 8.7168 112.0423 55.7594 66.8677 171.5919 3 S 4.4998 8.9535 119.9785 59.9922 64.7036 174.2798 4 G 3.9582 7.7308 113.3287 45.5175 0.0000 173.4168 5 S 3.7462 8.7095 110.9870 59.7460 60.6953 171.9305 6 S 4.8226 7.5964 112.4450 57.4123 66.9038 174.8273 7 G 4.1102 8.5898 107.6541 44.4971 0.0000 173.9073 8 V 3.5901 7.6146 118.2377 60.5267 32.4689 175.4287 9 I 4.2492 7.8086 121.1276 62.7183 39.4496 175.9875 10 R 4.1845 7.7730 118.2802 55.5222 33.7146 173.8673 11 R 4.9328 7.1294 119.3582 54.9889 32.1842 173.9641 12 G 3.8662 7.2027 108.1271 46.2125 0.0000 171.6123 13 W 5.0638 9.1877 120.1477 56.0193 29.5416 176.3890 14 L 4.8705 8.9945 125.1769 53.2677 45.0529 175.6404 15 T 5.0026 7.8723 115.5367 62.2018 71.6580 174.3310 16 I 4.0855 8.4798 128.1209 60.0897 35.4509 175.6669 17 N 4.1812 8.6675 123.6944 56.1812 38.6003 176.0865 18 N 4.5758 7.8624 120.3742 51.1753 36.3094 173.6438 19 I 4.5379 7.4213 125.0748 59.4101 40.5062 175.9944 20 S 4.4364 8.3935 119.9565 58.0635 60.9131 175.3399 21 L 3.9373 8.3007 124.2869 57.9264 42.1140 178.9764 22 M 3.9609 7.9805 117.6604 58.4205 32.0046 178.0015 23 K 4.1467 7.3063 119.9083 55.4591 30.7706 174.0659 24 G 4.1777 8.3285 116.8043 44.3635 0.0000 172.6325 25 G 4.0708 8.0394 107.3149 43.5476 0.0000 174.4890 26 S 3.7168 8.7306 114.1792 58.3572 60.6665 173.2052 27 K 4.2841 8.3294 120.2382 59.5340 33.2213 176.1967 28 E 5.0241 7.9559 118.7566 56.4275 30.5140 176.0126 29 Y 4.7763 9.3452 119.7876 56.2281 43.5516 174.3854 30 W 4.4279 9.2422 131.9835 56.2046 31.0496 174.5476 31 F 4.7857 8.6899 126.3672 56.8372 40.1069 175.1951 32 V 4.7586 9.2523 123.2523 60.8898 33.9334 173.3879 33 L 4.6234 9.5119 131.2620 54.6508 42.4924 175.4548 34 T 4.9495 8.8799 116.6993 59.3903 71.5503 174.9760 35 A 3.9816 8.9498 125.7261 55.6788 18.3131 179.1295 36 E 4.1361 7.6752 114.2793 58.5224 29.9911 177.1514 37 S 4.6406 8.0121 111.4986 57.9316 68.9475 172.4053 38 L 5.1773 9.3782 123.1842 54.0263 43.7477 175.2788 39 S 4.7835 8.7292 122.8091 56.0655 66.3644 173.2289 40 W 4.9460 6.6318 119.3932 54.9424 30.2511 174.4750 41 Y 4.9084 9.2850 122.3413 55.7460 40.2350 177.0680 42 K 4.0685 9.1210 120.3806 59.3329 32.6231 176.3847 43 D 4.5620 7.6247 115.9070 51.7960 42.3763 174.5474 44 E 2.0000 8.0560 115.2779 56.0610 29.3528 176.9725 45 E 4.1329 7.4909 119.8741 56.2910 31.3814 175.9117 46 E 2.6695 7.5327 116.5392 57.0065 26.2289 174.9348 47 K 4.1165 7.5396 118.2958 57.4088 33.3855 178.2645 48 E 4.4767 7.6455 127.2106 54.0261 28.9768 174.9890 49 K 3.9497 8.4098 124.1581 56.3945 33.0271 176.9316 50 K 4.1152 7.8275 126.3426 58.8495 32.1275 176.7683 51 Y 4.1508 6.4451 116.1015 56.6443 41.9901 171.9790 52 M 4.7641 7.6706 125.8839 52.9481 34.4011 174.5614 53 L 5.0980 8.3265 126.7721 52.5892 45.7040 174.4833 54 P 4.8216 0.0000 0.0000 62.2876 32.8777 175.8277 55 L 4.9272 8.3520 116.5117 54.6636 42.7838 176.9553 56 D 4.7709 8.3890 119.7215 54.7680 42.9547 176.3641 57 N 5.0118 8.1049 114.8535 52.8743 40.0627 174.2329 58 L 4.8927 7.4136 118.5112 53.1628 45.2633 175.1974 59 K 4.0629 7.5459 117.5956 55.7556 35.8307 173.7579 60 I 4.9734 8.0286 126.0590 59.7330 39.0448 174.7499 61 R 4.6937 8.2503 119.8586 54.9788 33.4464 173.6069 62 D 4.5859 8.6542 118.8887 54.1527 41.7393 175.8400 63 V 3.8925 8.0527 125.0361 60.6624 32.5615 175.7852 64 E 4.0123 8.6148 122.1665 56.7075 28.9408 176.6167 65 K 3.9269 8.6039 124.1273 56.4310 33.2355 176.1370 66 G 4.1585 7.7484 109.7541 44.9360 0.0000 173.6224 67 F 4.7299 7.3910 113.8175 56.7734 39.9226 175.9119 68 M 3.9897 5.8600 115.0415 53.9131 34.6170 174.3845 69 S 4.1507 8.4852 121.8739 58.7449 63.5797 173.4426 70 N 4.7575 7.8679 118.1861 53.1423 40.3547 173.3627 71 K 3.9563 7.1537 116.1134 56.5238 34.8764 174.0038 72 H 4.8104 7.9053 118.3350 54.9396 28.4240 174.3661 73 V 5.0595 8.1547 121.8668 59.4837 34.2765 174.8630 74 F 5.0394 8.7439 119.2046 54.9281 40.2880 174.2226 75 A 4.8864 8.0955 123.9398 50.7481 21.3586 175.9946 76 I 4.7255 8.0116 121.7201 59.4251 39.9506 174.7618 77 F 5.4035 8.2831 122.3137 54.8926 40.7595 174.2686 78 N 5.0667 8.7524 118.3322 52.9464 39.2643 176.2549 79 T 4.2059 8.5446 114.5835 63.4916 69.4567 174.4252 80 E 