NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2979 8.3293 119.6935 55.7149 30.0328 175.5249 2 D 4.3644 8.3127 122.5662 53.2750 38.3302 174.4647 3 N 3.9827 8.6494 129.9720 60.9359 36.9229 180.9248 4 S 3.5277 7.4769 112.8816 60.8732 64.3709 175.7528 5 R 4.0332 7.8075 121.1435 59.5696 29.7530 178.2834 6 Y 4.5878 8.6621 120.7302 59.9278 38.8667 177.6298 7 T 3.8068 7.8560 116.4521 66.5061 68.6948 176.1071 8 H 4.1886 8.9783 120.7778 59.0621 29.7925 177.0865 9 F 4.0393 7.8380 121.2787 61.4234 39.4088 177.1503 10 L 3.9104 7.8258 118.5340 58.0624 41.0950 179.7415 11 T 3.9294 7.6760 115.0707 66.4331 68.4645 176.3121 12 Q 4.0806 7.6111 118.3572 57.4198 29.1354 176.2443 13 H 4.7053 7.9205 115.0299 53.7415 31.6018 172.1196 14 Y 5.2402 8.1990 119.1403 56.0187 41.5523 174.4238 15 D 4.1314 8.7135 125.3090 52.4327 43.6953 175.4786 16 A 4.0439 7.9896 128.3514 53.8209 18.5091 177.4736 17 K 4.7321 7.3821 120.7479 53.1410 32.5486 174.1161 18 P 4.1776 0.0000 0.0000 64.5523 31.4099 177.2807 19 Q 3.1640 8.7106 114.6296 55.2255 25.8123 172.7232 20 G 3.9922 6.9623 102.7603 44.2933 0.0000 173.3836 21 R 4.3092 8.0963 123.0741 55.4939 31.6400 173.9651 22 D 5.2030 7.9440 118.0062 51.1566 42.7474 175.5994 23 D 4.4456 8.8015 117.4503 57.9398 40.7306 178.8876 24 R 3.9211 7.9941 118.5858 59.5022 30.1785 177.7773 25 Y 4.0711 8.7837 119.7398 60.8151 38.7285 177.1752 26 C 3.8214 8.2147 117.3568 60.1791 38.6404 175.7618 27 E 4.0337 8.2816 119.9066 59.7453 29.0549 179.7465 28 S 4.0940 7.8289 112.3222 61.4455 62.5712 176.1029 29 I 3.4435 7.6970 121.6191 63.9379 37.5190 177.6974 30 M 3.9932 7.9814 119.9797 58.2952 31.7474 178.9622 31 R 3.9161 7.5298 116.8911 59.4780 30.1075 179.3458 32 R 3.9443 7.6820 116.3088 58.9909 30.1011 178.5602 33 R 4.3054 7.9045 115.7331 55.7560 30.4757 176.7879 34 G 3.8586 7.9064 106.6969 46.8357 0.0000 173.9303 35 L 4.6207 7.9607 117.1608 54.5778 41.8928 177.8668 36 T 4.5261 7.9308 111.2687 61.9252 68.0836 174.2995 37 S 4.4877 7.6806 114.0308 56.6375 62.9769 171.0844 38 P 4.7852 0.0000 0.0000 61.2070 33.1802 176.4523 39 C 4.2740 7.9432 118.0646 57.6625 40.5322 174.0559 40 K 4.1957 8.7597 126.4476 56.1044 32.0422 176.1859 41 D 4.6189 9.0064 127.6229 57.2035 42.3693 175.8112 42 I 5.1643 7.5215 116.4931 59.5997 41.3178 173.7865 43 N 4.8144 9.1934 127.1307 52.4260 42.8897 172.7584 44 T 4.7172 8.2248 122.0750 61.7284 71.4040 173.0304 45 F 4.8904 9.0873 125.0629 55.7815 41.8990 174.5581 46 I 4.7759 8.6723 124.4450 60.2149 39.0565 174.8240 47 H 5.9292 8.3930 123.7182 54.0316 31.4990 173.4092 48 G 4.0160 8.5314 104.2869 44.3871 0.0000 172.8674 49 N 5.0603 8.6578 116.6159 51.8154 39.1809 175.9388 50 K 3.8862 8.8012 119.9393 59.7816 32.1445 179.5437 51 R 3.9521 8.2310 117.8180 59.8259 29.6932 178.9034 52 S 4.2575 7.9684 113.8276 61.6377 63.1439 176.6833 53 I 3.8957 8.0940 122.4719 64.3152 36.8596 178.1498 54 K 3.7631 8.2973 118.6341 59.8727 31.9109 178.6308 55 A 3.8582 8.1785 120.5550 55.7283 18.1748 179.4899 56 I 3.7623 7.8529 117.9094 64.5300 37.0256 176.5746 57 C 4.8735 8.6710 116.9743 56.5660 38.7821 172.8227 58 E 4.4332 7.7577 120.8827 56.1932 31.7963 175.1950 59 N 5.9791 8.5920 116.4796 52.5720 39.5436 175.5828 60 K 4.2980 8.2014 119.6835 58.1558 32.9445 177.0280 61 N 4.9857 8.0292 112.8575 52.6750 41.5469 173.9321 62 G 4.7910 7.5407 104.8208 44.9421 0.0000 172.3782 63 N 4.8517 8.2924 115.7200 51.7539 42.5490 172.2059 64 P 4.3998 0.0000 0.0000 64.2927 31.5584 173.8879 65 H 5.1467 8.5454 117.6431 56.6509 38.5500 174.8661 66 R 4.6469 7.9834 115.2470 56.7048 30.1206 177.6525 67 E 4.2127 9.2117 126.4128 56.7026 29.1964 177.5110 68 N 4.1493 7.9641 110.9847 