NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.8845 8.0544 120.3890 62.9452 32.5534 174.5382 2 H 4.5135 8.7352 127.0527 53.5520 29.8776 171.2518 3 L 4.7072 7.8576 128.8311 52.8540 45.0407 176.3595 4 T 4.2000 8.5722 116.7019 60.8045 71.0248 174.0801 5 P 4.0117 0.0000 0.0000 65.8749 31.3648 178.9018 6 E 3.9524 8.0722 117.0628 59.2931 29.5535 179.0809 7 E 3.9139 7.8629 118.2939 59.1579 29.6465 178.9504 8 K 3.7916 8.9816 120.9584 59.6542 32.1915 178.8479 9 S 4.1134 8.2967 114.2584 61.5296 62.8158 176.3818 10 A 4.2276 7.9130 123.9849 54.3940 17.9578 179.9544 11 V 3.6131 7.6613 116.6251 66.4914 31.6902 178.2624 12 T 3.9106 7.9617 115.1328 66.6614 68.1329 176.0013 13 A 3.9917 8.2640 121.5217 55.5933 18.7140 179.1852 14 L 3.8693 7.8756 118.1373 57.9568 42.2137 178.9566 15 W 4.7667 9.0332 128.7811 60.2993 30.3783 178.0925 16 G 3.7857 8.0828 105.0866 46.8517 0.0000 174.2075 17 K 4.4270 7.9400 118.2968 55.9312 32.5135 176.7521 18 V 3.9039 7.2904 119.5949 62.7475 32.1422 176.6625 19 N 4.6201 8.1146 124.7135 51.3538 36.7378 175.4525 20 V 3.3825 7.7201 118.6499 65.0931 31.9649 176.7688 21 D 4.2406 8.1758 115.8195 58.2060 40.6612 178.8002 22 E 3.8412 8.1164 118.4017 59.6849 29.9491 179.4701 23 V 3.5101 8.1113 118.6632 65.6980 31.4275 178.1031 24 G 3.7296 8.7227 106.0028 47.9372 0.0000 175.9914 25 G 3.6051 7.8351 108.5963 46.9948 0.0000 175.5473 26 E 3.7787 8.1611 121.3553 59.0420 29.7659 178.6563 27 A 3.8827 8.0958 121.0630 55.1014 18.3521 179.3206 28 L 3.9152 7.9107 118.9244 58.1842 42.2874 179.3150 29 G 3.5802 7.9549 105.6284 48.0413 0.0000 175.8866 30 R 3.8999 7.9763 120.6995 58.4959 29.9744 178.9143 31 L 4.0454 7.8372 120.2259 58.3670 41.7407 179.1940 32 L 4.1531 7.5638 120.0564 56.9057 41.2124 179.8519 33 V 3.4911 7.2821 117.1971 66.0580 31.6684 178.0780 34 V 3.4942 7.6654 116.8897 64.3900 32.7139 175.5930 35 Y 3.7867 7.6792 117.0181 53.9906 37.9210 174.0450 36 P 4.3723 0.0000 0.0000 64.5436 31.7142 178.4305 37 W 4.3905 7.7770 116.1935 59.1984 27.6394 177.7813 38 T 4.4737 7.7497 110.6427 64.0588 68.1529 176.3556 39 Q 4.2681 8.1714 121.9042 58.7368 28.4171 178.3238 40 R 3.7993 7.6912 116.4122 59.4454 29.2422 178.5293 41 F 4.0941 7.7460 116.1770 58.6356 39.1632 175.6559 42 F 4.4170 8.1140 118.2333 56.7897 39.8924 177.1195 43 E 4.0543 8.4088 122.8680 59.3501 29.3702 178.3546 44 S 4.5047 7.9868 110.6829 59.2104 63.4859 174.6082 45 F 4.7405 8.1575 119.7190 57.6768 40.0622 175.5950 46 G 4.0584 8.0386 105.4361 44.4154 0.0000 173.8576 47 D 4.6659 8.7348 124.8073 53.6216 40.9394 176.0373 48 L 4.8479 8.3577 123.3248 54.1786 43.9994 178.2095 49 S 4.2981 8.6800 115.1705 60.3907 63.3725 174.9528 50 T 4.7201 7.3262 111.6778 58.5122 72.9859 172.9763 51 P 4.3812 0.0000 0.0000 65.7926 31.3030 178.7894 52 D 4.3493 8.0240 117.2993 56.8426 40.9669 178.1851 53 A 3.9455 8.1496 121.6831 55.2206 18.1950 179.7124 54 V 3.5046 7.8892 115.3546 66.7004 31.7557 178.0237 55 M 4.2678 7.9823 116.8311 58.0810 31.7778 178.6750 56 G 3.8388 7.9270 105.4647 45.9339 0.0000 173.4179 57 N 4.1977 7.7584 119.9385 53.7184 39.1728 173.6579 58 P 4.3777 0.0000 0.0000 64.8316 31.4082 178.8694 59 K 3.6906 8.1484 118.1507 59.0135 31.7874 179.3090 60 V 3.6852 7.8630 117.9915 66.0504 31.5051 177.7423 61 K 3.8391 7.9750 117.7921 59.5210 31.8592 178.7661 62 A 3.9585 8.0894 120.8035 55.6829 18.1950 179.1539 63 H 4.2760 8.5034 116.6812 59.5665 30.0568 177.7360 64 G 3.6145 8.4709 107.7190 47.5537 0.0000 175.5250 65 K 4.0254 8.0055 121.9952 59.3189 32.0589 179.1168 