4.3814 8.1770 121.3040 57.4492 30.1437 175.8514 81 Q 3.2536 7.4389 116.0752 57.2829 28.0047 172.8784 82 R 4.7510 7.5334 111.7474 53.6337 33.1167 174.4363 83 N 4.5652 8.5828 116.3041 52.5300 37.8061 175.5780 84 V 4.3249 8.0587 116.5299 63.3242 31.7945 175.4320 85 Y 4.7433 7.3948 118.8962 55.2344 41.0031 175.1501 86 K 3.8843 6.8518 119.4858 59.1374 32.0426 177.2840 87 D 4.6856 7.7486 113.8587 54.8019 43.7434 176.2696 88 L 4.0901 7.8885 118.6223 55.1878 42.4431 177.7133 89 R 4.2866 8.6126 122.9176 58.5787 31.5269 175.9964 90 Q 5.3191 7.6297 115.9402 54.4863 31.5570 174.3638 91 I 4.0226 8.2230 124.7174 60.4316 38.9475 174.8123 92 E 4.3133 9.3853 128.2819 55.3086 30.2460 175.6456 93 L 4.2592 7.7353 126.2872 53.2123 42.4726 175.8136 94 A 4.9983 8.2650 126.8300 50.8256 20.8317 176.0143 95 C 5.0169 8.8338 120.2834 57.8973 30.8571 174.4422 96 D 4.4766 8.8775 119.0988 56.1679 39.3534 176.2203 97 S 4.7804 8.1436 113.1461 54.7563 66.2751 174.1588 98 Q 3.8087 8.6285 123.1101 59.2747 28.6876 177.7633 99 E 3.8501 8.1943 119.8161 59.6273 29.5346 178.5552 100 D 4.3500 7.8876 118.5673 57.4101 40.9033 178.6223 101 V 3.5678 7.9297 118.0875 66.3734 31.4326 177.0762 102 D 4.2923 8.4704 117.8281 57.5959 40.8309 178.4153 103 S 3.9136 7.8888 112.9334 61.2069 62.2641 175.7607 104 W 4.1628 8.1364 120.8347 60.1110 29.1349 178.3631 105 K 4.1866 8.4302 117.9860 59.5282 30.1020 178.9925 106 A 4.0396 8.1081 120.8577 55.6607 17.8037 179.9816 107 S 4.1986 8.3537 113.7369 61.6033 62.8666 176.6900 108 F 4.1417 8.1180 120.4985 60.6603 38.8335 177.4152 109 L 4.2697 7.4079 119.5408 57.4393 41.2435 179.8560 110 R 3.9420 7.5402 115.7422 59.3670 30.0552 178.7267 111 A 4.2452 7.7888 119.7841 54.3386 18.4689 176.6721 112 G 3.5450 6.8860 106.0110 45.9617 0.0000 174.1679 113 V 3.9645 8.1264 125.9739 62.5579 31.8077 174.9086 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 G 8.35 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 2 S 8.72 4.45 0.00 3.89 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 3 S 8.95 4.50 0.00 3.81 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 4 G 7.73 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.71 3.75 0.00 3.96 3.90 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 6 S 7.60 4.82 0.00 3.79 3.71 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 7 G 8.59 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 8 V 7.61 3.59 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 0.84 0.00 0.00 0.96 0.00 0.00 9 I 7.81 4.25 1.92 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.61 0.84 0.00 0.00 10 R 7.77 4.18 0.00 1.40 1.02 0.00 2.62 0.00 0.00 2.39 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 11 R 7.13 4.93 0.00 1.23 1.71 0.00 3.62 0.00 0.00 3.46 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.58 0.00 12 G 7.20 3.87 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 0.00 0.00 0.00 13 W 9.19 5.06 0.00 3.38 3.45 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 14 L 8.99 4.87 0.00 1.52 1.28 -0.42 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 15 T 7.87 5.00 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 1.24 0.00 0.00 16 I 8.48 4.09 1.76 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.51 0.61 0.00 0.00 17 N 8.67 4.18 0.00 2.67 2.82 0.00 0.00 6.98 7.92 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 18 N 7.86 4.58 0.00 2.76 2.77 0.00 0.00 5.54 7.81 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 19 I 7.42 4.54 2.01 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.89 0.96 0.00 0.00 20 S 8.39 4.44 0.00 4.02 3.87 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 21 L 8.30 3.94 0.00 1.64 1.73 1.02 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 22 M 7.98 3.96 0.00 2.00 2.17 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.66 0.00 23 K 7.31 4.15 0.00 1.70 1.79 0.00 1.85 0.00 0.00 1.73 0.00 0.00 3.18 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.47 7.81 24 G 8.33 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 0.00 0.00 0.00 0.00 25 G 8.04 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 26 S 8.73 3.72 0.00 3.99 3.81 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 