NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3626 0.0000 0.0000 62.2816 33.0720 176.3595 3 K 4.0496 8.5023 117.1298 58.4960 30.8325 175.9951 4 K 4.3436 7.0529 117.6577 53.1580 34.1995 174.2887 5 V 4.5479 8.1785 126.3846 61.8341 33.5588 174.3622 6 L 5.0793 8.2456 124.9242 53.3095 46.1633 175.0710 7 T 4.9903 8.1769 108.9969 60.9852 71.3211 173.3902 8 G 4.1166 9.0004 112.0610 45.5294 0.0000 171.7083 9 V 4.7661 7.9108 113.5759 59.4888 33.7662 176.3296 10 V 4.1716 8.6275 126.1928 63.4245 31.7455 176.4575 11 V 4.2967 8.5972 127.1851 61.8410 33.2361 175.9424 12 S 4.7513 7.7636 116.0681 56.6199 65.8079 173.6741 13 D 5.0077 8.5773 123.1140 53.0997 40.6054 175.6341 14 K 4.4300 7.5446 118.5095 56.8630 31.9385 176.8012 15 M 4.8666 7.5159 115.8885 53.6073 35.9570 175.2642 16 Q 4.0312 8.6518 120.9432 57.1384 29.6607 176.5875 17 K 4.4698 9.0553 119.5434 56.2609 30.0418 174.2834 18 T 5.2342 7.4753 112.0005 62.4966 72.7718 173.7346 19 V 4.7048 8.7474 115.4089 60.5114 36.8502 173.7880 20 T 4.9988 8.7304 120.7422 62.3149 70.5109 173.9369 21 V 4.6458 9.2428 126.7868 60.9559 34.5905 173.6472 22 L 5.0963 8.3851 129.9654 53.7120 43.9370 175.4149 23 V 4.5531 8.7312 118.9487 59.7366 35.4475 174.9894 24 E 5.1855 8.8285 124.0612 55.3177 32.2948 175.9518 25 R 4.6574 9.0041 118.4926 55.3658 32.5333 175.0351 26 Q 4.9619 8.8405 122.9448 55.0939 30.1457 174.8826 27 F 4.8183 7.9031 114.3082 55.8471 41.3500 171.5155 28 P 5.2209 0.0000 0.0000 62.1453 32.1445 176.0042 29 H 4.3618 9.0928 125.2062 55.3600 30.3011 174.2790 30 P 4.5022 0.0000 0.0000 64.4962 31.1605 176.4112 31 L 4.4935 7.8645 117.0345 55.0054 44.3246 175.8958 32 Y 4.8386 7.9259 112.7887 56.9679 39.6720 175.9870 33 G 4.2849 8.2131 116.2412 46.7432 0.0000 174.0255 34 K 4.0680 7.5753 120.7375 54.2497 33.5418 176.2023 35 V 4.3676 8.0644 127.2693 61.1272 29.2147 175.2944 36 I 3.8654 7.2482 117.0306 61.3427 39.2571 176.6734 37 K 5.1494 8.2768 121.0317 54.9156 35.7587 175.6680 38 R 4.9956 8.8629 121.3638 54.8127 35.2261 173.7083 39 S 5.2496 8.4339 113.7572 57.4467 66.7699 172.8029 40 K 4.5152 8.7821 119.3876 55.2553 35.8694 174.1698 41 K 4.9691 8.3601 124.9898 55.0764 33.6937 175.2263 42 Y 4.6312 9.0410 123.1049 56.0806 40.6916 174.9573 43 L 4.8355 8.5554 122.7091 53.9271 43.2309 175.3334 44 A 4.9712 9.5719 127.8644 50.6530 21.2957 175.5154 45 H 4.5989 9.0731 122.3807 55.8938 31.0219 173.7642 46 D 5.1283 8.5210 127.7248 51.7765 41.1415 174.8528 47 P 4.2723 0.0000 0.0000 64.7942 31.7498 177.6578 48 E 4.2712 8.2813 116.3630 55.6751 30.3635 175.3765 49 E 3.9543 7.6262 117.5765 57.1862 27.3857 175.6537 50 K 3.9635 8.2839 117.9440 58.4288 33.3205 176.2230 51 Y 4.5735 8.9270 118.6473 55.8437 37.7463 175.4489 52 K 4.3789 8.4047 124.9201 54.6161 35.1267 175.7833 53 L 3.9760 8.1684 120.0761 56.6198 42.2497 177.9196 54 G 4.1066 8.5487 111.3564 45.9182 0.0000 174.2023 55 D 4.6700 7.8006 120.5659 54.7744 41.8762 176.1752 56 V 4.2891 8.7005 123.9972 62.6556 33.2180 175.1749 57 V 5.1337 8.5034 118.9385 60.1310 36.5239 173.7019 58 E 5.3073 8.9486 123.1819 55.5947 31.3419 175.6413 59 I 5.0639 8.0382 115.0524 59.3917 41.5910 173.4518 60 I 4.7281 8.6530 125.2118 58.7689 40.6105 174.2585 61 E 2.7053 7.9863 129.3153 56.7990 29.8792 176.0394 62 S 4.5047 7.6080 120.9245 56.9770 67.7676 174.1133 63 R 3.8478 8.5302 121.1186 56.0382 30.1346 174.4137 64 P 4.4351 0.0000 0.0000 63.3184 31.9206 175.9766 65 I 4.1928 8.7713 124.3533 62.7529 38.2806 175.3997 66 S 4.5516 7.4562 110.8421 57.0534 65.3829 172.8276 67 K 4.0169 8.8892 120.3223 59.4231 31.7464 177.9383 68 R 4.4441 7.8127 114.0357 55.9925 32.0946 176.1267 69 K 4.6541 7.9451 117.6570 55.3960 31.0827 176.8544 70 R 5.0710 8.4482 126.1535 55.2208 32.1165 