NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 3.9505 8.3393 109.7305 45.3534 0.0000 175.7991 0 S 4.5518 8.4960 116.0732 57.4226 65.7888 174.2059 1 A 4.1307 9.0032 125.1760 55.0664 19.2013 179.7622 2 F 4.4505 8.4043 113.1047 59.3495 39.5220 175.9077 3 N 4.5269 8.1251 118.8454 53.4553 38.9145 174.8625 4 G 3.7174 7.6600 108.5233 43.7192 0.0000 171.4223 5 K 5.0935 8.0038 118.8533 54.4353 34.5600 175.9024 6 W 5.3529 9.5234 124.2086 54.8616 33.5330 173.9973 7 E 5.1492 9.3294 123.0319 54.3684 32.7069 174.8941 8 T 4.3550 8.4810 123.0261 64.0606 68.5007 173.0168 9 E 4.5560 9.6297 126.3359 57.0152 32.1386 176.1925 10 S 4.8849 7.8769 113.4429 56.8440 67.3807 173.2106 11 Q 5.0006 8.4456 123.0378 55.0976 31.9606 173.3767 12 E 4.5961 9.2771 125.7230 55.4756 33.7670 176.8232 13 G 4.1938 8.9940 110.1542 47.3995 0.0000 174.4179 14 Y 4.1775 8.2224 121.4582 60.7321 38.6382 178.2038 15 E 3.7585 8.2359 118.6215 59.0733 29.7996 177.4360 16 P 4.2071 0.0000 0.0000 65.3530 31.3784 178.5324 17 F 4.0100 8.2782 119.5035 61.5620 39.2967 177.0656 18 C 3.9170 8.0696 116.3316 62.6154 27.4176 176.2736 19 K 3.8503 8.0726 120.2584 59.2450 31.3640 179.2069 20 L 3.8888 7.4587 119.9898 57.7337 42.1539 178.2055 21 I 3.9690 7.0006 109.8456 60.9203 37.7673 176.2319 22 G 3.7940 7.3208 108.1214 45.9381 0.0000 173.6671 23 I 3.8461 7.5833 120.9805 59.7117 37.7739 175.2159 24 P 4.3223 0.0000 0.0000 62.7917 33.1250 177.0616 25 D 4.3055 8.5683 119.8958 57.7140 41.2042 178.5311 26 D 4.3714 8.0203 118.9824 57.1618 40.7750 178.7410 27 V 3.5953 7.7224 118.5086 65.8427 31.3799 177.9492 28 I 3.8137 7.8101 119.7718 63.8183 36.8073 177.8799 29 A 4.2397 8.1877 121.5398 55.3451 18.0343 179.9195 30 K 4.2427 8.4257 115.9849 58.5349 32.2485 178.8391 31 G 4.1369 7.8557 104.3429 44.4087 0.0000 175.5886 32 R 3.5181 7.7661 117.4130 58.0900 29.6538 177.1980 33 D 4.7619 7.8444 115.4936 53.5682 41.7496 175.9875 34 F 4.1585 7.9154 122.7917 58.0441 39.8142 174.5611 35 K 4.2977 7.4099 127.0446 54.3354 33.1687 175.7547 36 L 4.1264 8.3389 128.5928 54.9584 43.4714 175.5563 37 V 4.7794 8.4548 126.1234 62.0568 33.6283 174.2710 38 T 5.2211 9.2919 124.5991 61.7666 71.6349 172.4690 39 E 5.2299 9.5687 127.5623 54.4869 32.3899 174.4951 40 I 4.8964 8.9661 127.5321 59.3705 41.0048 174.5107 41 V 4.5533 8.7696 126.6139 61.1813 33.7706 173.8811 42 Q 4.3061 8.6536 129.5373 54.4076 30.9707 174.9310 43 N 4.7404 8.9662 125.6742 51.8228 39.9311 176.5045 44 G 3.7713 7.9647 116.0124 46.9400 0.0000 173.8454 45 D 4.5812 8.7573 126.7038 55.0688 41.2695 174.4901 46 D 5.0488 8.0259 120.9472 53.1696 42.3210 174.9468 47 F 5.1058 8.9769 125.5018 55.8208 42.3474 174.8364 48 T 4.9440 8.9550 119.2681 61.5530 71.4987 172.8210 49 W 5.0390 9.6195 135.0000 56.0080 33.5980 173.9703 50 T 5.2123 9.1946 124.8207 61.8381 71.1187 173.3435 51 Q 4.9811 9.3103 125.0107 54.5198 32.2261 174.6059 52 Y 4.6682 8.7445 122.5989 56.9422 37.2570 175.2066 53 Y 4.5103 9.0155 122.4550 56.1504 39.5540 173.4739 54 P 4.1307 0.0000 0.0000 63.6827 31.8239 175.9669 55 N 4.3337 9.2276 114.0125 54.8065 35.7999 174.2247 56 N 4.2458 8.4597 110.3513 54.6560 36.2653 174.3696 57 H 4.7087 8.0760 119.8298 55.6489 30.3904 173.5936 58 V 4.5881 8.3471 126.1835 61.1880 33.1201 174.7816 59 V 4.4185 8.8066 128.5539 61.5134 33.5629 174.2186 60 T 5.2653 8.6596 124.2732 61.8532 71.2778 173.0669 61 N 5.1464 9.5737 124.0132 51.3596 41.7555 173.5243 62 K 5.1897 8.8491 123.1493 54.5862 34.2731 175.5112 63 F 5.0790 8.5780 119.3168 55.3488 42.2033 173.3057 64 I 5.0389 8.4471 121.0423 59.2236 39.5463 175.6425 65 V 3.9816 8.8058 127.9257 64.7326 31.6907 176.4350 66 G 4.0345 9.3342 115.5947 45.1281 0.0000 173.1313 67 K 4.7058 7.6959 118.3754 53.9277 35.2091 176.0968 68 E 4.1758 8.9546 123.2593 57.4469 29.9908 176.7028 69 S 4.7369 9.0952 120.0990 56.4576 67.3478 173.2163 70 D 4.7166 8.7212 124.0674 54.8048 41.2612 175.4248 71 M 4.8525 8.7359 122.3816 