54.7190 36.0352 173.9364 69 L 4.8607 7.2932 116.4310 54.0404 43.0001 175.8548 70 R 4.9178 9.4416 124.2574 54.3283 33.4357 175.1355 71 I 4.7639 8.5119 124.9161 59.0787 39.1420 174.9111 72 S 4.5705 8.8487 125.3917 59.3183 62.9118 175.1731 73 K 4.2644 10.5964 121.7101 59.6070 32.2254 178.0198 74 S 4.5136 9.0613 113.5382 57.7250 64.5290 173.6377 75 S 4.7524 8.0598 115.8817 57.1978 64.6353 173.7457 76 F 4.9804 9.3524 120.9356 55.7085 43.3799 174.2775 77 Q 5.0105 8.9886 120.3981 55.8984 29.8224 175.5278 78 V 5.0065 9.2462 117.0328 59.9282 36.8823 174.8698 79 T 5.0102 8.7141 117.7263 62.5617 72.5647 173.1421 80 T 4.8553 9.1418 124.0185 62.0867 71.0752 172.8988 81 C 5.2724 9.5116 124.6249 55.2183 41.3335 172.5737 82 K 5.1970 9.0500 125.8812 54.0322 34.5840 174.9502 83 L 4.0001 9.2344 130.5759 55.8300 42.6032 176.1458 84 H 4.6729 8.9365 126.5276 54.4236 31.0673 172.0989 85 G 3.9064 7.8639 112.3262 44.9849 0.0000 171.1290 86 G 3.7177 8.7464 107.5804 46.7971 0.0000 173.8075 87 S 4.7916 7.6722 112.2022 55.4767 65.1633 171.9412 88 P 4.3359 0.0000 0.0000 63.0607 31.6861 175.8311 89 W 5.0202 7.4827 119.3154 54.7931 30.3872 174.4611 90 P 4.6141 0.0000 0.0000 61.5802 31.4949 174.6989 91 P 4.3978 0.0000 0.0000 63.0777 31.8309 176.4160 92 C 4.5028 8.6290 118.5458 55.6670 38.6511 172.5912 93 Q 4.6457 8.1689 125.9031 54.5807 30.6505 173.5457 94 Y 5.3114 9.3611 124.1376 56.3088 41.2728 175.1052 95 R 4.8468 9.1957 122.5488 54.6970 32.3584 175.1413 96 A 5.0998 9.6465 126.3854 51.0690 20.8372 176.7297 97 T 4.5803 9.0440 118.0302 61.7279 71.6830 173.1936 98 A 4.9217 8.7835 128.7110 51.5036 20.2335 176.1160 99 G 4.2090 9.0169 107.0148 45.5601 0.0000 172.0402 100 F 5.5206 8.8425 121.7056 56.3821 40.7863 173.2450 101 R 4.6995 8.8012 125.4576 54.3140 34.4021 173.1172 102 N 5.1362 8.6337 118.7941 52.5723 38.6767 174.8499 103 V 4.6101 8.4733 113.1370 59.8066 35.4029 174.7759 104 V 4.8301 8.2507 121.9293 61.4457 33.8739 174.8019 105 V 5.0282 9.0062 120.2113 59.5744 36.5076 174.0242 106 A 5.1337 8.8717 123.8325 50.6811 21.0832 175.2353 107 C 5.2779 8.8558 120.0782 55.3253 40.2595 174.0211 108 E 4.4139 8.8532 122.2859 56.2218 32.2262 175.2312 109 N 4.0212 9.3067 121.5703 54.3385 35.5442 175.0266 110 G 3.8978 8.4140 103.1575 46.1161 0.0000 174.0579 111 L 4.5903 7.2289 118.4743 51.4077 44.9637 174.3978 112 P 4.5562 0.0000 0.0000 62.9165 31.8070 176.8074 113 V 4.5711 8.1975 113.1222 61.0085 33.8873 175.1511 114 H 5.0602 7.8623 120.3996 54.6052 33.4902 171.2872 115 L 4.8578 8.3563 127.3077 53.1488 43.7774 175.1829 116 D 4.5323 8.6672 126.8614 54.1707 40.8009 176.1126 117 Q 4.4180 8.8505 126.4192 57.9631 29.6039 178.9828 118 S 4.1433 8.3174 113.6901 61.2739 62.8727 176.7953 119 I 3.5159 7.5642 112.8303 62.5055 37.1176 176.3017 120 F 4.6043 7.5078 117.7257 57.5003 38.7625 176.5612 121 R 3.7967 7.4054 121.2030 57.2730 30.2003 175.4306 122 R 4.6037 7.6494 118.1881 53.8783 32.4428 174.6677 123 P 4.4631 0.0000 0.0000 62.8977 31.3827 176.1710 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 Q 8.33 4.30 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.26 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 2 D 8.31 4.36 0.00 2.98 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 3 N 8.65 3.98 0.00 3.14 2.97 0.00 0.00 7.17 7.57 0.00 0.00 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 S 7.48 3.53 0.00 3.99 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 0.00 5 R 7.81 4.03 0.00 1.92 2.06 0.00 3.13 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.73 0.00 6 Y 8.66 4.59 0.00 2.97 3.25 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 7 T 7.86 3.81 