174.9593 71 F 4.8611 8.3580 115.9435 56.4086 43.7101 174.1540 72 R 4.9583 8.6000 121.6742 54.4667 33.0042 175.5267 73 V 3.8446 7.7882 120.5905 63.0458 31.5921 175.4502 74 L 4.4310 9.1636 131.9679 56.4577 42.6309 176.4232 75 R 4.7119 7.1289 112.0306 55.7927 31.9654 173.3344 76 L 4.5040 8.8719 122.2010 55.5348 42.5403 176.3679 77 V 4.4456 8.2247 120.8218 63.7518 34.3562 175.2815 78 E 4.4466 7.7193 114.9172 56.5751 31.3983 175.6491 79 S 4.7344 8.5862 114.0175 58.9738 63.3233 173.9527 80 G 3.7280 7.8110 114.8156 46.6181 0.0000 174.3392 81 R 4.8484 7.9741 127.1321 54.0958 31.6317 177.4847 82 M 4.1338 8.3489 120.3462 58.3033 31.9754 177.3797 83 D 4.3763 8.2672 119.0161 56.8641 39.1078 179.1847 84 L 4.0112 7.6634 118.9509 57.6023 41.8679 179.3186 85 V 3.6863 7.8471 117.6250 66.1663 31.1529 177.6855 86 E 3.9274 9.0819 118.5479 59.9022 29.3689 179.0356 87 K 4.0000 7.7761 117.5236 60.4125 32.0051 178.2650 88 Y 4.0460 8.2929 119.0322 60.6479 38.8025 178.4238 89 L 3.8271 7.8765 119.9242 57.3400 41.7874 179.3088 90 I 3.6431 8.4751 120.6354 63.9710 36.7571 178.0645 91 R 3.5767 7.6052 118.8845 59.6966 29.9317 178.4167 92 R 3.4604 7.0653 117.3367 59.4750 29.9142 178.2360 93 Q 3.8712 7.7980 117.2772 59.4945 28.5627 178.6493 94 N 4.4813 8.4323 119.0627 55.3316 38.5032 177.0216 95 Y 4.4560 7.5800 118.7276 60.9326 37.6679 177.7275 96 Q 4.1150 8.3520 120.5936 58.7640 29.7307 177.9038 97 S 4.6653 7.7295 115.1319 57.7149 62.9853 174.7538 98 L 4.4287 7.6299 118.9380 57.1292 45.8183 177.6936 99 S 4.3877 7.2739 111.7903 58.2388 63.4791 174.3334 100 K 4.1412 8.1279 118.4047 57.2363 32.3506 175.9730 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 P 0.00 4.36 0.00 2.18 2.14 0.00 3.72 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 1.88 1.99 0.00 3 K 8.50 4.05 0.00 1.88 1.89 0.00 1.66 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.45 7.81 4 K 7.05 4.34 0.00 1.74 1.72 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.50 7.81 5 V 8.18 4.55 2.07 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 0.89 0.00 0.00 0.98 0.00 0.00 6 L 8.25 5.08 0.00 1.38 1.40 0.18 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.18 4.99 4.21 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 1.18 0.00 0.00 8 G 9.00 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 9 V 7.91 4.77 2.05 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 0.92 0.00 0.00 0.95 0.00 0.00 10 V 8.63 4.17 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 1.03 0.00 0.00 1.07 0.00 0.00 11 V 8.60 4.30 1.72 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 0.26 0.00 0.00 0.45 0.00 0.00 12 S 7.76 4.75 0.00 3.88 3.66 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 13 D 8.58 5.01 0.00 2.78 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 14 K 7.54 4.43 0.00 1.74 1.88 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.47 7.81 15 M 7.52 4.87 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.57 0.00 16 Q 8.65 4.03 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.27 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 17 K 9.06 4.47 0.00 1.92 1.79 0.00 1.91 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.40 7.81 18 T 7.48 5.23 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 1.29 0.00 0.00 19 V 8.75 4.70 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 0.84 0.00 0.00 0.92 0.00 0.00 20 T 8.73 5.00 4.20 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 0.00 0.00 0.00 1.13 0.00 0.00 21 V 9.24 4.65 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 0.94 0.00 0.00 0.87 0.00 0.00 22 L 8.39 5.10 0.00 1.63 1.33 0.98 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.73 4.55 2.07 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 