53.4695 36.9680 173.5666 72 E 5.2916 9.5923 120.1535 54.8527 33.2071 175.3004 73 T 4.5923 9.1394 115.9790 60.6404 70.2034 175.8411 74 V 3.4953 8.4288 121.9451 66.0650 31.3818 177.1731 75 G 3.6523 7.9187 105.7289 46.1966 0.0000 173.9820 76 G 4.0190 8.1733 108.3420 44.6744 0.0000 173.2513 77 K 4.3670 8.4842 122.6716 55.5143 33.3965 175.9135 78 K 4.9861 8.7401 127.3408 55.9859 33.3849 175.9010 79 F 5.0532 8.9662 118.5121 55.5142 42.2187 172.6649 80 K 4.8727 8.8180 120.0249 54.6328 34.0714 175.1152 81 G 4.3327 9.0606 113.2822 44.7550 0.0000 171.3639 82 I 4.6997 8.1305 120.7616 59.1734 39.2758 175.6620 83 V 3.9407 8.1755 128.0455 62.2958 32.8395 174.9397 84 S 5.1329 8.5037 121.1802 56.7575 66.4267 172.3948 85 M 5.3275 8.3824 119.2471 54.0225 35.5382 174.1628 86 E 4.5308 9.1842 125.6873 55.8257 32.8253 175.2328 87 G 4.1365 9.9631 115.2954 46.6678 0.0000 174.2621 88 G 4.0676 8.6752 106.6320 44.7359 0.0000 173.8931 89 K 4.8882 7.9432 120.2693 54.8253 34.0873 175.8229 90 L 4.7574 9.0958 125.8666 54.4594 43.5713 175.9434 91 T 4.8762 8.8015 119.4983 61.8249 71.6868 172.8913 92 I 4.1342 8.6100 127.9596 59.5804 39.6724 175.3765 93 S 4.7608 8.1519 124.0183 56.3779 62.1860 174.2435 94 F 3.7118 8.2535 123.6961 55.6642 39.7258 175.1499 95 P 4.0604 0.0000 0.0000 65.4888 30.9880 177.8818 96 K 4.3627 7.4002 113.7027 56.6747 33.0671 175.1588 97 Y 4.8841 6.8982 115.0394 56.5128 41.5621 172.9577 98 Q 4.6727 8.9684 119.6009 54.6919 31.0623 174.6239 99 Q 5.2091 9.2048 125.2610 54.4741 31.9932 174.0678 100 T 5.2007 9.1408 116.8368 60.2784 71.9405 173.1602 101 T 5.3769 8.9564 120.8892 62.0884 73.1279 172.7133 102 E 5.2226 9.2502 122.2510 55.4715 33.9393 173.7095 103 I 4.5100 7.7950 121.0402 59.8696 38.5207 175.5958 104 S 4.4436 8.7673 122.0942 57.2940 64.7959 173.9697 105 G 4.0247 9.7731 116.3602 46.7599 0.0000 174.3595 106 G 4.0148 8.5660 105.8630 45.0217 0.0000 174.0764 107 K 4.9864 7.7736 119.0192 54.2918 35.7082 175.2007 108 L 4.1914 8.4014 125.5648 54.3448 43.2173 175.5345 109 V 4.8010 8.8397 127.6800 61.2090 34.0053 173.9600 110 E 5.2008 9.4383 128.2031 54.9079 32.5124 175.0789 111 T 4.9895 9.2318 121.9586 61.8361 71.4764 173.2600 112 S 5.2263 9.0134 123.2756 56.9825 65.4682 173.2979 113 T 5.0937 9.4176 121.6092 61.8417 71.1225 173.0735 114 A 5.2417 9.4425 128.3219 50.1421 22.8569 174.6025 115 S 4.8342 8.5191 113.0178 56.9944 65.4041 173.8278 116 G 3.8919 8.7589 114.7985 45.0321 0.0000 172.7630 117 A 4.0014 8.8462 122.3725 55.4428 18.4536 179.5611 118 Q 4.0850 7.8637 111.3804 57.1163 29.7799 175.2459 119 G 3.8308 6.9682 105.3924 44.4694 0.0000 172.5281 120 T 4.9651 8.3601 111.9795 60.8981 70.6210 174.5889 121 A 4.8446 9.0340 125.1275 50.1980 22.6094 175.0127 122 V 4.8183 8.4424 121.0011 60.9823 35.0156 173.6359 123 L 4.7295 8.4862 130.5605 53.4099 43.9429 174.9189 124 V 4.7671 8.7593 126.7602 61.2507 34.0443 174.1548 125 R 5.0635 9.1371 127.5853 54.6816 33.0852 175.1118 126 T 5.1040 9.0584 120.3661 61.8835 71.5159 173.2276 127 S 5.3925 9.3054 122.7930 56.5623 66.4959 173.4337 128 K 4.9076 8.7089 122.4072 54.9597 35.2989 175.5223 129 K 3.8995 8.5510 123.3815 56.6308 32.3147 176.9278 130 V 4.1381 8.4473 119.2032 60.8511 32.8565 175.6867 131 L 4.4588 7.4573 119.6279 53.0279 42.5988 176.7714 132 V 3.8338 8.0632 115.8843 61.2098 31.7839 176.3002 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 8.34 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 0 S 8.50 4.55 0.00 4.06 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 1 A 9.00 4.13 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 2 F 8.40 4.45 0.00 3.23 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 3 N 8.13 4.53 0.00 2.90 2.80 0.00 0.00 7.01 7.68 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 4 G 7.66 3.72 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 0.00 0.00 0.00 5 K 8.00 5.09 0.00 1.56 1.63 0.00 1.52 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.39 