66 K 4.0283 7.8371 118.6602 59.3103 32.0524 179.3622 67 V 3.6831 7.9767 118.6932 66.3114 31.4365 178.2174 68 L 4.4767 8.2176 118.6659 57.5811 41.5431 179.7514 69 G 3.6913 8.1781 105.7086 47.7564 0.0000 175.6576 70 A 4.1193 8.0487 123.3793 54.7353 18.4006 179.4102 71 F 3.9395 8.2679 118.6899 61.7479 39.4057 177.2759 72 S 4.1869 9.0961 115.1515 62.0458 62.4758 176.4827 73 D 4.4358 7.9219 119.3461 57.2288 41.3323 178.2412 74 G 3.6756 8.0162 106.3186 47.6210 0.0000 175.7184 75 L 3.7213 7.3148 120.2976 57.2165 41.6364 178.7575 76 A 4.1792 7.4481 118.5889 53.1218 19.6194 176.7744 77 H 4.8963 7.7118 114.3059 54.6186 29.6439 175.3455 78 L 3.8918 7.9470 119.8252 57.6411 41.9130 178.5844 79 D 4.6222 7.8993 115.6228 54.7737 41.9559 175.5478 80 N 5.0460 8.0355 118.1013 51.8984 39.2762 175.4492 81 L 4.1417 7.8183 121.2953 57.7328 42.1439 179.2390 82 K 4.0609 8.0205 117.3509 59.3427 32.3567 179.2202 83 G 3.6559 7.9177 105.4020 48.1893 0.0000 175.6093 84 T 3.6722 7.9088 117.7086 65.5898 68.6110 175.6319 85 F 4.7252 8.0513 116.8131 57.4608 39.1372 177.5049 86 A 3.9153 7.6234 120.8757 56.1570 18.0865 180.3755 87 T 3.8546 7.7554 112.3394 66.6728 68.7385 177.1025 88 L 4.1345 7.9290 120.4477 57.6325 41.6252 179.3208 89 S 4.2005 8.7238 115.0049 60.8522 62.2532 176.0599 90 E 3.8803 7.8903 121.3135 59.2434 29.1040 178.8127 91 L 3.9117 7.7043 119.9504 58.8102 42.0890 178.8223 92 H 4.1498 8.5565 115.9815 58.8573 28.0331 177.6416 93 C 3.6992 8.2986 118.5910 62.2890 27.9644 175.8339 94 D 4.3894 8.0219 119.1041 56.4618 40.9976 177.6334 95 K 4.2873 7.8919 116.1768 58.2312 33.1601 177.8864 96 L 4.1267 8.0675 117.4172 55.7847 42.0416 176.6904 97 H 4.4464 7.3721 110.1732 56.0631 26.3212 175.5915 98 V 3.6002 8.1468 119.1720 62.1186 32.2484 175.0401 99 D 4.3518 8.7363 127.1119 53.5921 42.0467 175.0387 100 P 4.3797 0.0000 0.0000 66.2340 31.0869 178.1854 101 E 3.9398 8.4801 118.3390 59.3048 29.4144 178.4928 102 N 4.3506 8.0614 116.4860 56.0665 38.4837 177.3600 103 F 4.5110 7.5933 119.1359 60.6519 38.9884 177.9308 104 R 4.0252 8.0038 117.3158 59.2125 29.9742 178.9400 105 L 3.8663 7.9161 118.8826 57.5328 41.5561 179.2776 106 L 4.1206 8.1293 120.5419 57.9835 41.9990 179.1374 107 G 3.7346 8.1950 105.7451 47.9011 0.0000 175.2464 108 N 4.3821 8.2611 118.9485 56.2309 38.6449 177.6673 109 V 3.6378 8.3056 119.8866 65.9059 31.5617 177.7912 110 L 3.8555 8.4778 120.5343 58.0961 41.9523 179.1146 111 V 3.6661 8.0369 118.2914 66.2059 31.4134 177.8632 112 C 4.1244 7.9094 116.6207 62.6167 28.0128 176.2364 113 V 3.3573 7.8066 119.9772 65.8765 31.0309 178.1829 114 L 3.5847 7.6439 118.5295 57.1863 41.3208 179.3380 115 A 2.8557 7.0386 120.6989 55.1361 18.1478 178.8181 116 H 3.9311 7.7562 115.2808 59.9435 29.8215 176.4310 117 H 4.1231 7.6461 116.1869 57.6233 29.1024 176.8359 118 F 5.0153 8.0877 117.9764 54.8845 39.7304 179.0041 119 G 3.9238 9.1979 107.6175 46.0872 0.0000 175.7841 120 K 3.9305 9.3801 121.3642 59.3421 32.0100 177.0455 121 E 4.2217 8.4287 116.8174 57.1052 29.9970 176.9830 122 F 4.6778 7.9734 122.4890 57.9906 37.9556 175.2643 123 T 4.2673 7.3698 116.0798 59.8379 71.5865 173.7873 124 P 4.1360 0.0000 0.0000 65.3450 31.2853 177.2686 125 P 4.3485 0.0000 0.0000 65.6180 31.2371 178.6827 126 V 3.5483 7.3447 116.8834 65.8092 31.4124 177.6003 127 Q 3.6437 8.0498 119.4272 59.1795 28.7474 178.2572 128 A 3.9836 8.4390 121.6677 55.0477 18.3912 179.4806 129 A 3.8494 8.1199 119.2377 55.6597 18.4642 179.4388 130 Y 3.8473 8.6427 115.5782 61.2183 38.0828 178.6241 131 Q 