27 K 8.33 4.28 0.00 1.94 2.18 0.00 1.58 0.00 0.00 1.90 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.56 1.56 7.81 28 E 7.96 5.02 0.00 2.26 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 0.00 2.41 2.73 0.00 29 Y 9.35 4.78 0.00 2.82 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 30 W 9.24 4.43 0.00 2.23 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 31 F 8.69 4.79 0.00 2.90 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 32 V 9.25 4.76 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 1.17 0.00 0.00 1.09 0.00 0.00 33 L 9.51 4.62 0.00 1.92 1.74 0.56 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.88 4.95 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 1.27 0.00 0.00 35 A 8.95 3.98 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 36 E 7.68 4.14 0.00 2.02 2.00 0.00 0.00 0.00 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 2.29 0.00 37 S 8.01 4.64 0.00 3.74 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 38 L 9.38 5.18 0.00 1.90 1.82 1.22 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 39 S 8.73 4.78 0.00 3.55 2.92 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 40 W 6.63 4.95 0.00 2.38 1.74 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 41 Y 9.29 4.91 0.00 3.21 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 K 9.12 4.07 0.00 1.86 2.00 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.23 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.64 1.50 7.81 43 D 7.62 4.56 0.00 2.89 3.04 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 44 E 8.06 2.00 0.00 1.16 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 1.97 1.85 0.00 45 E 7.49 4.13 0.00 2.03 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 0.00 2.11 2.22 0.00 46 E 7.53 2.67 0.00 1.73 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 1.47 1.95 0.00 47 K 7.54 4.12 0.00 1.75 1.79 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.36 7.81 48 E 7.65 4.48 0.00 2.01 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 2.26 2.30 0.00 49 K 8.41 3.95 0.00 1.89 1.68 0.00 1.44 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.04 0.67 7.81 50 K 7.83 4.12 0.00 1.50 1.93 0.00 1.92 0.00 0.00 1.88 0.00 0.00 3.11 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.66 1.77 7.81 51 Y 6.45 4.15 0.00 2.90 2.39 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 52 M 7.67 4.76 0.00 1.75 1.64 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.26 0.00 53 L 8.33 5.10 0.00 2.25 1.82 1.22 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.82 0.00 2.17 2.13 0.00 3.90 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.06 0.00 55 L 8.35 4.93 0.00 1.71 1.85 1.05 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 56 D 8.39 4.77 0.00 2.62 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 57 N 8.10 5.01 0.00 2.70 2.79 0.00 0.00 6.95 6.72 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 58 L 7.41 4.89 0.00 1.42 1.41 1.02 0.87 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 59 K 7.55 4.06 0.00 1.12 0.74 0.00 1.34 0.00 0.00 1.55 0.00 0.00 2.94 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.20 1.16 7.81 60 I 8.03 4.97 1.73 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 1.09 0.32 0.90 0.00 0.00 61 R 8.25 4.69 0.00 1.98 2.27 0.00 2.76 0.00 0.00 3.01 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.70 0.00 62 D 8.65 4.59 0.00 2.65 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 63 V 8.05 3.89 2.19 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 0.77 0.00 0.00 0.87 0.00 0.00 64 E 8.61 4.01 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 65 K 8.60 3.93 0.00 1.56 1.80 0.00 1.55 0.00 0.00 1.55 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.27 1.41 7.81 66 G 7.75 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 0.00 0.00 0.00 67 F 7.39 4.73 0.00 3.16 3.10 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 68 M 5.86 3.99 0.00 1.75 1.87 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 2.26 2.47 0.00 69 S 8.49 4.15 0.00 3.80 3.69 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 70 N 7.87 4.76 0.00 2.60 2.74 