7.81 6 W 9.52 5.35 0.00 3.15 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 E 9.33 5.15 0.00 1.94 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 0.00 2.12 2.17 0.00 8 T 8.48 4.35 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 1.29 0.00 0.00 9 E 9.63 4.56 0.00 1.91 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 0.00 2.21 2.25 0.00 10 S 7.88 4.88 0.00 3.77 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 11 Q 8.45 5.00 0.00 1.98 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.70 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 12 E 9.28 4.60 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 2.22 2.24 0.00 13 G 8.99 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 14 Y 8.22 4.18 0.00 3.07 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 15 E 8.24 3.76 0.00 2.10 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 2.52 2.65 0.00 16 P 0.00 4.21 0.00 2.19 2.11 0.00 3.73 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 2.14 2.16 0.00 17 F 8.28 4.01 0.00 3.13 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 18 C 8.07 3.92 0.00 2.71 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 19 K 8.07 3.85 0.00 1.91 1.78 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.50 7.81 20 L 7.46 3.89 0.00 1.63 1.58 0.86 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.00 3.97 1.65 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.49 0.26 0.00 0.00 22 G 7.32 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 23 I 7.58 3.85 1.80 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 1.30 0.73 0.85 0.00 0.00 24 P 0.00 4.32 0.00 2.12 1.96 0.00 3.55 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 2.08 2.12 0.00 25 D 8.57 4.31 0.00 2.69 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.02 4.37 0.00 2.80 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 27 V 7.72 3.60 2.21 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 1.07 0.00 0.00 0.91 0.00 0.00 28 I 7.81 3.81 2.03 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.37 0.83 0.00 0.00 29 A 8.19 4.24 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.43 4.24 0.00 1.85 1.91 0.00 1.87 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.52 7.81 31 G 7.86 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 0.00 0.00 0.00 0.00 32 R 7.77 3.52 0.00 2.00 2.44 0.00 3.07 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.62 0.00 33 D 7.84 4.76 0.00 2.69 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 34 F 7.92 4.16 0.00 2.90 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 35 K 7.41 4.30 0.00 1.38 1.59 0.00 1.82 0.00 0.00 1.56 0.00 0.00 2.73 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.25 1.26 7.81 36 L 8.34 4.13 0.00 1.85 1.55 0.40 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 37 V 8.45 4.78 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 0.99 0.00 0.00 0.84 0.00 0.00 38 T 9.29 5.22 4.37 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 1.06 0.00 0.00 39 E 9.57 5.23 0.00 2.21 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 2.26 2.31 0.00 40 I 8.97 4.90 2.07 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.33 0.87 0.00 0.00 41 V 8.77 4.55 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 0.98 0.00 0.00 0.93 0.00 0.00 42 Q 8.65 4.31 0.00 1.67 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.86 0.00 0.00 0.00 0.00 0.00 1.79 1.16 0.00 43 N 8.97 4.74 0.00 2.59 2.64 0.00 0.00 6.45 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 44 G 7.96 3.77 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 0.00 0.00 0.00 45 D 8.76 4.58 0.00 2.81 2.82 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 46 D 8.03 5.05 0.00 2.70 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.98 5.11 0.00 1.51 2.49 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 48 T 8.96 4.94 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 