4.0793 8.6642 120.8380 59.3542 29.1413 178.7931 132 K 4.0205 7.8743 119.0529 59.2423 32.0756 179.5269 133 V 3.4722 7.7112 118.4847 66.0625 31.4922 178.0949 134 V 3.8151 8.1894 117.9152 66.2103 31.3125 177.8691 135 A 4.1300 8.0999 120.1173 54.9700 18.2437 179.8455 136 G 3.4949 8.0875 104.3065 47.9157 0.0000 176.1137 137 V 3.2323 8.2775 121.0623 65.4941 31.5835 177.9283 138 A 3.8485 8.0674 120.5635 55.0620 17.9585 179.1461 139 N 4.3040 7.9404 114.5104 56.7586 38.8244 176.7372 140 A 4.0972 7.9229 122.1556 55.2074 17.9902 179.6705 141 L 3.6336 7.9271 117.6705 57.0843 41.4588 178.5579 142 A 4.6097 7.6450 118.5339 52.3607 18.9526 178.1105 143 H 3.9797 7.7065 118.3633 59.4925 29.6304 177.2936 144 K 3.9390 7.6102 118.1099 58.8160 31.8541 177.4820 145 Y 4.5645 8.0250 116.5690 59.5679 38.4698 175.4191 146 H 4.5954 7.9500 121.6690 56.0342 28.8091 174.9919 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 V 8.05 3.88 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 0.89 0.00 0.00 0.88 0.00 0.00 2 H 8.74 4.51 0.00 3.19 3.20 0.00 5.73 0.00 0.00 0.00 0.00 6.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.86 4.71 0.00 1.47 1.40 0.81 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.57 4.20 4.23 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 0.00 0.00 0.00 1.22 0.00 0.00 5 P 0.00 4.01 0.00 2.16 2.13 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 6 E 8.07 3.95 0.00 1.99 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 2.39 2.38 0.00 7 E 7.86 3.91 0.00 2.14 1.91 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 2.28 2.26 0.00 8 K 8.98 3.79 0.00 1.60 1.77 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.38 7.81 9 S 8.30 4.11 0.00 4.08 4.36 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 10 A 7.91 4.23 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 11 V 7.66 3.61 2.25 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 0.82 0.00 0.00 0.61 0.00 0.00 12 T 7.96 3.91 4.52 0.00 0.00 0.00 0.00 0.00 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 13 A 8.26 3.99 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 14 L 7.88 3.87 0.00 1.79 1.87 0.32 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 15 W 9.03 4.77 0.00 3.82 3.23 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 0.00 0.00 0.00 0.00 16 G 8.08 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 0.00 0.00 0.00 17 K 7.94 4.43 0.00 1.72 1.86 0.00 1.33 0.00 0.00 1.55 0.00 0.00 3.06 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.33 7.81 18 V 7.29 3.90 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 0.87 0.00 0.00 19 N 8.11 4.62 0.00 2.82 2.61 0.00 0.00 7.06 7.71 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 20 V 7.72 3.38 2.10 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 0.72 0.00 0.00 0.98 0.00 0.00 21 D 8.18 4.24 0.00 2.84 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.12 3.84 0.00 1.99 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 0.00 2.32 2.33 0.00 23 V 8.11 3.51 1.93 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 0.85 0.00 0.00 0.56 0.00 0.00 24 G 8.72 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 25 G 7.84 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 0.00 0.00 0.00 26 E 8.16 3.78 0.00 2.23 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 2.17 2.18 0.00 27 A 8.10 3.88 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 28 L 7.91 3.92 0.00 1.75 1.62 0.84 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.95 3.58 