0.00 0.00 6.78 6.68 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 71 K 7.15 3.96 0.00 1.64 1.58 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.26 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.17 1.24 7.81 72 H 7.91 4.81 0.00 3.19 3.29 0.00 5.61 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 73 V 8.15 5.06 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 0.86 0.00 0.00 0.77 0.00 0.00 74 F 8.74 5.04 0.00 3.05 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 75 A 8.10 4.89 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 76 I 8.01 4.73 1.67 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 1.09 0.45 0.77 0.00 0.00 77 F 8.28 5.40 0.00 3.11 3.10 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 78 N 8.75 5.07 0.00 3.04 2.84 0.00 0.00 6.80 7.11 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 79 T 8.54 4.21 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 1.17 0.00 0.00 80 E 8.18 4.38 0.00 2.02 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 2.29 2.32 0.00 81 Q 7.44 3.25 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.70 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 82 R 7.53 4.75 0.00 1.93 2.03 0.00 3.13 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 83 N 8.58 4.57 0.00 3.12 2.89 0.00 0.00 6.29 7.62 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 84 V 8.06 4.32 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 1.05 0.00 0.00 85 Y 7.39 4.74 0.00 2.68 2.80 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 86 K 6.85 3.88 0.00 1.43 1.68 0.00 1.56 0.00 0.00 1.48 0.00 0.00 2.81 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.05 0.48 7.81 87 D 7.75 4.69 0.00 2.53 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 88 L 7.89 4.09 0.00 1.83 1.58 0.94 0.86 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 89 R 8.61 4.29 0.00 1.90 1.91 0.00 3.15 0.00 0.00 3.37 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 90 Q 7.63 5.32 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.62 0.00 0.00 0.00 0.00 0.00 2.20 2.18 0.00 91 I 8.22 4.02 1.47 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.92 0.43 0.00 0.00 92 E 9.39 4.31 0.00 1.71 1.73 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 2.16 2.15 0.00 93 L 7.74 4.26 0.00 0.27 0.72 0.18 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.27 5.00 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 95 C 8.83 5.02 0.00 2.96 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 96 D 8.88 4.48 0.00 2.83 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 97 S 8.14 4.78 0.00 3.87 3.71 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 98 Q 8.63 3.81 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.49 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 99 E 8.19 3.85 0.00 2.11 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 2.39 2.50 0.00 100 D 7.89 4.35 0.00 3.10 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 0.00 101 V 7.93 3.57 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 0.96 0.00 0.00 1.05 0.00 0.00 102 D 8.47 4.29 0.00 2.67 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 0.00 103 S 7.89 3.91 0.00 4.01 3.70 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 0.00 104 W 8.14 4.16 0.00 3.22 3.13 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 0.00 105 K 8.43 4.19 0.00 1.93 1.82 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.27 1.33 7.81 106 A 8.11 4.04 1.36 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 0.00 0.00 107 S 8.35 4.20 0.00 3.86 3.69 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 0.00 108 F 8.12 4.14 0.00 3.33 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 0.00 109 L 7.41 4.27 0.00 2.06 1.76 1.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 110 R 7.54 3.94 0.00 1.99 1.99 0.00 3.12 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 111 A 7.79 4.25 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 0.00 112 G 6.89 3.54 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 0.00 0.00 0.00 113 V 8.13 3.96 2.34 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 0.81 0.00 0.00 1.08 0.00 0.00