49 W 9.62 5.04 0.00 3.62 3.08 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 50 T 9.19 5.21 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 0.80 0.00 0.00 51 Q 9.31 4.98 0.00 2.09 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.82 0.00 0.00 0.00 0.00 0.00 2.49 2.66 0.00 52 Y 8.74 4.67 0.00 2.92 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 53 Y 9.02 4.51 0.00 3.08 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 54 P 0.00 4.13 0.00 1.96 1.59 0.00 3.72 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.44 0.00 55 N 9.23 4.33 0.00 2.88 2.92 0.00 0.00 6.97 8.00 0.00 0.00 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 N 8.46 4.25 0.00 2.95 3.00 0.00 0.00 7.08 8.16 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 57 H 8.08 4.71 0.00 3.26 3.44 0.00 5.76 0.00 0.00 0.00 0.00 6.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 8.35 4.59 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 0.54 0.00 0.00 1.00 0.00 0.00 59 V 8.81 4.42 2.32 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 0.99 0.00 0.00 0.83 0.00 0.00 60 T 8.66 5.27 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 1.28 0.00 0.00 61 N 9.57 5.15 0.00 2.84 2.95 0.00 0.00 6.43 7.41 0.00 0.00 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 K 8.85 5.19 0.00 1.63 1.72 0.00 1.74 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.44 7.81 63 F 8.58 5.08 0.00 2.97 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 64 I 8.45 5.04 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.06 0.97 0.00 0.00 65 V 8.81 3.98 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 0.87 0.00 0.00 1.26 0.00 0.00 66 G 9.33 4.03 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 0.00 0.00 0.00 67 K 7.70 4.71 0.00 1.78 1.70 0.00 1.64 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.43 7.81 68 E 8.95 4.18 0.00 1.84 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 2.31 2.35 0.00 69 S 9.10 4.74 0.00 3.69 3.88 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 70 D 8.72 4.72 0.00 2.51 2.54 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 71 M 8.74 4.85 0.00 1.31 0.57 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 72 E 9.59 5.29 0.00 1.88 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 2.31 2.30 0.00 73 T 9.14 4.59 4.29 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 1.40 0.00 0.00 74 V 8.43 3.50 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 0.13 0.00 0.00 0.92 0.00 0.00 75 G 7.92 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.17 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 0.00 0.00 0.00 0.00 77 K 8.48 4.37 0.00 1.88 1.77 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.46 7.81 78 K 8.74 4.99 0.00 1.72 1.72 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.47 7.81 79 F 8.97 5.05 0.00 2.98 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 80 K 8.82 4.87 0.00 1.73 1.71 0.00 1.71 0.00 0.00 1.89 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.28 1.39 7.81 81 G 9.06 4.33 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 0.00 82 I 8.13 4.70 1.82 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 1.28 0.69 0.88 0.00 0.00 83 V 8.18 3.94 1.84 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 0.58 0.00 0.00 0.02 0.00 0.00 84 S 8.50 5.13 0.00 3.90 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 85 M 8.38 5.33 0.00 2.06 1.96 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.61 0.00 86 E 9.18 4.53 0.00 1.96 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 2.22 2.41 0.00 87 G 9.96 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 0.00 0.00 0.00 0.00 88 G 8.68 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 89 K 7.94 4.89 0.00 1.90 1.78 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.45 7.81 90 L 9.10 4.76 0.00 1.35 1.24 0.11 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.80 