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 0.00 0.00 0.00 30 R 7.98 3.90 0.00 2.03 1.92 0.00 3.02 0.00 0.00 3.00 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.67 0.00 31 L 7.84 4.05 0.00 1.89 1.84 0.99 0.70 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 32 L 7.56 4.15 0.00 1.74 1.66 0.66 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.28 3.49 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 0.69 0.00 0.00 0.91 0.00 0.00 34 V 7.67 3.49 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 0.73 0.00 0.00 35 Y 7.68 3.79 0.00 2.62 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 36 P 0.00 4.37 0.00 2.27 2.25 0.00 3.48 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.85 0.00 37 W 7.78 4.39 0.00 3.60 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 38 T 7.75 4.47 4.49 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 1.26 0.00 0.00 39 Q 8.17 4.27 0.00 2.30 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 40 R 7.69 3.80 0.00 1.77 1.98 0.00 2.86 0.00 0.00 3.28 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.77 0.00 41 F 7.75 4.09 0.00 2.50 2.38 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 42 F 8.11 4.42 0.00 2.78 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 0.00 0.00 0.00 0.00 43 E 8.41 4.05 0.00 1.92 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 2.31 2.51 0.00 44 S 7.99 4.50 0.00 4.09 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 45 F 8.16 4.74 0.00 3.24 3.16 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 46 G 8.04 4.06 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 0.00 47 D 8.73 4.67 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 48 L 8.36 4.85 0.00 1.72 1.60 1.07 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.68 4.30 0.00 3.98 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 50 T 7.33 4.72 4.23 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 0.00 0.00 0.00 1.21 0.00 0.00 51 P 0.00 4.38 0.00 2.15 2.11 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 52 D 8.02 4.35 0.00 2.67 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 53 A 8.15 3.95 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 54 V 7.89 3.50 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 0.85 0.00 0.00 0.95 0.00 0.00 55 M 7.98 4.27 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.86 0.00 56 G 7.93 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 57 N 7.76 4.20 0.00 2.96 2.86 0.00 0.00 7.15 7.61 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 58 P 0.00 4.38 0.00 2.15 2.04 0.00 3.61 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 59 K 8.15 3.69 0.00 1.34 0.82 0.00 1.64 0.00 0.00 1.35 0.00 0.00 2.46 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.27 1.57 7.81 60 V 7.86 3.69 2.26 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 1.13 0.00 0.00 1.03 0.00 0.00 61 K 7.98 3.84 0.00 1.83 1.82 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.65 7.81 62 A 8.09 3.96 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 63 H 8.50 4.28 0.00 3.48 3.55 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.47 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 0.00 0.00 0.00 65 K 8.01 4.03 0.00 1.83 2.08 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.76 7.81 66 K 7.84 4.03 0.00 2.10 1.88 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.50 7.81 67 V 7.98 3.68 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 0.96 0.00 0.00 68 L 8.22 4.48 0.00 2.04 1.90 1.01 1.19 