0.69 0.00 0.00 1.05 0.00 0.00 24 E 8.83 5.19 0.00 1.87 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 2.27 2.31 0.00 25 R 9.00 4.66 0.00 1.90 2.06 0.00 2.83 0.00 0.00 3.26 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.83 0.00 26 Q 8.84 4.96 0.00 2.08 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.04 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 27 F 7.90 4.82 0.00 3.20 3.20 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 0.00 0.00 0.00 0.00 28 P 0.00 5.22 0.00 2.06 2.15 0.00 3.95 0.00 0.00 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 29 H 9.09 4.36 0.00 3.15 3.22 0.00 5.59 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.50 0.00 2.12 2.12 0.00 3.57 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 1.62 1.90 0.00 31 L 7.86 4.49 0.00 1.28 1.08 0.75 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.93 4.84 0.00 2.86 2.77 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 0.00 0.00 0.00 33 G 8.21 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 0.00 0.00 0.00 0.00 34 K 7.58 4.07 0.00 1.86 1.71 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.48 1.48 7.81 35 V 8.06 4.37 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 0.84 0.00 0.00 0.92 0.00 0.00 36 I 7.25 3.87 1.71 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 0.47 -0.04 0.86 0.00 0.00 37 K 8.28 5.15 0.00 1.59 1.70 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.29 1.38 7.81 38 R 8.86 5.00 0.00 1.98 1.87 0.00 3.18 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 39 S 8.43 5.25 0.00 3.90 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 40 K 8.78 4.52 0.00 1.75 1.57 0.00 1.39 0.00 0.00 1.12 0.00 0.00 2.13 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.30 1.02 7.81 41 K 8.36 4.97 0.00 1.58 1.64 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.24 1.42 7.81 42 Y 9.04 4.63 0.00 2.65 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 43 L 8.56 4.84 0.00 1.70 1.66 0.93 0.87 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 44 A 9.57 4.97 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 45 H 9.07 4.60 0.00 3.34 3.26 0.00 5.74 0.00 0.00 0.00 0.00 6.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.52 5.13 0.00 2.91 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 47 P 0.00 4.27 0.00 2.26 2.29 0.00 3.91 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.08 0.00 48 E 8.28 4.27 0.00 1.92 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 2.25 2.32 0.00 49 E 7.63 3.95 0.00 2.05 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 2.26 2.23 0.00 50 K 8.28 3.96 0.00 1.54 1.75 0.00 1.48 0.00 0.00 1.37 0.00 0.00 2.20 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.24 0.21 7.81 51 Y 8.93 4.57 0.00 3.20 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 52 K 8.40 4.38 0.00 1.87 1.85 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.37 7.81 53 L 8.17 3.98 0.00 1.76 1.61 1.04 0.99 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 54 G 8.55 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 55 D 7.80 4.67 0.00 2.92 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 56 V 8.70 4.29 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 0.92 0.00 0.00 0.99 0.00 0.00 57 V 8.50 5.13 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 0.71 0.00 0.00 0.88 0.00 0.00 58 E 8.95 5.31 0.00 1.89 1.82 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 2.36 2.12 0.00 59 I 8.04 5.06 1.95 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.41 0.84 0.00 0.00 60 I 8.65 4.73 1.86 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 1.09 1.48 0.85 0.00 0.00 61 E 7.99 2.71 0.00 1.76 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 