4.88 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 1.13 0.00 0.00 92 I 8.61 4.13 1.45 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.33 -0.20 0.00 0.00 93 S 8.15 4.76 0.00 3.58 3.75 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 94 F 8.25 3.71 0.00 2.20 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 0.00 0.00 0.00 95 P 0.00 4.06 0.00 1.86 1.97 0.00 3.29 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 96 K 7.40 4.36 0.00 1.84 1.95 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.37 7.81 97 Y 6.90 4.88 0.00 3.52 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 98 Q 8.97 4.67 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 99 Q 9.20 5.21 0.00 2.55 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 100 T 9.14 5.20 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 1.21 0.00 0.00 101 T 8.96 5.38 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 1.71 0.00 0.00 102 E 9.25 5.22 0.00 2.06 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 2.23 2.29 0.00 103 I 7.79 4.51 1.55 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.20 0.46 0.88 0.00 0.00 104 S 8.77 4.44 0.00 3.75 3.64 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 0.00 105 G 9.77 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 0.00 0.00 0.00 0.00 106 G 8.57 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 0.00 107 K 7.77 4.99 0.00 1.77 1.91 0.00 1.87 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.61 1.53 7.81 108 L 8.40 4.19 0.00 0.27 1.05 0.90 0.45 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 0.00 109 V 8.84 4.80 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 0.92 0.00 0.00 0.91 0.00 0.00 110 E 9.44 5.20 0.00 1.91 1.85 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 2.38 2.34 0.00 111 T 9.23 4.99 4.24 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 1.19 0.00 0.00 112 S 9.01 5.23 0.00 2.72 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 0.00 113 T 9.42 5.09 4.33 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 1.27 0.00 0.00 114 A 9.44 5.24 1.17 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 0.00 115 S 8.52 4.83 0.00 3.84 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 0.00 116 G 8.76 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 0.00 0.00 0.00 117 A 8.85 4.00 1.27 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 0.00 0.00 0.00 118 Q 7.86 4.09 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.42 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 119 G 6.97 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 0.00 120 T 8.36 4.97 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 1.23 0.00 0.00 121 A 9.03 4.84 1.27 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 0.00 0.00 0.00 122 V 8.44 4.82 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 0.95 0.00 0.00 0.97 0.00 0.00 123 L 8.49 4.73 0.00 1.29 0.47 1.02 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 124 V 8.76 4.77 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 1.00 0.00 0.00 0.91 0.00 0.00 125 R 9.14 5.06 0.00 1.74 1.81 0.00 3.26 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.54 0.00 126 T 9.06 5.10 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 1.23 0.00 0.00 127 S 9.31 5.39 0.00 3.80 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 0.00 128 K 8.71 4.91 0.00 1.88 2.13 0.00 1.31 0.00 0.00 1.78 0.00 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.51 1.37 7.81 129 K 8.55 3.90 0.00 0.99 1.44 0.00 1.43 0.00 0.00 1.45 0.00 0.00 2.22 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.13 0.64 7.81 130 V 8.45 4.14 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 0.72 0.00 0.00 0.90 0.00 0.00 131 L 7.46 4.46 0.00 1.40 1.45 0.83 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 132 V 8.06 3.83 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 0.55 0.00 0.00 0.86 0.00 0.00