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 69 G 8.18 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 0.00 0.00 0.00 70 A 8.05 4.12 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.27 3.94 0.00 3.33 3.50 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.10 4.19 0.00 4.47 4.15 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 73 D 7.92 4.44 0.00 2.81 2.84 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 74 G 8.02 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 75 L 7.31 3.72 0.00 1.42 1.46 -0.14 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.45 4.18 1.13 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 0.00 0.00 77 H 7.71 4.90 0.00 3.09 3.13 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.95 3.89 0.00 1.54 1.67 0.78 1.02 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 79 D 7.90 4.62 0.00 2.63 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 80 N 8.04 5.05 0.00 2.65 2.60 0.00 0.00 7.12 6.24 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 81 L 7.82 4.14 0.00 1.77 1.86 0.89 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.02 4.06 0.00 1.64 1.75 0.00 1.56 0.00 0.00 1.64 0.00 0.00 3.10 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.13 1.48 7.81 83 G 7.92 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 0.00 0.00 0.00 84 T 7.91 3.67 4.02 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 0.42 0.00 0.00 85 F 8.05 4.73 0.00 3.09 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 86 A 7.62 3.92 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 87 T 7.76 3.85 4.23 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 0.00 0.00 0.00 1.22 0.00 0.00 88 L 7.93 4.13 0.00 2.00 1.81 1.13 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.72 4.20 0.00 3.97 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 90 E 7.89 3.88 0.00 2.15 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 2.31 2.52 0.00 91 L 7.70 3.91 0.00 1.74 1.92 0.91 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.56 4.15 0.00 3.30 3.66 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.30 3.70 0.00 2.61 1.95 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 94 D 8.02 4.39 0.00 2.79 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 95 K 7.89 4.29 0.00 1.86 1.83 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.41 7.81 96 L 8.07 4.13 0.00 1.78 1.76 0.75 1.31 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 97 H 7.37 4.45 0.00 3.51 3.50 0.00 5.62 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.15 3.60 1.76 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 -0.14 0.00 0.00 0.66 0.00 0.00 99 D 8.74 4.35 0.00 2.73 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.38 0.00 2.37 2.53 0.00 3.54 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.88 0.00 101 E 8.48 3.94 0.00 2.05 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 0.00 2.35 2.48 0.00 102 N 8.06 4.35 0.00 2.57 2.64 0.00 0.00 6.94 7.91 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 0.00 103 F 7.59 4.51 0.00 3.26 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 0.00 104 R 8.00 4.03 0.00 2.01 2.00 0.00 3.33 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.94 0.00 105 L 7.92 3.87 0.00 1.64 1.12 0.77 -0.13 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 0.00 106 L 8.13 4.12 0.00 1.82 1.75 0.94 0.95 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 0.00 107 G 8.19 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 0.00 108 N 8.26 4.38 0.00 