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 8 H 8.98 4.19 0.00 3.33 3.57 0.00 5.79 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 F 7.84 4.04 0.00 3.22 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 10 L 7.83 3.91 0.00 1.78 1.67 0.70 0.20 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 11 T 7.68 3.93 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 1.20 0.00 0.00 12 Q 7.61 4.08 0.00 1.54 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.23 0.00 0.00 0.00 0.00 0.00 2.13 2.25 0.00 13 H 7.92 4.71 0.00 2.13 2.71 0.00 5.76 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.20 5.24 0.00 2.83 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 15 D 8.71 4.13 0.00 2.60 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 16 A 7.99 4.04 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 17 K 7.38 4.73 0.00 1.66 1.68 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.29 7.81 18 P 0.00 4.18 0.00 1.66 1.38 0.00 3.39 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.37 0.00 19 Q 8.71 3.16 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.52 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 20 G 6.96 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 21 R 8.10 4.31 0.00 1.64 1.77 0.00 3.03 0.00 0.00 2.90 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.38 0.00 22 D 7.94 5.20 0.00 2.89 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 23 D 8.80 4.45 0.00 2.83 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 24 R 7.99 3.92 0.00 1.87 2.24 0.00 3.37 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 25 Y 8.78 4.07 0.00 3.02 3.28 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 26 C 8.21 3.82 0.00 3.28 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 27 E 8.28 4.03 0.00 2.26 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 0.00 2.40 2.66 0.00 28 S 7.83 4.09 0.00 4.04 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 29 I 7.70 3.44 0.86 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.05 0.50 -0.10 0.00 0.00 30 M 7.98 3.99 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.36 0.00 31 R 7.53 3.92 0.00 2.08 1.97 0.00 3.16 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 32 R 7.68 3.94 0.00 1.70 1.95 0.00 3.27 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 33 R 7.90 4.31 0.00 1.86 1.98 0.00 3.64 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.01 0.00 34 G 7.91 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 0.00 0.00 0.00 35 L 7.96 4.62 0.00 1.66 1.60 0.77 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.93 4.53 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 1.27 0.00 0.00 37 S 7.68 4.49 0.00 3.86 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 38 P 0.00 4.79 0.00 2.03 2.06 0.00 3.86 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.95 0.00 39 C 7.94 4.27 0.00 3.04 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 40 K 8.76 4.20 0.00 1.89 1.78 0.00 1.74 0.00 0.00 1.49 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.56 1.37 7.81 41 D 9.01 4.62 0.00 2.85 2.67 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 0.00 0.00 0.00 42 I 7.52 5.16 1.92 0.00 0.00 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 1.25 0.96 0.94 0.00 0.00 43 N 9.19 4.81 0.00 2.59 2.19 0.00 0.00 6.77 6.75 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 44 T 8.22 4.72 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 0.26 0.00 0.00 45 F 9.09 4.89 0.00 2.92 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 46 I 8.67 4.78 1.95 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 1.10 0.67 0.86 0.00 0.00 47 H 8.39 