2.05 1.90 0.00 62 S 7.61 4.50 0.00 3.56 3.61 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 R 8.53 3.85 0.00 1.72 1.80 0.00 3.21 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 64 P 0.00 4.44 0.00 2.07 1.99 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 65 I 8.77 4.19 1.91 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.81 0.90 0.00 0.00 66 S 7.46 4.55 0.00 3.94 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 K 8.89 4.02 0.00 1.75 1.91 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.49 7.81 68 R 7.81 4.44 0.00 1.84 1.96 0.00 3.26 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 69 K 7.95 4.65 0.00 1.99 1.86 0.00 1.67 0.00 0.00 1.81 0.00 0.00 3.04 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.52 1.42 7.81 70 R 8.45 5.07 0.00 1.91 1.82 0.00 3.24 0.00 0.00 3.41 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 71 F 8.36 4.86 0.00 2.91 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 72 R 8.60 4.96 0.00 1.80 1.85 0.00 3.12 0.00 0.00 3.05 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 73 V 7.79 3.84 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 -0.28 0.00 0.00 0.92 0.00 0.00 74 L 9.16 4.43 0.00 1.67 1.64 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 75 R 7.13 4.71 0.00 1.93 2.00 0.00 3.20 0.00 0.00 3.24 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.36 0.00 76 L 8.87 4.50 0.00 1.86 1.70 1.11 0.88 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 77 V 8.22 4.45 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 0.86 0.00 0.00 0.93 0.00 0.00 78 E 7.72 4.45 0.00 2.04 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 2.13 2.16 0.00 79 S 8.59 4.73 0.00 3.86 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 80 G 7.81 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 0.00 0.00 0.00 81 R 7.97 4.85 0.00 2.09 1.87 0.00 3.82 0.00 0.00 3.30 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.54 0.00 82 M 8.35 4.13 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 83 D 8.27 4.38 0.00 2.87 2.97 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 84 L 7.66 4.01 0.00 1.75 1.75 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.85 3.69 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 1.12 0.00 0.00 0.94 0.00 0.00 86 E 9.08 3.93 0.00 2.15 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 2.50 2.50 0.00 87 K 7.78 4.00 0.00 1.97 1.86 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.63 1.66 7.81 88 Y 8.29 4.05 0.00 3.08 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 89 L 7.88 3.83 0.00 2.01 1.65 1.01 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.48 3.64 1.79 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 1.62 0.83 0.85 0.00 0.00 91 R 7.61 3.58 0.00 1.71 1.77 0.00 3.24 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.44 0.00 92 R 7.07 3.46 0.00 1.72 1.78 0.00 3.13 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.35 0.00 93 Q 7.80 3.87 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.51 0.00 94 N 8.43 4.48 0.00 2.63 2.87 0.00 0.00 6.71 7.01 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 95 Y 7.58 4.46 0.00 3.11 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 96 Q 8.35 4.11 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.54 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 97 S 7.73 4.67 0.00 4.02 4.04 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 98 L 7.63 4.43 0.00 1.72 1.66 1.06 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 99 S 7.27 4.39 0.00 4.07 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 0.00 100 K 8.13 4.14 0.00 1.81 1.74 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.29 1.36 7.81