3.00 2.97 0.00 0.00 6.69 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 0.00 109 V 8.31 3.64 2.25 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 1.05 0.00 0.00 1.20 0.00 0.00 110 L 8.48 3.86 0.00 1.68 1.73 0.83 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.04 3.67 2.30 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 1.24 0.00 0.00 1.15 0.00 0.00 112 C 7.91 4.12 0.00 3.15 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 0.00 113 V 7.81 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 0.72 0.00 0.00 0.85 0.00 0.00 114 L 7.64 3.58 0.00 1.28 1.43 0.62 0.82 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 0.00 115 A 7.04 2.86 1.18 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 0.00 116 H 7.76 3.93 0.00 3.09 3.51 0.00 5.94 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.65 4.12 0.00 2.43 2.14 0.00 5.71 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.09 5.02 0.00 3.26 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 0.00 119 G 9.20 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 0.00 0.00 0.00 120 K 9.38 3.93 0.00 1.82 1.96 0.00 1.80 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.42 7.81 121 E 8.43 4.22 0.00 2.00 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 2.33 2.26 0.00 122 F 7.97 4.68 0.00 3.15 3.26 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 0.00 123 T 7.37 4.27 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 1.22 0.00 0.00 124 P 0.00 4.14 0.00 2.15 2.13 0.00 3.57 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 125 P 0.00 4.35 0.00 2.31 2.29 0.00 3.31 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 126 V 7.34 3.55 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 0.92 0.00 0.00 0.96 0.00 0.00 127 Q 8.05 3.64 0.00 1.42 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 128 A 8.44 3.98 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.12 3.85 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 0.00 130 Y 8.64 3.85 0.00 3.21 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.66 4.08 0.00 2.30 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 132 K 7.87 4.02 0.00 1.97 1.81 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.59 7.81 133 V 7.71 3.47 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 0.63 0.00 0.00 0.75 0.00 0.00 134 V 8.19 3.82 2.26 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 1.04 0.00 0.00 1.13 0.00 0.00 135 A 8.10 4.13 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 0.00 136 G 8.09 3.49 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 0.00 137 V 8.28 3.23 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 0.64 0.00 0.00 0.65 0.00 0.00 138 A 8.07 3.85 1.47 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 0.00 139 N 7.94 4.30 0.00 2.85 2.97 0.00 0.00 7.22 8.11 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 0.00 140 A 7.92 4.10 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 0.00 141 L 7.93 3.63 0.00 0.89 0.34 0.16 0.38 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 0.00 142 A 7.65 4.61 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 0.00 0.00 0.00 0.00 0.00 0.00 143 H 7.71 3.98 0.00 3.46 3.37 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.61 3.94 0.00 1.53 1.70 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.57 7.81 145 Y 8.02 4.56 0.00 3.13 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 0.00 146 H 7.95 4.60 0.00 3.24 3.22 0.00 5.70 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00