5.93 0.00 3.07 3.31 0.00 5.59 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.53 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 49 N 8.66 5.06 0.00 2.95 2.93 0.00 0.00 5.90 7.13 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 50 K 8.80 3.89 0.00 1.82 1.79 0.00 1.55 0.00 0.00 1.44 0.00 0.00 3.01 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.10 1.56 7.81 51 R 8.23 3.95 0.00 1.95 2.05 0.00 3.24 0.00 0.00 3.39 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.84 0.00 52 S 7.97 4.26 0.00 4.38 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 0.00 53 I 8.09 3.90 2.03 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 1.32 0.85 0.96 0.00 0.00 54 K 8.30 3.76 0.00 1.99 1.83 0.00 1.62 0.00 0.00 1.78 0.00 0.00 2.74 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.72 7.81 55 A 8.18 3.86 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 56 I 7.85 3.76 1.90 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.00 0.94 0.00 0.00 57 C 8.67 4.87 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 58 E 7.76 4.43 0.00 2.00 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 2.19 2.40 0.00 59 N 8.59 5.98 0.00 2.69 2.76 0.00 0.00 7.25 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 60 K 8.20 4.30 0.00 1.75 1.86 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.41 7.81 61 N 8.03 4.99 0.00 2.83 2.78 0.00 0.00 6.95 8.28 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 62 G 7.54 4.79 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 63 N 8.29 4.85 0.00 2.81 2.62 0.00 0.00 7.34 7.59 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 64 P 0.00 4.40 0.00 2.11 2.09 0.00 3.85 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 65 H 8.55 5.15 0.00 3.10 3.31 0.00 5.71 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 R 7.98 4.65 0.00 1.67 1.29 0.00 3.19 0.00 0.00 3.18 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.50 0.00 67 E 9.21 4.21 0.00 2.09 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 0.00 2.34 2.24 0.00 68 N 7.96 4.15 0.00 2.94 3.12 0.00 0.00 6.95 6.74 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 69 L 7.29 4.86 0.00 1.59 1.60 0.97 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 70 R 9.44 4.92 0.00 1.70 1.82 0.00 3.08 0.00 0.00 3.31 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 71 I 8.51 4.76 1.89 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.69 0.93 0.00 0.00 72 S 8.85 4.57 0.00 4.24 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 73 K 10.60 4.26 0.00 1.89 1.91 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.16 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.47 1.40 7.81 74 S 9.06 4.51 0.00 3.63 3.82 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 75 S 8.06 4.75 0.00 3.01 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.35 4.98 0.00 3.05 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 77 Q 8.99 5.01 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.70 2.42 0.00 78 V 9.25 5.01 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 0.84 0.00 0.00 1.06 0.00 0.00 79 T 8.71 5.01 4.58 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 1.40 0.00 0.00 80 T 9.14 4.86 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 1.24 0.00 0.00 81 C 9.51 5.27 0.00 2.61 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 82 K 9.05 5.20 0.00 1.91 1.72 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.45 7.81 83 L 9.23 4.00 0.00 1.88 1.50 0.82 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 84 H 8.94 4.67 0.00 3.08 3.12 0.00 5.84 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 7.86 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 0.00 0.00 0.00 86 G 8.75 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 87 S 7.67 4.79 0.00 4.08 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 88 P 0.00 4.34 0.00 1.71 2.04 0.00 3.48 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 1.54 0.00 89 W 7.48 5.02 0.00 3.30 3.05 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 0.00 0.00 0.00 90 P 0.00 4.61 0.00 2.11 2.05 0.00 3.97 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.42 0.00 91 P 0.00 4.40 0.00 2.18 2.07 0.00 3.78 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 2.00 0.00 92 C 8.63 4.50 0.00 3.08 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 93 Q 8.17 4.65 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.85 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 94 Y 9.36 5.31 0.00 2.86 2.83 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 95 R 9.20 4.85 0.00 1.75 1.86 0.00 3.19 0.00 0.00 3.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 96 A 9.65 5.10 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 97 T 9.04 4.58 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 1.28 0.00 0.00 98 A 8.78 4.92 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 99 G 9.02 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 0.00 0.00 0.00 0.00 100 F 8.84 5.52 0.00 2.97 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 0.00 101 R 8.80 4.70 0.00 1.93 1.83 0.00 2.95 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 102 N 8.63 5.14 0.00 2.78 2.96 0.00 0.00 5.88 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 0.00 103 V 8.47 4.61 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 0.81 0.00 0.00 0.81 0.00 0.00 104 V 8.25 4.83 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 1.07 0.00 0.00 0.89 0.00 0.00 105 V 9.01 5.03 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 0.78 0.00 0.00 0.86 0.00 0.00 106 A 8.87 5.13 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 0.00 107 C 8.86 5.28 0.00 2.80 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 0.00 108 E 8.85 4.41 0.00 1.94 1.79 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 2.20 2.26 0.00 109 N 9.31 4.02 0.00 2.84 2.90 0.00 0.00 7.18 7.65 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 0.00 110 G 8.41 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 0.00 0.00 0.00 111 L 7.23 4.59 0.00 1.64 1.17 0.71 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 112 P 0.00 4.56 0.00 0.98 1.84 0.00 3.60 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 1.89 1.87 0.00 113 V 8.20 4.57 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 0.74 0.00 0.00 0.93 0.00 0.00 114 H 7.86 5.06 0.00 3.19 3.10 0.00 5.63 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.36 4.86 0.00 1.61 1.09 1.08 0.91 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 0.00 116 D 8.67 4.53 0.00 2.76 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 0.00 117 Q 8.85 4.42 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.66 0.00 0.00 0.00 0.00 0.00 2.44 2.30 0.00 118 S 8.32 4.14 0.00 3.96 4.13 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 0.00 119 I 7.56 3.52 1.52 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 -0.36 0.80 0.00 0.00 120 F 7.51 4.60 0.00 3.28 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 0.00 121 R 7.41 3.80 0.00 2.01 1.82 0.00 3.26 0.00 0.00 3.17 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 122 R 7.65 4.60 0.00 1.81 1.79 0.00 3.46 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 123 P 0.00 4.46 0.00 2.12 2.00 0.00 3.79 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 2.07 2.14 0.00